A0A087XRJ6_POEFO Loading...

Amyloid beta A4 precursor protein-binding family B member 1-interacting protein

AlphaFold DB , UniProt , Accession A0A087XRJ6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 658 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	57.4	Low	63.5	Low	196 Å²	196	116.3 Å²	116.3	97%	0.966	62%	0.62	S	S	*	*				0	-0.2	0	-85.5	164.2	162.6	0	0	111.7	I4	M1-I4 PolarHBondContact O-N 3.49Å
2	D	56.1	Low	64	Low	129 Å²	129	115.2 Å²	115.2	69%	0.69	61%	0.613	S	S	*	*	H	α-helix	trans	-90.1	-22.4	-149.8	-42.6	-106	0	0	0	111.9	I4 D5 A6	D2-I4 PolarHBondContact O-N 3.14Å; D2-D5 PolarHBondContact O-N 3.37Å; D2-A6 PolarHBondContact O-N 3.31Å; D2-A6 VanDerWaalsContact O-N 3.14Å
3	D	57.4	Low	64.5	Low	134 Å²	134	109.6 Å²	109.6	72%	0.717	60%	0.6	S	S	*	*	H	α-helix	trans	-62.8	-26.9	172.5	-55.8	-62.9	0	0	0	112.8	M7	D3-M7 WeakPolarHBondContact O-CG 3.37Å; D3-M7 PolarHBondContact O-N 2.99Å
4	I	62.9	Low	64.7	Low	102 Å²	102	111.4 Å²	111.4	52%	0.523	60%	0.602	S	S	.	*	H	α-helix	trans	-75.2	-45.1	178.8	-66.2	176.2	0	0	0	110.3	M1 D2 A6 M7 F8	M1-I4 PolarHBondContact O-N 3.49Å; D2-I4 PolarHBondContact O-N 3.14Å; I4-A6 VanDerWaalsContact C-N 3.27Å; I4-A6 PolarHBondContact O-N 2.99Å; I4-M7 PolarHBondContact O-N 3.19Å; I4-F8 HydrophobicContact CG2-CD2 3.76Å; I4-F8 HydrophobicContact CG2-CE2 3.79Å; I4-F8 WeakPolarHBondContact O-CD2 3.44Å; I4-F8 PolarHBondContact O-N 3.4Å
5	D	63.2	Low	64.2	Low	105 Å²	105	111.3 Å²	111.3	56%	0.561	60%	0.598	S	S	*	*	H	α-helix	trans	-67.6	-29.7	178.6	-66.4	-31.7	0	0	0	111.7	D2 S9	D2-D5 PolarHBondContact O-N 3.37Å; D5-S9 WeakPolarHBondContact O-CB 3.49Å; D5-S9 PolarHBondContact O-N 2.97Å; D5-S9 PolarHBondContact O-OG 3.11Å
6	A	68.1	Low	63.8	Low	50 Å²	50	109.8 Å²	109.8	41%	0.413	59%	0.59	S	S	.	*	H	α-helix	trans	-61.7	-52.5	168	0	0	0	0	0	111.7	D2 I4 F8 S9 D10	D2-A6 PolarHBondContact O-N 3.31Å; D2-A6 VanDerWaalsContact O-N 3.14Å; I4-A6 VanDerWaalsContact C-N 3.27Å; I4-A6 PolarHBondContact O-N 2.99Å; A6-F8 VanDerWaalsContact C-N 3.3Å; A6-F8 PolarHBondContact O-N 3.31Å; A6-S9 WeakPolarHBondContact O-CB 3.36Å; A6-S9 PolarHBondContact O-N 3.04Å; A6-D10 PolarHBondContact O-N 2.7Å
7	M	60.1	Low	63.4	Low	138 Å²	138	110.9 Å²	110.9	68%	0.68	59%	0.594	S	S	*	*	H	α-helix	trans	-59.4	-36.9	177.7	-73.4	173.8	55.4	0	0	113.4	D3 I4 L11	D3-M7 WeakPolarHBondContact O-CG 3.37Å; D3-M7 PolarHBondContact O-N 2.99Å; I4-M7 PolarHBondContact O-N 3.19Å; M7-L11 WeakPolarHBondContact O-CB 3.35Å; M7-L11 PolarHBondContact O-N 3.19Å
8	F	64.9	Low	62.7	Low	123 Å²	123	111.6 Å²	111.6	54%	0.539	60%	0.598	S	S	.	*	H	α-helix	trans	-70.4	-34.1	173.9	-87.2	-74.9	0	0	0	112.9	I4 A6 L12	I4-F8 HydrophobicContact CG2-CD2 3.76Å; I4-F8 HydrophobicContact CG2-CE2 3.79Å; I4-F8 WeakPolarHBondContact O-CD2 3.44Å; I4-F8 PolarHBondContact O-N 3.4Å; A6-F8 VanDerWaalsContact C-N 3.3Å; A6-F8 PolarHBondContact O-N 3.31Å; F8-L12 WeakPolarHBondContact O-CB 3.38Å; F8-L12 WeakPolarHBondContact O-CG 3.37Å; F8-L12 PolarHBondContact O-N 3.43Å
9	S	70.1	Confident	62.2	Low	75 Å²	75	110.3 Å²	110.3	52%	0.524	59%	0.594	S	S	.	*	H	α-helix	trans	-68.3	-44.2	177.6	-60.3	0	0	0	0	111.9	D5 A6 L12 G13	D5-S9 WeakPolarHBondContact O-CB 3.49Å; D5-S9 PolarHBondContact O-N 2.97Å; D5-S9 PolarHBondContact O-OG 3.11Å; A6-S9 WeakPolarHBondContact O-CB 3.36Å; A6-S9 PolarHBondContact O-N 3.04Å; S9-L12 PolarHBondContact O-N 3.4Å; S9-G13 PolarHBondContact O-N 3.43Å
10	D	70.8	Confident	61.6	Low	119 Å²	119	111.6 Å²	111.6	64%	0.636	60%	0.596	S	S	*	*	H	α-helix	trans	-64.7	-43.7	176.9	-71	-21.8	0	0	0	111.3	A6 L12 G13 E14	A6-D10 PolarHBondContact O-N 2.7Å; D10-L12 VanDerWaalsContact C-N 3.35Å; D10-L12 PolarHBondContact O-N 3.02Å; D10-G13 WeakPolarHBondContact O-CA 3.39Å; D10-G13 PolarHBondContact O-N 3.19Å; D10-G13 VanDerWaalsContact O-N 3.11Å; D10-E14 PolarHBondContact O-N 2.97Å
11	L	67.8	Low	61	Low	108 Å²	108	111.2 Å²	111.2	57%	0.565	60%	0.602	S	S	*	*	H	α-helix	trans	-64.5	-36	177.4	-176.8	63	0	0	0	112.9	M7 M15	M7-L11 WeakPolarHBondContact O-CB 3.35Å; M7-L11 PolarHBondContact O-N 3.19Å; L11-M15 WeakPolarHBondContact O-CB 3.44Å; L11-M15 PolarHBondContact O-N 3.07Å; L11-M15 VanDerWaalsContact O-N 3.11Å
12	L	69.3	Low	60.5	Low	103 Å²	103	109.5 Å²	109.5	54%	0.539	60%	0.596	S	S	.	*	H	α-helix	trans	-67.3	-37.8	171.6	-84.9	162.1	0	0	0	111.8	F8 S9 D10 M15 D16	F8-L12 WeakPolarHBondContact O-CB 3.38Å; F8-L12 WeakPolarHBondContact O-CG 3.37Å; F8-L12 PolarHBondContact O-N 3.43Å; S9-L12 PolarHBondContact O-N 3.4Å; D10-L12 VanDerWaalsContact C-N 3.35Å; D10-L12 PolarHBondContact O-N 3.02Å; L12-M15 HydrophobicContact CD2-CE 3.99Å; L12-M15 PolarHBondContact O-N 2.92Å; L12-D16 PolarHBondContact O-N 2.98Å
13	G	69.9	Low	60.1	Low	43 Å²	43	106.3 Å²	106.3	44%	0.443	59%	0.593	S	S	.	*	H	α-helix	trans	-63.2	-46.2	175	0	0	0	0	0	113.1	S9 D10 M15 D16 L17	S9-G13 PolarHBondContact O-N 3.43Å; D10-G13 WeakPolarHBondContact O-CA 3.39Å; D10-G13 PolarHBondContact O-N 3.19Å; D10-G13 VanDerWaalsContact O-N 3.11Å; G13-M15 VanDerWaalsContact C-N 3.35Å; G13-M15 PolarHBondContact O-N 2.86Å; G13-D16 PolarHBondContact O-N 2.75Å; G13-L17 WeakPolarHBondContact O-CB 3.37Å; G13-L17 PolarHBondContact O-N 3.48Å
14	E	68.1	Low	59	Low	134 Å²	134	109 Å²	109	63%	0.626	60%	0.602	S	S	*	*	H	α-helix	trans	-64.1	-38.7	175.5	-70	-168.8	164.5	0	0	112.1	D10 L17 L18	D10-E14 PolarHBondContact O-N 2.97Å; E14-L17 PolarHBondContact O-N 2.97Å; E14-L18 WeakPolarHBondContact O-CG 3.43Å; E14-L18 PolarHBondContact O-N 3.45Å
15	M	57.2	Low	57.5	Low	111 Å²	111	113 Å²	113	55%	0.547	62%	0.618	S	S	.	*	H	α-helix	trans	-69.6	-37.5	178.8	-169.8	172.6	65.9	0	0	113	L11 L12 G13 T19	L11-M15 WeakPolarHBondContact O-CB 3.44Å; L11-M15 PolarHBondContact O-N 3.07Å; L11-M15 VanDerWaalsContact O-N 3.11Å; L12-M15 HydrophobicContact CD2-CE 3.99Å; L12-M15 PolarHBondContact O-N 2.92Å; G13-M15 VanDerWaalsContact C-N 3.35Å; G13-M15 PolarHBondContact O-N 2.86Å; M15-T19 WeakPolarHBondContact O-CB 3.41Å; M15-T19 PolarHBondContact O-N 3.11Å; M15-T19 PolarHBondContact O-OG1 3.46Å
16	D	56.9	Low	56	Low	87 Å²	87	114.8 Å²	114.8	47%	0.465	63%	0.633	S	S	.	*	H	α-helix	trans	-70	-37.8	174.8	-165.2	60.5	0	0	0	111.6	L12 G13 L18 T19 Q20	L12-D16 PolarHBondContact O-N 2.98Å; G13-D16 PolarHBondContact O-N 2.75Å; D16-L18 PolarHBondContact O-N 3.5Å; D16-T19 WeakPolarHBondContact O-CB 3.47Å; D16-T19 PolarHBondContact O-N 3.11Å; D16-T19 VanDerWaalsContact O-N 3.11Å; D16-Q20 WeakPolarHBondContact O-CG 3.41Å; D16-Q20 PolarHBondContact O-N 3.01Å; D16-Q20 PolarHBondContact OD2-NE2 3.29Å
17	L	58.3	Low	54.3	Low	128 Å²	128	120.7 Å²	120.7	67%	0.67	65%	0.652	S	S	*	*	H	α-helix	trans	-63.4	-40.5	175.2	-161.4	73	0	0	0	112.2	G13 E14 S21	G13-L17 WeakPolarHBondContact O-CB 3.37Å; G13-L17 PolarHBondContact O-N 3.48Å; E14-L17 PolarHBondContact O-N 2.97Å; L17-S21 PolarHBondContact O-N 3.31Å; L17-S21 VanDerWaalsContact O-N 3.13Å
18	L	49.6	Very low	53.1	Low	124 Å²	124	119 Å²	119	65%	0.649	65%	0.652	S	S	*	*	H	α-helix	trans	-64.7	-38.2	171.1	-74.9	168.2	0	0	0	112.2	E14 D16 S21 L22	E14-L18 WeakPolarHBondContact O-CG 3.43Å; E14-L18 PolarHBondContact O-N 3.45Å; D16-L18 PolarHBondContact O-N 3.5Å; L18-S21 PolarHBondContact O-N 3.17Å; L18-L22 PolarHBondContact O-N 3.4Å
19	T	53.9	Low	51.5	Low	86 Å²	86	119.2 Å²	119.2	53%	0.528	67%	0.665	S	S	.	*	H	α-helix	trans	-67.2	-43.5	178.9	-58.7	0	0	0	0	111.6	M15 D16 S21 L22	M15-T19 WeakPolarHBondContact O-CB 3.41Å; M15-T19 PolarHBondContact O-N 3.11Å; M15-T19 PolarHBondContact O-OG1 3.46Å; D16-T19 WeakPolarHBondContact O-CB 3.47Å; D16-T19 PolarHBondContact O-N 3.11Å; D16-T19 VanDerWaalsContact O-N 3.11Å; T19-S21 VanDerWaalsContact C-N 3.33Å; T19-S21 PolarHBondContact O-N 3.13Å; T19-L22 PolarHBondContact O-N 3.47Å
20	Q	49.8	Very low	49.7	Very low	136 Å²	136	124.3 Å²	124.3	64%	0.636	68%	0.681	S	S	*	*	H	α-helix	trans	-65.5	-35	175.7	-67.5	-176.2	39.4	0	0	112	D16 L22 G23	D16-Q20 WeakPolarHBondContact O-CG 3.41Å; D16-Q20 PolarHBondContact O-N 3.01Å; D16-Q20 PolarHBondContact OD2-NE2 3.29Å; Q20-L22 PolarHBondContact O-N 3.38Å; Q20-G23 PolarHBondContact O-N 2.72Å
21	S	49.9	Very low	47.7	Very low	104 Å²	104	123.9 Å²	123.9	73%	0.727	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-8.4	175.1	-169	0	0	0	0	114.5	L17 L18 T19	L17-S21 PolarHBondContact O-N 3.31Å; L17-S21 VanDerWaalsContact O-N 3.13Å; L18-S21 PolarHBondContact O-N 3.17Å; T19-S21 VanDerWaalsContact C-N 3.33Å; T19-S21 PolarHBondContact O-N 3.13Å
22	L	45.8	Very low	45.9	Very low	161 Å²	161	126 Å²	126	84%	0.843	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	5.4	178.2	-138.2	75	0	0	0	113	L18 T19 Q20	L18-L22 PolarHBondContact O-N 3.4Å; T19-L22 PolarHBondContact O-N 3.47Å; Q20-L22 PolarHBondContact O-N 3.38Å
23	G	48.2	Very low	43.9	Very low	61 Å²	61	127.1 Å²	127.1	63%	0.629	71%	0.709	S	S	*	*			trans	-116.6	30.8	-158	0	0	0	0	0	117.3	Q20	Q20-G23 PolarHBondContact O-N 2.72Å
24	Q	34.5	Very low	41.8	Very low	190 Å²	190	129.5 Å²	129.5	89%	0.888	72%	0.719	S	S	*	*	S	Bend	trans	-138.4	127.3	172.8	-163.6	159.4	16.6	0	0	114.8
25	E	30.8	Very low	40	Very low	186 Å²	186	130.4 Å²	130.4	87%	0.869	73%	0.734	S	S	*	*			trans	76.9	88.8	174.2	-154.8	133.6	-125.2	0	0	117.1	E27	E25-E27 PolarHBondContact O-N 3.12Å
26	T	31.4	Very low	38.9	Very low	144 Å²	144	132.9 Å²	132.9	88%	0.883	74%	0.737	S	S	*	*			trans	-81.1	101.2	171	48.1	0	0	0	0	112.1
27	E	32.7	Very low	37.7	Very low	174 Å²	174	135.9 Å²	135.9	81%	0.813	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-72.7	162.5	150.8	-95.2	-153.3	102.6	0	0	111	E25	E25-E27 PolarHBondContact O-N 3.12Å
28	P	34.9	Very low	36.9	Very low	102 Å²	102	137.3 Å²	137.3	66%	0.662	75%	0.751	S	S	*	*	S	Bend	trans	-62.3	155.6	174.5	27.8	-35.7	0	0	0	111.5	E30	P28-E30 PolarHBondContact O-N 3.35Å; P28-E30 VanDerWaalsContact O-N 3.1Å
29	P	32.5	Very low	37	Very low	127 Å²	127	133.5 Å²	133.5	83%	0.825	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-60.8	116.9	-170.2	23.8	-34.6	0	0	0	112.3
30	E	30.8	Very low	37.5	Very low	183 Å²	183	131.5 Å²	131.5	86%	0.855	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-59.4	132.7	172	-167.8	175.7	-148.3	0	0	109.6	P28	P28-E30 PolarHBondContact O-N 3.35Å; P28-E30 VanDerWaalsContact O-N 3.1Å
31	P	30.5	Very low	38.5	Very low	109 Å²	109	128.2 Å²	128.2	71%	0.708	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-58.9	143.6	175.5	-23.4	33.8	0	0	0	111.2
32	L	28.3	Very low	39.5	Very low	152 Å²	152	123.7 Å²	123.7	80%	0.796	67%	0.669	S	S	*	*			trans	-43.1	140.1	173.3	-73	167.4	0	0	0	111.3	S34	L32-S34 VanDerWaalsContact C-N 3.25Å; L32-S34 PolarHBondContact O-N 3.1Å; L32-S34 PolarHBondContact O-OG 3.2Å
33	P	27.2	Very low	41.2	Very low	127 Å²	127	116.2 Å²	116.2	83%	0.825	63%	0.631	S	S	*	*			trans	-64.4	88.2	-176.5	26.8	-35.2	0	0	0	110.3	T35	P33-T35 PolarHBondContact O-N 3.37Å
34	S	27.6	Very low	42.4	Very low	93 Å²	93	115.4 Å²	115.4	65%	0.65	62%	0.622	S	S	*	*			trans	-60.8	129.1	174.6	-63.4	0	0	0	0	107.3	L32 R36	L32-S34 VanDerWaalsContact C-N 3.25Å; L32-S34 PolarHBondContact O-N 3.1Å; L32-S34 PolarHBondContact O-OG 3.2Å; S34-R36 PolarHBondContact O-N 3.36Å
35	T	29.7	Very low	44.4	Very low	153 Å²	153	108.3 Å²	108.3	94%	0.939	59%	0.588	S	S	*	*			trans	-71.6	38.4	164.5	39.8	0	0	0	0	111.5	P33 Q37	P33-T35 PolarHBondContact O-N 3.37Å; T35-Q37 VanDerWaalsContact C-N 3.3Å; T35-Q37 PolarHBondContact O-N 3.41Å
36	R	34.5	Very low	46.4	Very low	164 Å²	164	106.6 Å²	106.6	62%	0.619	59%	0.591	S	S	*	*			trans	-77.5	84.8	168.1	-156.5	178	-151.7	172.3	10.5	106.3	S34 E38 D643	S34-R36 PolarHBondContact O-N 3.36Å; R36-E38 PolarHBondContact O-N 2.81Å; R36-D643 IonicContact CZ-OD1 3.84Å; R36-D643 IonicContact NH1-OD1 2.98Å; R36-D643 IonicContact NH2-OD1 3.25Å; R36-D643 PolarHBondContact NH2-OD1 3.44Å
37	Q	31.6	Very low	47.8	Very low	150 Å²	150	101.3 Å²	101.3	70%	0.701	57%	0.565	S	S	*	*			trans	-47.2	131.8	149	-72.8	-178.6	-40.2	0	0	106.6	T35 I39	T35-Q37 VanDerWaalsContact C-N 3.3Å; T35-Q37 PolarHBondContact O-N 3.41Å; Q37-I39 HydrophobicContact CB-CG1 4.19Å; Q37-I39 PolarHBondContact O-N 3.1Å
38	E	41.2	Very low	49.6	Very low	157 Å²	157	95.1 Å²	95.1	73%	0.734	54%	0.537	S	S	*	.			trans	-69.4	75.4	170.8	-72.8	-163.9	175.7	0	0	108.8	R36 N40 R243	R36-E38 PolarHBondContact O-N 2.81Å; E38-N40 PolarHBondContact O-N 3.27Å; E38-R243 IonicContact OE2-CZ 3.87Å; E38-R243 IonicContact OE2-NH1 2.86Å; E38-R243 PolarHBondContact OE2-NH1 2.93Å
39	I	51.1	Low	50.7	Low	45 Å²	45	93.2 Å²	93.2	23%	0.231	52%	0.521	C	S	.	.			trans	-61.8	123	174.1	-66.4	167.7	0	0	0	106.6	Q37 F41 K170 L239	Q37-I39 HydrophobicContact CB-CG1 4.19Å; Q37-I39 PolarHBondContact O-N 3.1Å; I39-F41 VanDerWaalsContact C-N 3.33Å; I39-F41 HydrophobicContact CB-CD2 4.31Å; I39-F41 HydrophobicContact CB-CE1 4.23Å; I39-F41 HydrophobicContact CB-CE2 3.85Å; I39-F41 HydrophobicContact CB-CZ 3.81Å; I39-F41 HydrophobicContact CD1-CZ 4.3Å; I39-F41 HydrophobicContact CG2-CD1 3.99Å; I39-F41 HydrophobicContact CG2-CD2 4.36Å; I39-F41 HydrophobicContact CG2-CE1 3.83Å; I39-F41 HydrophobicContact CG2-CE2 4.21Å; I39-F41 HydrophobicContact CG2-CG 4.25Å; I39-F41 HydrophobicContact CG2-CZ 3.95Å; I39-F41 WeakPolarHBondContact O-CD2 3.3Å; I39-F41 WeakPolarHBondContact O-CE2 3.4Å; I39-F41 PolarHBondContact O-N 3.49Å; I39-K170 HydrophobicContact CD1-CD 4.04Å; I39-K170 HydrophobicContact CD1-CG 4.48Å; I39-L239 HydrophobicContact CG2-CD2 3.99Å
40	N	64.1	Low	52.3	Low	43 Å²	43	88.8 Å²	88.8	23%	0.23	50%	0.495	C	S	.	.			trans	-76.7	87.3	178.4	-168.4	22.3	0	0	0	109.3	E38 S42 L172	E38-N40 PolarHBondContact O-N 3.27Å; N40-S42 PolarHBondContact ND2-O 2.92Å; N40-S42 PolarHBondContact O-N 3.27Å; N40-S42 VanDerWaalsContact O-N 3.13Å; N40-S42 PolarHBondContact OD1-O 3.47Å; N40-L172 WeakPolarHBondContact O-CD1 3.46Å
41	F	70.4	Confident	54.4	Low	67 Å²	67	80 Å²	80	29%	0.294	45%	0.454	S	S	.	.			trans	-69.6	-1.5	-174.8	-67.4	-79	0	0	0	114.8	I39 L48 V173	I39-F41 VanDerWaalsContact C-N 3.33Å; I39-F41 HydrophobicContact CB-CD2 4.31Å; I39-F41 HydrophobicContact CB-CE1 4.23Å; I39-F41 HydrophobicContact CB-CE2 3.85Å; I39-F41 HydrophobicContact CB-CZ 3.81Å; I39-F41 HydrophobicContact CD1-CZ 4.3Å; I39-F41 HydrophobicContact CG2-CD1 3.99Å; I39-F41 HydrophobicContact CG2-CD2 4.36Å; I39-F41 HydrophobicContact CG2-CE1 3.83Å; I39-F41 HydrophobicContact CG2-CE2 4.21Å; I39-F41 HydrophobicContact CG2-CG 4.25Å; I39-F41 HydrophobicContact CG2-CZ 3.95Å; I39-F41 WeakPolarHBondContact O-CD2 3.3Å; I39-F41 WeakPolarHBondContact O-CE2 3.4Å; I39-F41 PolarHBondContact O-N 3.49Å; F41-L48 HydrophobicContact CB-CD1 4.25Å; F41-L48 HydrophobicContact CB-CD2 3.55Å; F41-L48 HydrophobicContact CB-CG 4.47Å; F41-V173 PolarHBondContact O-N 2.88Å
42	S	72.4	Confident	56.3	Low	9 Å²	9	74.9 Å²	74.9	6%	0.063	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	136.1	179.8	166.3	0	0	0	0	111.9	N40 S51 V173	N40-S42 PolarHBondContact ND2-O 2.92Å; N40-S42 PolarHBondContact O-N 3.27Å; N40-S42 VanDerWaalsContact O-N 3.13Å; N40-S42 PolarHBondContact OD1-O 3.47Å; S42-S51 WeakPolarHBondContact CB-OG 3.38Å; S42-S51 VanDerWaalsContact OG-CB 3.24Å; S42-S51 WeakPolarHBondContact OG-CB 3.25Å; S42-S51 PolarHBondContact OG-OG 2.85Å; S42-V173 CarbonylContact C-O 3.54Å; S42-V173 WeakPolarHBondContact CA-O 3.01Å
43	V	80.9	Confident	58.3	Low	5 Å²	5	71.7 Å²	71.7	3%	0.03	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	129.1	-178.5	159.3	0	0	0	0	111.1	F45 L172 V173 K175 L238 W241	V43-F45 WeakPolarHBondContact O-CD2 3.49Å; V43-L172 HydrophobicContact CB-CD1 4.34Å; V43-L172 HydrophobicContact CG2-CD1 3.99Å; V43-L172 HydrophobicContact CG2-CD2 4.27Å; V43-V173 PolarHBondContact N-O 3.08Å; V43-K175 PolarHBondContact O-N 2.95Å; V43-L238 HydrophobicContact CG1-CD1 4.42Å; V43-L238 HydrophobicContact CG1-CD2 4.35Å; V43-L238 HydrophobicContact CG2-CB 4.36Å; V43-W241 HydrophobicContact CG1-CE3 3.7Å; V43-W241 HydrophobicContact CG1-CH2 4.37Å; V43-W241 HydrophobicContact CG1-CZ3 3.44Å; V43-W241 VanDerWaalsContact CG1-CZ3 3.44Å
44	G	74.3	Confident	60.5	Low	43 Å²	43	69.2 Å²	69.2	44%	0.443	38%	0.382	S	S	.	.	S	Bend	trans	88.4	14	-177.6	0	0	0	0	0	115.2	K175	G44-K175 VanDerWaalsContact O-CD 3.25Å; G44-K175 WeakPolarHBondContact O-CD 3.4Å
45	F	74.6	Confident	62.9	Low	42 Å²	42	65 Å²	65	18%	0.184	35%	0.351	C	S	.	.	S	Bend	trans	-129.9	161	-179.1	-66.4	-88.1	0	0	0	112.2	V43 G47 A50 S51 D54 V173 K175 T185	V43-F45 WeakPolarHBondContact O-CD2 3.49Å; F45-G47 VanDerWaalsContact C-N 3.31Å; F45-A50 HydrophobicContact CD1-CB 4.5Å; F45-S51 WeakPolarHBondContact CD2-OG 3.33Å; F45-S51 VanDerWaalsContact CE2-OG 3.24Å; F45-S51 WeakPolarHBondContact CE2-OG 3.37Å; F45-D54 HydrophobicContact CE1-CB 3.52Å; F45-D54 WeakPolarHBondContact CE1-OD2 3.48Å; F45-D54 HydrophobicContact CZ-CB 3.81Å; F45-V173 HydrophobicContact CE2-CG1 4.45Å; F45-K175 HydrophobicContact CD1-CD 4.41Å; F45-K175 HydrophobicContact CD2-CB 4.11Å; F45-K175 HydrophobicContact CE1-CD 3.96Å; F45-K175 HydrophobicContact CE1-CG 4.45Å; F45-K175 HydrophobicContact CE2-CB 3.53Å; F45-K175 HydrophobicContact CE2-CD 4.13Å; F45-K175 HydrophobicContact CE2-CG 3.96Å; F45-K175 HydrophobicContact CZ-CB 3.92Å; F45-K175 HydrophobicContact CZ-CD 3.8Å; F45-K175 HydrophobicContact CZ-CG 3.8Å; F45-T185 HydrophobicContact CE2-CG2 3.82Å; F45-T185 HydrophobicContact CZ-CG2 3.52Å
46	T	74.1	Confident	65.1	Low	150 Å²	150	60.6 Å²	60.6	92%	0.92	32%	0.32	S	S	*	.	S	Bend	trans	-78.9	-8.5	175.4	50	0	0	0	0	114.3
47	G	61.4	Low	66.8	Low	33 Å²	33	57.4 Å²	57.4	34%	0.34	32%	0.316	S	S	.	.	S	Bend	trans	172.4	167.4	179.4	0	0	0	0	0	112.6	F45 A50 S51	F45-G47 VanDerWaalsContact C-N 3.31Å; G47-A50 PolarHBondContact O-N 2.92Å; G47-S51 PolarHBondContact O-N 3.22Å; G47-S51 VanDerWaalsContact O-N 3.15Å
48	L	68.6	Low	68.7	Low	43 Å²	43	56.4 Å²	56.4	23%	0.225	32%	0.315	C	S	.	.	H	α-helix	trans	-64.6	-49.6	-173.4	-80.2	163.3	0	0	0	113.1	F41 A50 S51 L52 E647	F41-L48 HydrophobicContact CB-CD1 4.25Å; F41-L48 HydrophobicContact CB-CD2 3.55Å; F41-L48 HydrophobicContact CB-CG 4.47Å; L48-A50 PolarHBondContact O-N 3.32Å; L48-A50 VanDerWaalsContact O-N 3.15Å; L48-S51 CarbonylContact O-C 3.59Å; L48-S51 WeakPolarHBondContact O-CA 3.42Å; L48-S51 WeakPolarHBondContact O-CB 3.38Å; L48-S51 PolarHBondContact O-N 2.78Å; L48-L52 PolarHBondContact O-N 2.82Å; L48-E647 WeakPolarHBondContact CB-OE2 3.34Å
49	N	59	Low	70.3	Confident	63 Å²	63	50.1 Å²	50.1	34%	0.337	29%	0.286	S	S	.	.	H	α-helix	trans	-54.2	-32.3	174.3	170.9	82.7	0	0	0	113.7	H53 E647	N49-H53 WeakPolarHBondContact O-CB 3.25Å; N49-H53 PolarHBondContact O-N 2.95Å; N49-E647 WeakPolarHBondContact CA-OE2 3.18Å; N49-E647 HydrophobicContact CB-CB 4.23Å; N49-E647 HydrophobicContact CB-CG 4.33Å; N49-E647 WeakPolarHBondContact CB-OE2 3.42Å; N49-E647 PolarHBondContact N-OE2 2.93Å
50	A	66.9	Low	71.4	Confident	33 Å²	33	48 Å²	48	27%	0.273	28%	0.276	S	S	.	.	H	α-helix	trans	-73	-39.3	173.8	0	0	0	0	0	111.8	F45 G47 L48 H53 D54	F45-A50 HydrophobicContact CD1-CB 4.5Å; G47-A50 PolarHBondContact O-N 2.92Å; L48-A50 PolarHBondContact O-N 3.32Å; L48-A50 VanDerWaalsContact O-N 3.15Å; A50-H53 PolarHBondContact O-N 2.98Å; A50-D54 PolarHBondContact O-N 3.36Å
51	S	73.8	Confident	71.9	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.6	-47.8	175	-143.1	0	0	0	0	112.4	S42 F45 G47 L48 H53 D54 L55 V173	S42-S51 WeakPolarHBondContact CB-OG 3.38Å; S42-S51 VanDerWaalsContact OG-CB 3.24Å; S42-S51 WeakPolarHBondContact OG-CB 3.25Å; S42-S51 PolarHBondContact OG-OG 2.85Å; F45-S51 WeakPolarHBondContact CD2-OG 3.33Å; F45-S51 VanDerWaalsContact CE2-OG 3.24Å; F45-S51 WeakPolarHBondContact CE2-OG 3.37Å; G47-S51 PolarHBondContact O-N 3.22Å; G47-S51 VanDerWaalsContact O-N 3.15Å; L48-S51 CarbonylContact O-C 3.59Å; L48-S51 WeakPolarHBondContact O-CA 3.42Å; L48-S51 WeakPolarHBondContact O-CB 3.38Å; L48-S51 PolarHBondContact O-N 2.78Å; S51-H53 VanDerWaalsContact C-N 3.33Å; S51-H53 PolarHBondContact O-N 2.67Å; S51-D54 PolarHBondContact O-N 3.33Å; S51-L55 PolarHBondContact O-N 2.76Å; S51-V173 VanDerWaalsContact OG-CB 3.27Å; S51-V173 WeakPolarHBondContact OG-CB 3.3Å; S51-V173 WeakPolarHBondContact OG-CG1 2.99Å
52	L	70.1	Confident	72.2	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67.1	-31.9	178.5	-64.4	174.7	0	0	0	112.5	L48 D54 L55 L63 V173 F644 E647 L648 A651	L48-L52 PolarHBondContact O-N 2.82Å; L52-D54 VanDerWaalsContact C-N 3.28Å; L52-D54 PolarHBondContact O-N 3.45Å; L52-L55 HydrophobicContact CD2-CD1 4.02Å; L52-L63 HydrophobicContact CD2-CD2 3.89Å; L52-V173 HydrophobicContact CD2-CG2 4.43Å; L52-F644 HydrophobicContact CD1-CE2 4.41Å; L52-F644 HydrophobicContact CD2-CE2 4.45Å; L52-E647 HydrophobicContact CD1-CB 4.45Å; L52-L648 HydrophobicContact CD1-CB 4.05Å; L52-L648 HydrophobicContact CD1-CD1 4.22Å; L52-L648 HydrophobicContact CD2-CD1 4.27Å; L52-A651 HydrophobicContact CB-CB 4.32Å
53	H	71.4	Confident	72.2	Confident	86 Å²	86	49.2 Å²	49.2	40%	0.398	29%	0.29	S	S	.	.	H	α-helix	trans	-73.3	-19.5	175.2	-165.3	-68.8	0	0	0	113.1	N49 A50 S51 R655	N49-H53 WeakPolarHBondContact O-CB 3.25Å; N49-H53 PolarHBondContact O-N 2.95Å; A50-H53 PolarHBondContact O-N 2.98Å; S51-H53 VanDerWaalsContact C-N 3.33Å; S51-H53 PolarHBondContact O-N 2.67Å; H53-R655 PolarHBondContact O-NH2 3.28Å
54	D	72.9	Confident	71.6	Confident	75 Å²	75	51 Å²	51	40%	0.401	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-0.3	-179.2	-110	35.7	0	0	0	113.4	F45 A50 S51 L52 K175 T185	F45-D54 HydrophobicContact CE1-CB 3.52Å; F45-D54 WeakPolarHBondContact CE1-OD2 3.48Å; F45-D54 HydrophobicContact CZ-CB 3.81Å; A50-D54 PolarHBondContact O-N 3.36Å; S51-D54 PolarHBondContact O-N 3.33Å; L52-D54 VanDerWaalsContact C-N 3.28Å; L52-D54 PolarHBondContact O-N 3.45Å; D54-K175 IonicContact OD2-NZ 2.64Å; D54-K175 PolarHBondContact OD2-NZ 2.95Å; D54-T185 HydrophobicContact CB-CG2 4.31Å; D54-T185 WeakPolarHBondContact O-CB 3.49Å; D54-T185 PolarHBondContact O-OG1 2.58Å
55	L	77.1	Confident	71.5	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.016	30%	0.302	C	S	.	.	S	Bend	trans	-76.1	143.7	173.7	-82.7	170.5	0	0	0	112.5	S51 L52 D59 V173 T185 M187 R655	S51-L55 PolarHBondContact O-N 2.76Å; L52-L55 HydrophobicContact CD2-CD1 4.02Å; L55-D59 HydrophobicContact CD2-CB 4.12Å; L55-V173 HydrophobicContact CD1-CG1 4.18Å; L55-V173 HydrophobicContact CD1-CG2 4.13Å; L55-V173 HydrophobicContact CD2-CG1 4.03Å; L55-V173 HydrophobicContact CG-CG1 3.99Å; L55-T185 HydrophobicContact CD2-CG2 3.87Å; L55-T185 HydrophobicContact CG-CG2 4Å; L55-M187 HydrophobicContact CD2-CB 4.43Å; L55-R655 PolarHBondContact O-NH1 3.43Å; L55-R655 PolarHBondContact O-NH2 3.09Å
56	E	76.1	Confident	71.3	Confident	62 Å²	62	52.2 Å²	52.2	29%	0.29	31%	0.306	S	S	.	.			trans	-67.5	143.4	171.1	-63.2	177.7	-174.2	0	0	110.2	N58 D59 L60 K184 K204	E56-N58 VanDerWaalsContact C-N 3.31Å; E56-N58 PolarHBondContact O-N 3.42Å; E56-D59 WeakPolarHBondContact O-CB 3.28Å; E56-D59 PolarHBondContact O-N 3.08Å; E56-L60 PolarHBondContact O-N 3.1Å; E56-L60 VanDerWaalsContact O-N 3.16Å; E56-K184 IonicContact OE1-NZ 3.38Å; E56-K184 PolarHBondContact OE1-NZ 2.92Å; E56-K204 IonicContact OE2-NZ 3.69Å; E56-K204 PolarHBondContact OE2-NZ 2.88Å
57	D	71.6	Confident	71	Confident	97 Å²	97	46.4 Å²	46.4	52%	0.519	27%	0.269	S	S	.	.	H	α-helix	trans	-57.7	-39	-170.4	-61.2	-65.8	0	0	0	113.6	D59 L60 D61 R655	D57-D59 VanDerWaalsContact C-N 3.26Å; D57-D59 PolarHBondContact O-N 3.33Å; D57-L60 WeakPolarHBondContact O-CB 3.49Å; D57-L60 PolarHBondContact O-N 3.34Å; D57-L60 VanDerWaalsContact O-N 3.14Å; D57-D61 WeakPolarHBondContact O-CB 3.4Å; D57-D61 PolarHBondContact O-N 3.48Å; D57-R655 IonicContact OD1-CZ 2.6Å; D57-R655 IonicContact OD1-NE 3.68Å; D57-R655 IonicContact OD1-NH1 2.74Å; D57-R655 PolarHBondContact OD1-NH1 3.43Å
58	N	70.6	Confident	71.3	Confident	128 Å²	128	49 Å²	49	68%	0.684	28%	0.278	S	S	*	.	H	α-helix	trans	-59	-35.4	175.6	-64	-21.7	0	0	0	113	E56 A62	E56-N58 VanDerWaalsContact C-N 3.31Å; E56-N58 PolarHBondContact O-N 3.42Å; N58-A62 WeakPolarHBondContact O-CB 3.39Å; N58-A62 PolarHBondContact O-N 2.88Å; N58-A62 VanDerWaalsContact O-N 3.12Å
59	D	74.8	Confident	71.4	Confident	25 Å²	25	47.8 Å²	47.8	13%	0.134	27%	0.274	C	S	.	.	H	α-helix	trans	-77.3	-32.1	-179.7	-55.6	-13.1	0	0	0	110.5	L55 E56 D57 L63 K204	L55-D59 HydrophobicContact CD2-CB 4.12Å; E56-D59 WeakPolarHBondContact O-CB 3.28Å; E56-D59 PolarHBondContact O-N 3.08Å; D57-D59 VanDerWaalsContact C-N 3.26Å; D57-D59 PolarHBondContact O-N 3.33Å; D59-L63 PolarHBondContact O-N 2.66Å; D59-L63 VanDerWaalsContact O-N 3.1Å; D59-K204 IonicContact OD1-NZ 2.87Å; D59-K204 PolarHBondContact OD1-NZ 3.32Å; D59-K204 IonicContact OD2-NZ 3.88Å; D59-K204 PolarHBondContact OD2-NZ 3.28Å
60	L	75.5	Confident	71.5	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-71.3	-42.4	174.8	-173.9	66.2	0	0	0	111.6	E56 D57 A62 L63 M64 L648 M652	E56-L60 PolarHBondContact O-N 3.1Å; E56-L60 VanDerWaalsContact O-N 3.16Å; D57-L60 WeakPolarHBondContact O-CB 3.49Å; D57-L60 PolarHBondContact O-N 3.34Å; D57-L60 VanDerWaalsContact O-N 3.14Å; L60-A62 VanDerWaalsContact C-N 3.33Å; L60-L63 WeakPolarHBondContact O-CB 3.39Å; L60-L63 PolarHBondContact O-N 3.2Å; L60-M64 WeakPolarHBondContact O-CG 3.39Å; L60-M64 PolarHBondContact O-N 3.06Å; L60-L648 HydrophobicContact CD1-CD1 3.55Å; L60-M652 HydrophobicContact CD2-CE 4.21Å
61	D	73.6	Confident	71.2	Confident	93 Å²	93	49 Å²	49	50%	0.497	28%	0.276	S	S	.	.	H	α-helix	trans	-64	-38.1	174.4	-79.4	-13.9	0	0	0	111.5	D57 M64 A65	D57-D61 WeakPolarHBondContact O-CB 3.4Å; D57-D61 PolarHBondContact O-N 3.48Å; D61-M64 PolarHBondContact O-N 3.3Å; D61-A65 WeakPolarHBondContact O-CB 3.44Å; D61-A65 PolarHBondContact O-N 2.86Å
62	A	75.9	Confident	70.9	Confident	42 Å²	42	50.8 Å²	50.8	35%	0.347	29%	0.288	S	S	.	.	H	α-helix	trans	-62.8	-45.6	172.4	0	0	0	0	0	111.9	N58 L60 M64 A65 D66 M187	N58-A62 WeakPolarHBondContact O-CB 3.39Å; N58-A62 PolarHBondContact O-N 2.88Å; N58-A62 VanDerWaalsContact O-N 3.12Å; L60-A62 VanDerWaalsContact C-N 3.33Å; A62-M64 VanDerWaalsContact C-N 3.29Å; A62-M64 PolarHBondContact O-N 3.06Å; A62-A65 PolarHBondContact O-N 3.35Å; A62-D66 PolarHBondContact O-N 3.33Å; A62-M187 HydrophobicContact CB-CE 4.32Å
63	L	73.1	Confident	70.7	Confident	10 Å²	10	52.6 Å²	52.6	5%	0.052	30%	0.297	C	S	.	.	H	α-helix	trans	-58.2	-41.9	174.5	175	59.2	0	0	0	111.8	L52 D59 L60 L67 M187 F644 L648	L52-L63 HydrophobicContact CD2-CD2 3.89Å; D59-L63 PolarHBondContact O-N 2.66Å; D59-L63 VanDerWaalsContact O-N 3.1Å; L60-L63 WeakPolarHBondContact O-CB 3.39Å; L60-L63 PolarHBondContact O-N 3.2Å; L63-L67 WeakPolarHBondContact O-CB 3.36Å; L63-L67 PolarHBondContact O-N 3.11Å; L63-M187 HydrophobicContact CB-CE 3.93Å; L63-M187 HydrophobicContact CB-SD 3.8Å; L63-M187 HydrophobicContact CD1-SD 3.82Å; L63-M187 HydrophobicContact CD2-SD 4.45Å; L63-M187 HydrophobicContact CG-SD 4.22Å; L63-F644 HydrophobicContact CD1-CE1 4.44Å; L63-F644 HydrophobicContact CD1-CZ 4.31Å; L63-F644 HydrophobicContact CD2-CZ 4.12Å; L63-L648 HydrophobicContact CD2-CD1 3.87Å; L63-L648 HydrophobicContact CD2-CD2 4.16Å; L63-L648 HydrophobicContact CG-CD2 4.2Å
64	M	67.9	Low	70.1	Confident	41 Å²	41	52.5 Å²	52.5	20%	0.202	30%	0.302	C	S	.	.	H	α-helix	trans	-67.5	-40.8	176.6	-73.3	-64.5	-61.9	0	0	112.6	L60 D61 A62 L67 V68 L648 M652	L60-M64 WeakPolarHBondContact O-CG 3.39Å; L60-M64 PolarHBondContact O-N 3.06Å; D61-M64 PolarHBondContact O-N 3.3Å; A62-M64 VanDerWaalsContact C-N 3.29Å; A62-M64 PolarHBondContact O-N 3.06Å; M64-L67 PolarHBondContact O-N 3.08Å; M64-V68 WeakPolarHBondContact O-CB 3.36Å; M64-V68 VanDerWaalsContact O-CG2 3.27Å; M64-V68 WeakPolarHBondContact O-CG2 3.34Å; M64-V68 PolarHBondContact O-N 3.46Å; M64-L648 HydrophobicContact SD-CD1 4.22Å; M64-L648 HydrophobicContact SD-CD2 3.7Å; M64-L648 HydrophobicContact SD-CG 3.79Å; M64-M652 HydrophobicContact CE-SD 4.03Å; M64-M652 HydrophobicContact CG-SD 3.77Å; M64-M652 HydrophobicContact SD-CG 4.34Å; M64-M652 HydrophobicContact SD-SD 4.02Å
65	A	73.7	Confident	69.8	Low	62 Å²	62	54.7 Å²	54.7	51%	0.512	31%	0.31	S	S	.	.	H	α-helix	trans	-64.4	-42.4	178.6	0	0	0	0	0	112.3	D61 A62 A69	D61-A65 WeakPolarHBondContact O-CB 3.44Å; D61-A65 PolarHBondContact O-N 2.86Å; A62-A65 PolarHBondContact O-N 3.35Å; A65-A69 PolarHBondContact O-N 3.2Å; A65-A69 VanDerWaalsContact O-N 3.07Å
66	D	69.6	Low	69.5	Low	50 Å²	50	60.2 Å²	60.2	27%	0.267	33%	0.334	S	S	.	.	H	α-helix	trans	-64.2	-48.7	175	-69.8	-15.7	0	0	0	110.8	A62 V68 A69 D70 K171	A62-D66 PolarHBondContact O-N 3.33Å; D66-V68 VanDerWaalsContact C-N 3.32Å; D66-V68 PolarHBondContact O-N 2.83Å; D66-A69 WeakPolarHBondContact O-CA 3.38Å; D66-A69 VanDerWaalsContact O-CB 3.29Å; D66-A69 WeakPolarHBondContact O-CB 3.47Å; D66-A69 PolarHBondContact O-N 3.13Å; D66-D70 PolarHBondContact O-N 3.21Å; D66-K171 IonicContact OD2-NZ 2.74Å; D66-K171 PolarHBondContact OD2-NZ 3.01Å
67	L	67.1	Low	68.9	Low	28 Å²	28	63.9 Å²	63.9	15%	0.147	35%	0.349	C	S	.	.	H	α-helix	trans	-62.3	-36	180	177.1	62.9	0	0	0	113.4	L63 M64 A69 D70 L71 M645 L648	L63-L67 WeakPolarHBondContact O-CB 3.36Å; L63-L67 PolarHBondContact O-N 3.11Å; M64-L67 PolarHBondContact O-N 3.08Å; L67-A69 VanDerWaalsContact C-N 3.35Å; L67-D70 PolarHBondContact O-N 2.95Å; L67-L71 WeakPolarHBondContact O-CG 3.33Å; L67-L71 PolarHBondContact O-N 3.49Å; L67-M645 HydrophobicContact CD1-CE 4.11Å; L67-M645 HydrophobicContact CD1-SD 3.56Å; L67-M645 VanDerWaalsContact CD1-SD 3.56Å; L67-M645 HydrophobicContact CD2-CE 3.83Å; L67-M645 HydrophobicContact CD2-SD 3.65Å; L67-M645 HydrophobicContact CG-CE 4.19Å; L67-M645 HydrophobicContact CG-SD 4.09Å; L67-L648 HydrophobicContact CD2-CD2 3.49Å; L67-L648 VanDerWaalsContact CD2-CD2 3.49Å
68	V	68.3	Low	68.4	Low	87 Å²	87	64.1 Å²	64.1	53%	0.527	35%	0.35	S	S	.	.	H	α-helix	trans	-69.5	-34	172.9	168.2	0	0	0	0	111.1	M64 D66 S72	M64-V68 WeakPolarHBondContact O-CB 3.36Å; M64-V68 VanDerWaalsContact O-CG2 3.27Å; M64-V68 WeakPolarHBondContact O-CG2 3.34Å; M64-V68 PolarHBondContact O-N 3.46Å; D66-V68 VanDerWaalsContact C-N 3.32Å; D66-V68 PolarHBondContact O-N 2.83Å; V68-S72 WeakPolarHBondContact O-CB 3.38Å; V68-S72 PolarHBondContact O-N 2.92Å
69	A	70	Confident	68.4	Low	18 Å²	18	63.2 Å²	63.2	15%	0.149	34%	0.341	C	S	.	.	H	α-helix	trans	-63.7	-49.1	171.8	0	0	0	0	0	110.9	A65 D66 L67 L71 S72 E73	A65-A69 PolarHBondContact O-N 3.2Å; A65-A69 VanDerWaalsContact O-N 3.07Å; D66-A69 WeakPolarHBondContact O-CA 3.38Å; D66-A69 VanDerWaalsContact O-CB 3.29Å; D66-A69 WeakPolarHBondContact O-CB 3.47Å; D66-A69 PolarHBondContact O-N 3.13Å; L67-A69 VanDerWaalsContact C-N 3.35Å; A69-L71 PolarHBondContact O-N 3.3Å; A69-S72 PolarHBondContact O-N 3.11Å; A69-S72 PolarHBondContact O-OG 3.06Å; A69-E73 PolarHBondContact O-N 2.84Å
70	D	61.3	Low	68.2	Low	42 Å²	42	65 Å²	65	23%	0.225	36%	0.359	C	S	.	.	H	α-helix	trans	-56.6	-49.5	178	-65.4	-5.9	0	0	0	111.6	D66 L67 S72 E73 T74 A167	D66-D70 PolarHBondContact O-N 3.21Å; L67-D70 PolarHBondContact O-N 2.95Å; D70-S72 PolarHBondContact O-N 2.7Å; D70-E73 WeakPolarHBondContact O-CB 3.5Å; D70-E73 PolarHBondContact O-N 3.38Å; D70-E73 VanDerWaalsContact O-N 3.08Å; D70-T74 PolarHBondContact O-N 2.94Å; D70-A167 HydrophobicContact CB-CB 4.36Å; D70-A167 WeakPolarHBondContact OD1-CA 3.44Å; D70-A167 WeakPolarHBondContact OD1-CB 3.37Å
71	L	61.6	Low	67.5	Low	79 Å²	79	70.2 Å²	70.2	41%	0.414	38%	0.383	S	S	.	.	H	α-helix	trans	-57.3	-50.2	175.4	-76.3	171.6	0	0	0	111.2	L67 A69 E73 T74 E75 M645	L67-L71 WeakPolarHBondContact O-CG 3.33Å; L67-L71 PolarHBondContact O-N 3.49Å; A69-L71 PolarHBondContact O-N 3.3Å; L71-E73 PolarHBondContact O-N 2.89Å; L71-E73 VanDerWaalsContact O-N 3.11Å; L71-T74 PolarHBondContact O-N 3.2Å; L71-T74 VanDerWaalsContact O-N 3.08Å; L71-T74 PolarHBondContact O-OG1 3.21Å; L71-E75 WeakPolarHBondContact O-CG 3.35Å; L71-E75 PolarHBondContact O-N 3.33Å; L71-M645 HydrophobicContact CD1-CE 4.03Å
72	S	66.6	Low	67.1	Low	38 Å²	38	69.9 Å²	69.9	27%	0.266	38%	0.381	S	S	.	.	H	α-helix	trans	-62.2	-22.3	178.6	88.7	0	0	0	0	113.1	V68 A69 D70 K76	V68-S72 WeakPolarHBondContact O-CB 3.38Å; V68-S72 PolarHBondContact O-N 2.92Å; A69-S72 PolarHBondContact O-N 3.11Å; A69-S72 PolarHBondContact O-OG 3.06Å; D70-S72 PolarHBondContact O-N 2.7Å; S72-K76 VanDerWaalsContact O-CG 3.28Å; S72-K76 WeakPolarHBondContact O-CG 3.23Å; S72-K76 PolarHBondContact O-N 3.29Å; S72-K76 PolarHBondContact O-NZ 3.42Å; S72-K76 PolarHBondContact OG-NZ 3.09Å; S72-K76 VanDerWaalsContact OG-NZ 3.11Å
73	E	67.1	Low	66.3	Low	38 Å²	38	74.7 Å²	74.7	18%	0.178	40%	0.396	C	S	.	.	H	α-helix	trans	-81.8	-41.1	175.6	-165.1	-175	102	0	0	111.3	A69 D70 L71 E75 K76 K77 L164	A69-E73 PolarHBondContact O-N 2.84Å; D70-E73 WeakPolarHBondContact O-CB 3.5Å; D70-E73 PolarHBondContact O-N 3.38Å; D70-E73 VanDerWaalsContact O-N 3.08Å; L71-E73 PolarHBondContact O-N 2.89Å; L71-E73 VanDerWaalsContact O-N 3.11Å; E73-E75 VanDerWaalsContact C-N 3.31Å; E73-E75 PolarHBondContact O-N 2.74Å; E73-K76 PolarHBondContact O-N 3.28Å; E73-K77 WeakPolarHBondContact O-CB 3.25Å; E73-K77 PolarHBondContact O-N 3.43Å; E73-L164 HydrophobicContact CG-CD1 4.3Å; E73-L164 WeakPolarHBondContact OE1-CA 3.45Å; E73-L164 WeakPolarHBondContact OE1-CD1 3.41Å; E73-L164 WeakPolarHBondContact OE1-CD2 3.34Å; E73-L164 PolarHBondContact OE2-N 2.86Å
74	T	57.9	Low	65.2	Low	84 Å²	84	77 Å²	77	52%	0.515	42%	0.422	S	S	.	.	H	α-helix	trans	-62.1	-37.9	172.3	62.4	0	0	0	0	112.3	D70 L71 K77 L78	D70-T74 PolarHBondContact O-N 2.94Å; L71-T74 PolarHBondContact O-N 3.2Å; L71-T74 VanDerWaalsContact O-N 3.08Å; L71-T74 PolarHBondContact O-OG1 3.21Å; T74-K77 PolarHBondContact O-N 3.04Å; T74-L78 WeakPolarHBondContact O-CB 3.45Å; T74-L78 PolarHBondContact O-N 2.8Å
75	E	66.4	Low	64.3	Low	121 Å²	121	81.9 Å²	81.9	57%	0.565	45%	0.449	S	S	*	.	H	α-helix	trans	-59.6	-55.8	171.7	-71	176.4	149.7	0	0	111	L71 E73 K77 L78 E79	L71-E75 WeakPolarHBondContact O-CG 3.35Å; L71-E75 PolarHBondContact O-N 3.33Å; E73-E75 VanDerWaalsContact C-N 3.31Å; E73-E75 PolarHBondContact O-N 2.74Å; E75-K77 PolarHBondContact O-N 2.73Å; E75-L78 WeakPolarHBondContact O-CB 3.33Å; E75-L78 PolarHBondContact O-N 3.11Å; E75-L78 VanDerWaalsContact O-N 3.08Å; E75-E79 WeakPolarHBondContact O-CG 3.26Å; E75-E79 PolarHBondContact O-N 3.4Å
76	K	71.9	Confident	62.7	Low	119 Å²	119	84.7 Å²	84.7	52%	0.517	46%	0.455	S	S	.	.	H	α-helix	trans	-58.1	-35.8	178.1	-71.5	175.4	-159.2	76.1	0	113	S72 E73 A80	S72-K76 VanDerWaalsContact O-CG 3.28Å; S72-K76 WeakPolarHBondContact O-CG 3.23Å; S72-K76 PolarHBondContact O-N 3.29Å; S72-K76 PolarHBondContact O-NZ 3.42Å; S72-K76 PolarHBondContact OG-NZ 3.09Å; S72-K76 VanDerWaalsContact OG-NZ 3.11Å; E73-K76 PolarHBondContact O-N 3.28Å; K76-A80 WeakPolarHBondContact O-CB 3.46Å; K76-A80 PolarHBondContact O-N 3.2Å
77	K	62.1	Low	61.2	Low	139 Å²	139	86.1 Å²	86.1	60%	0.604	47%	0.473	S	S	*	.	H	α-helix	trans	-67.3	-45.9	176.4	-171.3	-165.1	170.2	-135.3	0	110.8	E73 T74 E75 A80 E81	E73-K77 WeakPolarHBondContact O-CB 3.25Å; E73-K77 PolarHBondContact O-N 3.43Å; T74-K77 PolarHBondContact O-N 3.04Å; E75-K77 PolarHBondContact O-N 2.73Å; K77-A80 PolarHBondContact O-N 3.34Å; K77-E81 WeakPolarHBondContact O-CB 3.43Å; K77-E81 PolarHBondContact O-N 3.01Å
78	L	61	Low	59.8	Low	102 Å²	102	90 Å²	90	53%	0.534	50%	0.5	S	S	.	.	H	α-helix	trans	-63.7	-40.7	176.5	-178.7	63.3	0	0	0	111.5	T74 E75 E81 I82	T74-L78 WeakPolarHBondContact O-CB 3.45Å; T74-L78 PolarHBondContact O-N 2.8Å; E75-L78 WeakPolarHBondContact O-CB 3.33Å; E75-L78 PolarHBondContact O-N 3.11Å; E75-L78 VanDerWaalsContact O-N 3.08Å; L78-E81 PolarHBondContact O-N 3.08Å; L78-I82 HydrophobicContact CD1-CD1 4.12Å; L78-I82 HydrophobicContact CD1-CG1 4.4Å; L78-I82 HydrophobicContact CG-CD1 3.87Å; L78-I82 WeakPolarHBondContact O-CB 3.4Å; L78-I82 VanDerWaalsContact O-CG1 3.25Å; L78-I82 WeakPolarHBondContact O-CG1 3.45Å; L78-I82 PolarHBondContact O-N 3.15Å
79	E	70.6	Confident	58.4	Low	109 Å²	109	92.2 Å²	92.2	51%	0.509	52%	0.516	S	S	.	.	H	α-helix	trans	-62.1	-42.6	174	-71	176.5	142.4	0	0	112.1	E75 E81 I82 Q83	E75-E79 WeakPolarHBondContact O-CG 3.26Å; E75-E79 PolarHBondContact O-N 3.4Å; E79-E81 VanDerWaalsContact C-N 3.34Å; E79-I82 PolarHBondContact O-N 3.48Å; E79-Q83 WeakPolarHBondContact O-CB 3.34Å; E79-Q83 VanDerWaalsContact O-CG 3.25Å; E79-Q83 WeakPolarHBondContact O-CG 3.4Å; E79-Q83 PolarHBondContact O-N 2.81Å
80	A	70.9	Confident	56.5	Low	61 Å²	61	97.2 Å²	97.2	50%	0.504	55%	0.55	S	S	.	*	H	α-helix	trans	-65.5	-36.5	174.7	0	0	0	0	0	112.5	K76 K77 Q83 G84	K76-A80 WeakPolarHBondContact O-CB 3.46Å; K76-A80 PolarHBondContact O-N 3.2Å; K77-A80 PolarHBondContact O-N 3.34Å; A80-Q83 PolarHBondContact O-N 2.99Å; A80-G84 PolarHBondContact O-N 3.03Å
81	E	60	Low	55.3	Low	111 Å²	111	100.4 Å²	100.4	52%	0.519	58%	0.576	S	S	.	*	H	α-helix	trans	-69.4	-42.9	176.6	-161.5	163.4	163.1	0	0	111.2	K77 L78 E79 G84 L85	K77-E81 WeakPolarHBondContact O-CB 3.43Å; K77-E81 PolarHBondContact O-N 3.01Å; L78-E81 PolarHBondContact O-N 3.08Å; E79-E81 VanDerWaalsContact C-N 3.34Å; E81-G84 PolarHBondContact O-N 3.48Å; E81-L85 WeakPolarHBondContact O-CG 3.16Å; E81-L85 PolarHBondContact O-N 2.97Å; E81-L85 VanDerWaalsContact O-N 3.1Å
82	I	65.7	Low	54	Low	86 Å²	86	102 Å²	102	44%	0.441	59%	0.594	S	S	.	*	H	α-helix	trans	-64.2	-38.8	173	-70.2	167.6	0	0	0	111.6	L78 E79 L85 N86	L78-I82 HydrophobicContact CD1-CD1 4.12Å; L78-I82 HydrophobicContact CD1-CG1 4.4Å; L78-I82 HydrophobicContact CG-CD1 3.87Å; L78-I82 WeakPolarHBondContact O-CB 3.4Å; L78-I82 VanDerWaalsContact O-CG1 3.25Å; L78-I82 WeakPolarHBondContact O-CG1 3.45Å; L78-I82 PolarHBondContact O-N 3.15Å; E79-I82 PolarHBondContact O-N 3.48Å; I82-L85 PolarHBondContact O-N 3.06Å; I82-N86 PolarHBondContact O-N 2.93Å; I82-N86 PolarHBondContact O-ND2 2.87Å
83	Q	60.2	Low	52.5	Low	143 Å²	143	105.3 Å²	105.3	67%	0.668	62%	0.617	S	S	*	*	H	α-helix	trans	-68.7	-37.3	174.8	-74.2	174.2	26.8	0	0	111.8	E79 A80 L85 N86	E79-Q83 WeakPolarHBondContact O-CB 3.34Å; E79-Q83 VanDerWaalsContact O-CG 3.25Å; E79-Q83 WeakPolarHBondContact O-CG 3.4Å; E79-Q83 PolarHBondContact O-N 2.81Å; A80-Q83 PolarHBondContact O-N 2.99Å; Q83-L85 VanDerWaalsContact C-N 3.26Å; Q83-L85 PolarHBondContact O-N 3.44Å; Q83-N86 PolarHBondContact O-N 3.34Å
84	G	49	Very low	50.8	Low	58 Å²	58	110.5 Å²	110.5	60%	0.598	65%	0.646	S	S	*	*	H	α-helix	trans	-61.3	-32.4	172.8	0	0	0	0	0	113.7	A80 E81	A80-G84 PolarHBondContact O-N 3.03Å; E81-G84 PolarHBondContact O-N 3.48Å
85	L	50.3	Low	49.9	Very low	145 Å²	145	114.4 Å²	114.4	76%	0.759	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-9.2	177.5	-69.1	168.9	0	0	0	114.4	E81 I82 Q83	E81-L85 WeakPolarHBondContact O-CG 3.16Å; E81-L85 PolarHBondContact O-N 2.97Å; E81-L85 VanDerWaalsContact O-N 3.1Å; I82-L85 PolarHBondContact O-N 3.06Å; Q83-L85 VanDerWaalsContact C-N 3.26Å; Q83-L85 PolarHBondContact O-N 3.44Å
86	N	40.2	Very low	48.6	Very low	121 Å²	121	114.2 Å²	114.2	65%	0.647	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	12.1	-177.2	-83.7	-74.5	0	0	0	114.4	I82 Q83 P88	I82-N86 PolarHBondContact O-N 2.93Å; I82-N86 PolarHBondContact O-ND2 2.87Å; Q83-N86 PolarHBondContact O-N 3.34Å; N86-P88 VanDerWaalsContact O-CD 3.3Å; N86-P88 WeakPolarHBondContact O-CD 3.2Å
87	A	36.4	Very low	47.5	Very low	79 Å²	79	114.3 Å²	114.3	65%	0.653	69%	0.685	S	S	*	*			trans	-80.3	114.6	176.1	0	0	0	0	0	111.7
88	P	38.2	Very low	46.7	Very low	109 Å²	109	113.4 Å²	113.4	71%	0.708	69%	0.693	S	S	*	*			trans	-75.2	150.4	175.8	31.9	-35.2	0	0	0	111.5	N86 S90	N86-P88 VanDerWaalsContact O-CD 3.3Å; N86-P88 WeakPolarHBondContact O-CD 3.2Å; P88-S90 PolarHBondContact O-N 2.86Å; P88-S90 VanDerWaalsContact O-N 3.12Å
89	P	38.8	Very low	46	Very low	134 Å²	134	114.6 Å²	114.6	87%	0.87	71%	0.707	S	S	*	*			trans	-72.7	104.5	178.6	29.3	-34	0	0	0	111.2
90	S	31.3	Very low	44.3	Very low	123 Å²	123	119.7 Å²	119.7	86%	0.86	73%	0.728	S	S	*	*			trans	-80.1	123.2	174.1	47.3	0	0	0	0	111.7	P88	P88-S90 PolarHBondContact O-N 2.86Å; P88-S90 VanDerWaalsContact O-N 3.12Å
91	S	34.4	Very low	42.4	Very low	110 Å²	110	120 Å²	120	77%	0.769	74%	0.736	S	S	*	*			trans	-88.1	133	-173.7	55.8	0	0	0	0	113.9
92	S	35.6	Very low	41.1	Very low	112 Å²	112	123.5 Å²	123.5	78%	0.783	76%	0.758	S	S	*	*			trans	-2.2	123.4	155.7	57.8	0	0	0	0	120.6
93	S	35.5	Very low	39.4	Very low	108 Å²	108	123 Å²	123	76%	0.755	77%	0.773	S	S	*	*			trans	-176.7	147	130.7	-120.6	0	0	0	0	107.7
94	D	31.2	Very low	38	Very low	147 Å²	147	122.3 Å²	122.3	79%	0.786	78%	0.779	S	S	*	*			cis	-136.1	172.1	17	-79.2	-47.3	0	0	0	113.5
95	L	38.9	Very low	37.2	Very low	165 Å²	165	127.6 Å²	127.6	86%	0.864	79%	0.788	S	S	*	*			trans	-118.1	145.7	168.3	-81.8	169.9	0	0	0	111.6
96	P	38.3	Very low	37.1	Very low	118 Å²	118	125.5 Å²	125.5	77%	0.766	78%	0.783	S	S	*	*			trans	-106.8	154.7	138	-13.2	31.7	0	0	0	113
97	P	49.8	Very low	36.6	Very low	120 Å²	120	124.2 Å²	124.2	78%	0.779	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-93.7	160.3	-166.3	36.3	-37.2	0	0	0	115.5
98	P	45.5	Very low	36.6	Very low	121 Å²	121	125.3 Å²	125.3	79%	0.786	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-91.4	142.8	173.8	35.4	-33.2	0	0	0	113.3
99	P	44.5	Very low	36.4	Very low	126 Å²	126	125.1 Å²	125.1	82%	0.818	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-90.5	139.8	167.6	33.5	-31.2	0	0	0	112.7
100	K	35.1	Very low	36.2	Very low	217 Å²	217	126 Å²	126	94%	0.943	79%	0.789	S	S	*	*			trans	-134.9	134.5	164.1	-81.6	-172.6	176.9	179.3	0	110.3
101	G	31.6	Very low	36.1	Very low	66 Å²	66	126.1 Å²	126.1	68%	0.68	79%	0.785	S	S	*	*			trans	161.5	92.4	177.7	0	0	0	0	0	109
102	L	33.3	Very low	36	Very low	186 Å²	186	125.9 Å²	125.9	97%	0.974	78%	0.783	S	S	*	*				70.2	100.2	86.5	-70.2	176.2	0	0	0	113.7
103	G	29.2	Very low	37.1	Very low	75 Å²	75	126.2 Å²	126.2	77%	0.773	78%	0.782	S	S	*	*			trans	-161.2	148.8	170.4	0	0	0	0	0	108.6
104	V	31.4	Very low	37.9	Very low	128 Å²	128	126.5 Å²	126.5	78%	0.776	78%	0.782	S	S	*	*			trans	-136.1	116.2	-154	175.5	0	0	0	0	113.6
105	Q	32.5	Very low	38.1	Very low	169 Å²	169	125 Å²	125	79%	0.79	78%	0.782	S	S	*	*			trans	65.6	174.4	155	-61.8	-73	17.6	0	0	117.8
106	P	47.6	Very low	38.7	Very low	102 Å²	102	123.6 Å²	123.6	66%	0.662	78%	0.783	S	S	*	*			cis	-135.6	174.7	-47	36.6	-21.8	0	0	0	115.1
107	A	29.5	Very low	38.3	Very low	93 Å²	93	121.2 Å²	121.2	77%	0.769	78%	0.78	S	S	*	*			trans	68.5	151	144.3	0	0	0	0	0	120.8
108	S	36.9	Very low	37.4	Very low	103 Å²	103	122.6 Å²	122.6	72%	0.72	78%	0.781	S	S	*	*			cis	-169.4	-179.2	-11.5	56	0	0	0	0	112.5
109	S	34.6	Very low	36.7	Very low	104 Å²	104	123.2 Å²	123.2	73%	0.727	78%	0.778	S	S	*	*			trans	79.9	152.2	165.3	-50.3	0	0	0	0	115.5
110	I	33.2	Very low	36	Very low	152 Å²	152	128.7 Å²	128.7	78%	0.779	78%	0.782	S	S	*	*			cis	-153.6	172.3	-6.2	21.4	171.3	0	0	0	106.9
111	T	29.4	Very low	35.8	Very low	127 Å²	127	123.8 Å²	123.8	78%	0.779	78%	0.775	S	S	*	*			cis	-153.5	-168.4	16.8	-17.6	0	0	0	0	110.9
112	S	31.6	Very low	36	Very low	104 Å²	104	125.1 Å²	125.1	73%	0.727	77%	0.774	S	S	*	*			trans	-112.8	-173.3	175.1	-22	0	0	0	0	111.6
113	P	59.3	Low	35.9	Very low	119 Å²	119	121.5 Å²	121.5	77%	0.773	77%	0.765	S	S	*	*			cis	-123.1	-134.1	-17.3	33.1	-8.9	0	0	0	108.7
114	P	52.3	Low	36	Very low	115 Å²	115	123.8 Å²	123.8	75%	0.747	76%	0.763	S	S	*	*			cis	-132.8	-145.5	-21	42.2	-21.1	0	0	0	114.1
115	S	35.1	Very low	36	Very low	114 Å²	114	123.6 Å²	123.6	80%	0.797	76%	0.763	S	S	*	*			trans	-163.8	-172.9	172.9	-67.8	0	0	0	0	107.8
116	P	51.7	Low	36.1	Very low	136 Å²	136	121.5 Å²	121.5	88%	0.883	76%	0.761	S	S	*	*			cis	-123.7	-142	-7.7	47.8	-30.5	0	0	0	110.2
117	G	29.6	Very low	36	Very low	68 Å²	68	122 Å²	122	70%	0.701	77%	0.765	S	S	*	*			cis	163	177.5	-3.5	0	0	0	0	0	115.7
118	N	31.3	Very low	36	Very low	150 Å²	150	123.6 Å²	123.6	80%	0.802	77%	0.77	S	S	*	*			trans	79.8	105.7	156.4	-133.3	16	0	0	0	122.4
119	N	30.3	Very low	35.9	Very low	134 Å²	134	124.3 Å²	124.3	72%	0.717	78%	0.775	S	S	*	*				80.9	148.7	126.5	-112.6	-44.7	0	0	0	125.9
120	R	31.1	Very low	35.8	Very low	241 Å²	241	125.3 Å²	125.3	91%	0.909	78%	0.782	S	S	*	*			trans	89.1	176.1	158.4	-69.5	-178.4	177.8	-165.9	-1.1	120.8
121	S	31.2	Very low	36	Very low	113 Å²	113	124.9 Å²	124.9	79%	0.79	79%	0.787	S	S	*	*			trans	-140.8	176.7	-137.5	-168.2	0	0	0	0	114.7
122	S	34.6	Very low	36.3	Very low	95 Å²	95	124.8 Å²	124.8	66%	0.664	79%	0.791	S	S	*	*			trans	67.5	102.9	156	63.1	0	0	0	0	121.7
123	S	31.2	Very low	36.6	Very low	110 Å²	110	125 Å²	125	77%	0.769	79%	0.792	S	S	*	*				77.1	165.8	121.4	74.5	0	0	0	0	122.4
124	V	31.9	Very low	35.7	Very low	123 Å²	123	125.4 Å²	125.4	75%	0.745	80%	0.795	S	S	*	*			trans	87.6	102.5	159.9	177	0	0	0	0	119
125	T	30.2	Very low	35.2	Very low	124 Å²	124	127.6 Å²	127.6	76%	0.761	80%	0.8	S	S	*	*			trans	52.3	134.7	144.1	64.5	0	0	0	0	124.2
126	T	34.6	Very low	35.7	Very low	125 Å²	125	127.3 Å²	127.3	77%	0.767	80%	0.795	S	S	*	*			trans	-37.6	170.7	140.7	44.8	0	0	0	0	115.1
127	P	46.4	Very low	35.6	Very low	113 Å²	113	126.2 Å²	126.2	73%	0.734	79%	0.788	S	S	*	*			cis	-139.8	173.8	19.4	43.8	-26.9	0	0	0	117.2
128	S	28.8	Very low	36.2	Very low	125 Å²	125	129 Å²	129	87%	0.874	79%	0.794	S	S	*	*				-175.8	151.3	118.8	-80.6	0	0	0	0	112.1
129	S	34.9	Very low	36.8	Very low	119 Å²	119	131 Å²	131	83%	0.832	80%	0.798	S	S	*	*			trans	-110.2	139.6	-174.6	53.8	0	0	0	0	112.9
130	S	34	Very low	37.6	Very low	125 Å²	125	130 Å²	130	87%	0.874	80%	0.802	S	S	*	*			trans	-143.3	144	155.6	59	0	0	0	0	110.5
131	T	37.2	Very low	38.8	Very low	143 Å²	143	123.6 Å²	123.6	88%	0.877	79%	0.794	S	S	*	*			trans	-98.1	133.6	-167.8	49.2	0	0	0	0	112.7
132	S	35.3	Very low	39.8	Very low	124 Å²	124	127.3 Å²	127.3	87%	0.867	80%	0.796	S	S	*	*			trans	-149.7	160.6	153.5	59.9	0	0	0	0	111.3
133	S	38.1	Very low	40.7	Very low	108 Å²	108	126.4 Å²	126.4	76%	0.755	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-65.5	160.7	-158.6	-48.9	0	0	0	0	116.3	L135	S133-L135 PolarHBondContact O-N 2.97Å
134	P	40	Very low	42.4	Very low	128 Å²	128	124.9 Å²	124.9	83%	0.831	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-64	132.9	173.3	-16.4	30.1	0	0	0	112
135	L	41.8	Very low	44	Very low	162 Å²	162	126.2 Å²	126.2	85%	0.848	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-73.4	144	160.2	-75.4	158	0	0	0	109.1	S133	S133-L135 PolarHBondContact O-N 2.97Å
136	P	46.4	Very low	45.9	Very low	108 Å²	108	127.8 Å²	127.8	70%	0.701	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-65.2	149.9	171.8	29.4	-34.5	0	0	0	110.3
137	P	48.1	Very low	47.5	Very low	112 Å²	112	127 Å²	127	73%	0.727	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-60.6	149.2	173.8	27.2	-34.6	0	0	0	110.5	Q139	P137-Q139 PolarHBondContact O-N 2.9Å
138	P	43.2	Very low	48.5	Very low	127 Å²	127	125.1 Å²	125.1	83%	0.825	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-57.4	138.2	176.3	25.5	-34	0	0	0	110	S140	P138-S140 PolarHBondContact O-N 2.92Å
139	Q	42.6	Very low	50.3	Low	192 Å²	192	125.3 Å²	125.3	90%	0.897	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-57.9	131.4	-177.5	-64.1	177.4	-82.5	0	0	110.1	P137 S141	P137-Q139 PolarHBondContact O-N 2.9Å; Q139-S141 PolarHBondContact O-N 3Å
140	S	48.2	Very low	51.6	Low	114 Å²	114	122.4 Å²	122.4	80%	0.797	71%	0.713	S	S	*	*			trans	-61.1	112	166.9	39.2	0	0	0	0	109	P138 K142	P138-S140 PolarHBondContact O-N 2.92Å; S140-K142 PolarHBondContact O-N 3.07Å; S140-K142 VanDerWaalsContact O-N 3.16Å
141	S	56.4	Low	52.8	Low	105 Å²	105	121.6 Å²	121.6	73%	0.734	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-53.5	120.3	160.7	45.2	0	0	0	0	107.4	Q139	Q139-S141 PolarHBondContact O-N 3Å
142	K	52.2	Low	53.8	Low	192 Å²	192	121.1 Å²	121.1	84%	0.835	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-57.8	129.1	170.5	-67.9	-178.5	178.5	-179.2	0	107.1	S140 T144	S140-K142 PolarHBondContact O-N 3.07Å; S140-K142 VanDerWaalsContact O-N 3.16Å; K142-T144 PolarHBondContact O-N 3.46Å
143	P	53.3	Low	54.9	Low	75 Å²	75	122 Å²	122	49%	0.487	67%	0.673	S	S	.	*	P	Polyproline II helix	trans	-58.1	140	-178.8	24.4	-33.6	0	0	0	109.2	E147 I148	P143-E147 WeakPolarHBondContact CA-OE2 3.35Å; P143-E147 HydrophobicContact CB-CB 4.47Å; P143-E147 HydrophobicContact CB-CG 4.28Å; P143-E147 WeakPolarHBondContact CB-OE2 3.14Å; P143-I148 HydrophobicContact CB-CG1 4.03Å; P143-I148 HydrophobicContact CG-CD1 4.23Å; P143-I148 HydrophobicContact CG-CG1 3.97Å
144	T	67	Low	55.4	Low	78 Å²	78	119.1 Å²	119.1	48%	0.479	66%	0.656	S	S	.	*	P	Polyproline II helix	trans	-69.4	159.1	-177.9	66.4	0	0	0	0	110.2	K142 E146 E147 I148	K142-T144 PolarHBondContact O-N 3.46Å; T144-E146 PolarHBondContact O-N 2.92Å; T144-E147 PolarHBondContact N-OE2 3.38Å; T144-E147 WeakPolarHBondContact O-CB 3.4Å; T144-E147 PolarHBondContact O-N 3.11Å; T144-E147 WeakPolarHBondContact OG1-CB 3.27Å; T144-E147 PolarHBondContact OG1-N 2.87Å; T144-I148 WeakPolarHBondContact O-CG1 3.22Å; T144-I148 PolarHBondContact O-N 3.01Å
145	M	64.9	Low	56	Low	151 Å²	151	116.8 Å²	116.8	74%	0.744	64%	0.637	S	S	*	*	H	α-helix	trans	-55	-38.8	177.7	-171.5	70.3	-171.1	0	0	111.7	I148 E149	M145-I148 PolarHBondContact O-N 3.48Å; M145-E149 WeakPolarHBondContact O-CB 3.35Å; M145-E149 PolarHBondContact O-N 2.84Å
146	E	69.6	Low	56.6	Low	158 Å²	158	117 Å²	117	74%	0.738	63%	0.631	S	S	*	*	H	α-helix	trans	-67.6	-36.5	177	-172.3	172.8	-162.3	0	0	112.6	T144 A150	T144-E146 PolarHBondContact O-N 2.92Å; E146-A150 VanDerWaalsContact O-CB 3.23Å; E146-A150 WeakPolarHBondContact O-CB 3.29Å; E146-A150 PolarHBondContact O-N 2.84Å
147	E	69.3	Low	56.8	Low	108 Å²	108	116.1 Å²	116.1	51%	0.505	62%	0.619	S	S	.	*	H	α-helix	trans	-72.4	-37.3	175.4	-173.6	173.8	-148.2	0	0	112.1	P143 T144 Q151	P143-E147 WeakPolarHBondContact CA-OE2 3.35Å; P143-E147 HydrophobicContact CB-CB 4.47Å; P143-E147 HydrophobicContact CB-CG 4.28Å; P143-E147 WeakPolarHBondContact CB-OE2 3.14Å; T144-E147 PolarHBondContact N-OE2 3.38Å; T144-E147 WeakPolarHBondContact O-CB 3.4Å; T144-E147 PolarHBondContact O-N 3.11Å; T144-E147 WeakPolarHBondContact OG1-CB 3.27Å; T144-E147 PolarHBondContact OG1-N 2.87Å; E147-Q151 WeakPolarHBondContact O-CB 3.34Å; E147-Q151 PolarHBondContact O-N 3.4Å
148	I	67.4	Low	57.2	Low	74 Å²	74	116.7 Å²	116.7	38%	0.379	61%	0.61	S	S	.	*	H	α-helix	trans	-64.6	-45.5	171.1	-61.7	167.8	0	0	0	110	P143 T144 M145 Q151 M152	P143-I148 HydrophobicContact CB-CG1 4.03Å; P143-I148 HydrophobicContact CG-CD1 4.23Å; P143-I148 HydrophobicContact CG-CG1 3.97Å; T144-I148 WeakPolarHBondContact O-CG1 3.22Å; T144-I148 PolarHBondContact O-N 3.01Å; M145-I148 PolarHBondContact O-N 3.48Å; I148-Q151 PolarHBondContact O-N 3.26Å; I148-M152 HydrophobicContact CG2-SD 4.19Å; I148-M152 WeakPolarHBondContact O-CB 3.35Å; I148-M152 WeakPolarHBondContact O-CG 3.46Å; I148-M152 PolarHBondContact O-N 2.87Å
149	E	65.8	Low	57.7	Low	129 Å²	129	115.3 Å²	115.3	60%	0.603	60%	0.595	S	S	*	*	H	α-helix	trans	-64.8	-41.1	177.6	-171.8	174.1	173	0	0	111.8	M145 M152 K153	M145-E149 WeakPolarHBondContact O-CB 3.35Å; M145-E149 PolarHBondContact O-N 2.84Å; E149-M152 PolarHBondContact O-N 3.13Å; E149-K153 VanDerWaalsContact O-CB 3.26Å; E149-K153 WeakPolarHBondContact O-CB 3.42Å; E149-K153 PolarHBondContact O-N 2.79Å
150	A	62.7	Low	58	Low	57 Å²	57	108.3 Å²	108.3	47%	0.471	57%	0.57	S	S	.	*	H	α-helix	trans	-61.4	-42.7	173.4	0	0	0	0	0	112.1	E146 K153 A154	E146-A150 VanDerWaalsContact O-CB 3.23Å; E146-A150 WeakPolarHBondContact O-CB 3.29Å; E146-A150 PolarHBondContact O-N 2.84Å; A150-K153 PolarHBondContact O-N 3.35Å; A150-A154 WeakPolarHBondContact O-CB 3.41Å; A150-A154 PolarHBondContact O-N 2.87Å
151	Q	58.9	Low	58.1	Low	108 Å²	108	108 Å²	108	51%	0.505	56%	0.56	S	S	.	*	H	α-helix	trans	-65.1	-48	175.8	-176.4	58.3	47.9	0	0	111.5	E147 I148 K153 A154 D155	E147-Q151 WeakPolarHBondContact O-CB 3.34Å; E147-Q151 PolarHBondContact O-N 3.4Å; I148-Q151 PolarHBondContact O-N 3.26Å; Q151-K153 PolarHBondContact O-N 3.03Å; Q151-A154 WeakPolarHBondContact O-CB 3.41Å; Q151-A154 PolarHBondContact O-N 3.3Å; Q151-A154 VanDerWaalsContact O-N 3.09Å; Q151-D155 PolarHBondContact NE2-OD1 2.92Å; Q151-D155 VanDerWaalsContact NE2-OD1 3.13Å; Q151-D155 PolarHBondContact NE2-OD2 3.07Å; Q151-D155 PolarHBondContact O-N 2.91Å
152	M	58.2	Low	58.6	Low	133 Å²	133	106.6 Å²	106.6	66%	0.655	54%	0.541	S	S	*	.	H	α-helix	trans	-59.4	-36.2	175.7	-72.2	-178.5	70.1	0	0	112.3	I148 E149 K156	I148-M152 HydrophobicContact CG2-SD 4.19Å; I148-M152 WeakPolarHBondContact O-CB 3.35Å; I148-M152 WeakPolarHBondContact O-CG 3.46Å; I148-M152 PolarHBondContact O-N 2.87Å; E149-M152 PolarHBondContact O-N 3.13Å; M152-K156 VanDerWaalsContact O-CB 3.23Å; M152-K156 WeakPolarHBondContact O-CB 3.47Å; M152-K156 PolarHBondContact O-N 3.47Å
153	K	59.8	Low	59.1	Low	142 Å²	142	100.7 Å²	100.7	62%	0.617	52%	0.516	S	S	*	.	H	α-helix	trans	-69.4	-41.9	174	-173.1	175.8	-178.2	177.4	0	111.8	E149 A150 Q151 K156 I157	E149-K153 VanDerWaalsContact O-CB 3.26Å; E149-K153 WeakPolarHBondContact O-CB 3.42Å; E149-K153 PolarHBondContact O-N 2.79Å; A150-K153 PolarHBondContact O-N 3.35Å; Q151-K153 PolarHBondContact O-N 3.03Å; K153-K156 PolarHBondContact O-N 2.83Å; K153-I157 HydrophobicContact CG-CD1 4.05Å; K153-I157 WeakPolarHBondContact O-CB 3.39Å; K153-I157 WeakPolarHBondContact O-CD1 3.37Å; K153-I157 VanDerWaalsContact O-CG1 3.25Å; K153-I157 WeakPolarHBondContact O-CG1 3.34Å; K153-I157 PolarHBondContact O-N 3.22Å
154	A	48.5	Very low	59.3	Low	48 Å²	48	100.3 Å²	100.3	40%	0.397	51%	0.509	S	S	.	.	H	α-helix	trans	-64	-44.2	176.1	0	0	0	0	0	111.9	A150 Q151 I157 K158	A150-A154 WeakPolarHBondContact O-CB 3.41Å; A150-A154 PolarHBondContact O-N 2.87Å; Q151-A154 WeakPolarHBondContact O-CB 3.41Å; Q151-A154 PolarHBondContact O-N 3.3Å; Q151-A154 VanDerWaalsContact O-N 3.09Å; A154-I157 PolarHBondContact O-N 3.44Å; A154-K158 WeakPolarHBondContact O-CB 3.23Å; A154-K158 PolarHBondContact O-N 2.75Å
155	D	51.4	Low	58.8	Low	80 Å²	80	101.7 Å²	101.7	43%	0.428	51%	0.508	S	S	.	.	H	α-helix	trans	-66	-38.3	176.3	-71.3	-40.4	0	0	0	112	Q151 K158 L159	Q151-D155 PolarHBondContact NE2-OD1 2.92Å; Q151-D155 VanDerWaalsContact NE2-OD1 3.13Å; Q151-D155 PolarHBondContact NE2-OD2 3.07Å; Q151-D155 PolarHBondContact O-N 2.91Å; D155-K158 PolarHBondContact O-N 3.26Å; D155-L159 WeakPolarHBondContact O-CB 3.35Å; D155-L159 PolarHBondContact O-N 3.28Å
156	K	55.1	Low	58.5	Low	165 Å²	165	98.6 Å²	98.6	72%	0.717	49%	0.492	S	S	*	.	H	α-helix	trans	-67.1	-36.2	174.5	-166.6	173.3	-173.6	177.5	0	112.5	M152 K153 A160	M152-K156 VanDerWaalsContact O-CB 3.23Å; M152-K156 WeakPolarHBondContact O-CB 3.47Å; M152-K156 PolarHBondContact O-N 3.47Å; K153-K156 PolarHBondContact O-N 2.83Å; K156-A160 WeakPolarHBondContact O-CB 3.49Å; K156-A160 PolarHBondContact O-N 3.37Å; K156-A160 VanDerWaalsContact O-N 3.07Å
157	I	50.2	Low	57.9	Low	91 Å²	91	92.7 Å²	92.7	47%	0.467	47%	0.471	S	S	.	.	H	α-helix	trans	-69.3	-42.8	172.1	-71.3	165.2	0	0	0	110.7	K153 A154 A160 L161	K153-I157 HydrophobicContact CG-CD1 4.05Å; K153-I157 WeakPolarHBondContact O-CB 3.39Å; K153-I157 WeakPolarHBondContact O-CD1 3.37Å; K153-I157 VanDerWaalsContact O-CG1 3.25Å; K153-I157 WeakPolarHBondContact O-CG1 3.34Å; K153-I157 PolarHBondContact O-N 3.22Å; A154-I157 PolarHBondContact O-N 3.44Å; I157-A160 PolarHBondContact O-N 3.48Å; I157-L161 HydrophobicContact CG2-CD1 3.87Å; I157-L161 HydrophobicContact CG2-CG 4.33Å; I157-L161 WeakPolarHBondContact O-CB 3.34Å; I157-L161 WeakPolarHBondContact O-CG 3.43Å; I157-L161 PolarHBondContact O-N 2.93Å
158	K	57.5	Low	57.8	Low	124 Å²	124	95 Å²	95	54%	0.539	48%	0.479	S	S	.	.	H	α-helix	trans	-58.7	-50	175.9	-178.5	-166.4	168.3	-162.9	0	110.8	A154 D155 A160 L161 E162	A154-K158 WeakPolarHBondContact O-CB 3.23Å; A154-K158 PolarHBondContact O-N 2.75Å; D155-K158 PolarHBondContact O-N 3.26Å; K158-A160 VanDerWaalsContact C-N 3.3Å; K158-A160 PolarHBondContact O-N 3.27Å; K158-L161 CarbonylContact O-C 3.51Å; K158-L161 PolarHBondContact O-N 3.3Å; K158-L161 VanDerWaalsContact O-N 3.13Å; K158-E162 WeakPolarHBondContact O-CB 3.49Å; K158-E162 PolarHBondContact O-N 2.89Å
159	L	53.3	Low	58.2	Low	97 Å²	97	92.3 Å²	92.3	51%	0.508	47%	0.466	S	S	.	.	H	α-helix	trans	-62	-36.4	177.7	-176	64.3	0	0	0	112.2	D155 E162 K163	D155-L159 WeakPolarHBondContact O-CB 3.35Å; D155-L159 PolarHBondContact O-N 3.28Å; L159-E162 PolarHBondContact O-N 3.07Å; L159-K163 WeakPolarHBondContact O-CG 3.49Å; L159-K163 PolarHBondContact O-N 3.5Å
160	A	48.1	Very low	59.1	Low	45 Å²	45	89.8 Å²	89.8	37%	0.372	45%	0.453	S	S	.	.	H	α-helix	trans	-68.6	-38.7	172.9	0	0	0	0	0	112.5	K156 I157 K158 E162 K163 L164	K156-A160 WeakPolarHBondContact O-CB 3.49Å; K156-A160 PolarHBondContact O-N 3.37Å; K156-A160 VanDerWaalsContact O-N 3.07Å; I157-A160 PolarHBondContact O-N 3.48Å; K158-A160 VanDerWaalsContact C-N 3.3Å; K158-A160 PolarHBondContact O-N 3.27Å; A160-E162 VanDerWaalsContact C-N 3.31Å; A160-K163 PolarHBondContact O-N 2.97Å; A160-L164 WeakPolarHBondContact O-CB 3.38Å; A160-L164 WeakPolarHBondContact O-CD1 3.2Å; A160-L164 PolarHBondContact O-N 3.09Å
161	L	51.4	Low	60.2	Low	109 Å²	109	89.4 Å²	89.4	57%	0.571	44%	0.441	S	S	*	.	H	α-helix	trans	-70.2	-27.8	175	-71.9	172.5	0	0	0	112.9	I157 K158 K165	I157-L161 HydrophobicContact CG2-CD1 3.87Å; I157-L161 HydrophobicContact CG2-CG 4.33Å; I157-L161 WeakPolarHBondContact O-CB 3.34Å; I157-L161 WeakPolarHBondContact O-CG 3.43Å; I157-L161 PolarHBondContact O-N 2.93Å; K158-L161 CarbonylContact O-C 3.51Å; K158-L161 PolarHBondContact O-N 3.3Å; K158-L161 VanDerWaalsContact O-N 3.13Å; L161-K165 WeakPolarHBondContact O-CB 3.01Å; L161-K165 PolarHBondContact O-N 3.14Å
162	E	66	Low	61.7	Low	75 Å²	75	84.4 Å²	84.4	35%	0.35	42%	0.417	S	S	.	.	H	α-helix	trans	-69.7	-45.7	171.9	-160.7	135.1	-125.9	0	0	110	K158 L159 A160 K165 E166	K158-E162 WeakPolarHBondContact O-CB 3.49Å; K158-E162 PolarHBondContact O-N 2.89Å; L159-E162 PolarHBondContact O-N 3.07Å; A160-E162 VanDerWaalsContact C-N 3.31Å; E162-K165 CarbonylContact O-C 3.59Å; E162-K165 WeakPolarHBondContact O-CA 3.49Å; E162-K165 WeakPolarHBondContact O-CB 3.49Å; E162-K165 PolarHBondContact O-N 3.34Å; E162-K165 VanDerWaalsContact O-N 3.11Å; E162-E166 WeakPolarHBondContact O-CG 3.2Å; E162-E166 PolarHBondContact O-N 3.22Å
163	K	63.8	Low	63.3	Low	68 Å²	68	78.4 Å²	78.4	30%	0.296	39%	0.388	S	S	.	.	H	α-helix	trans	-64.8	-43.9	173.7	-73.4	-178.1	168.5	-61.9	0	113.8	L159 A160 K165 E166 A167	L159-K163 WeakPolarHBondContact O-CG 3.49Å; L159-K163 PolarHBondContact O-N 3.5Å; A160-K163 PolarHBondContact O-N 2.97Å; K163-K165 PolarHBondContact O-N 3.38Å; K163-E166 PolarHBondContact O-N 3.33Å; K163-A167 WeakPolarHBondContact O-CB 3.47Å; K163-A167 PolarHBondContact O-N 2.74Å
164	L	56.4	Low	65	Low	66 Å²	66	71.7 Å²	71.7	35%	0.346	36%	0.359	S	S	.	.	H	α-helix	trans	-48	-27.2	168.4	-114.6	78.6	0	0	0	114.1	E73 A160	E73-L164 HydrophobicContact CG-CD1 4.3Å; E73-L164 WeakPolarHBondContact OE1-CA 3.45Å; E73-L164 WeakPolarHBondContact OE1-CD1 3.41Å; E73-L164 WeakPolarHBondContact OE1-CD2 3.34Å; E73-L164 PolarHBondContact OE2-N 2.86Å; A160-L164 WeakPolarHBondContact O-CB 3.38Å; A160-L164 WeakPolarHBondContact O-CD1 3.2Å; A160-L164 PolarHBondContact O-N 3.09Å
165	K	57.6	Low	67.3	Low	107 Å²	107	71.3 Å²	71.3	47%	0.465	35%	0.348	S	S	.	.	H	α-helix	trans	-102.5	-23.1	-174.8	167.7	-167.4	167.5	-145.7	0	112.1	L161 E162 K163 V169 R191	L161-K165 WeakPolarHBondContact O-CB 3.01Å; L161-K165 PolarHBondContact O-N 3.14Å; E162-K165 CarbonylContact O-C 3.59Å; E162-K165 WeakPolarHBondContact O-CA 3.49Å; E162-K165 WeakPolarHBondContact O-CB 3.49Å; E162-K165 PolarHBondContact O-N 3.34Å; E162-K165 VanDerWaalsContact O-N 3.11Å; K163-K165 PolarHBondContact O-N 3.38Å; K165-V169 WeakPolarHBondContact O-CG2 3.47Å; K165-R191 PolarHBondContact O-NH2 3.15Å; K165-R191 VanDerWaalsContact O-NH2 3.1Å
166	E	57.1	Low	69.6	Low	86 Å²	86	67.5 Å²	67.5	40%	0.402	33%	0.328	S	S	.	.	H	α-helix	trans	-77.8	-43.2	169.6	-73	172	158.1	0	0	111.2	E162 K163 K168 V169	E162-E166 WeakPolarHBondContact O-CG 3.2Å; E162-E166 PolarHBondContact O-N 3.22Å; K163-E166 PolarHBondContact O-N 3.33Å; E166-K168 PolarHBondContact O-N 2.84Å; E166-V169 WeakPolarHBondContact O-CB 3.44Å; E166-V169 WeakPolarHBondContact O-CG2 3.37Å; E166-V169 PolarHBondContact O-N 3.22Å
167	A	57.8	Low	71.6	Confident	35 Å²	35	61.4 Å²	61.4	29%	0.289	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-6.7	175.8	0	0	0	0	0	115.4	D70 K163	D70-A167 HydrophobicContact CB-CB 4.36Å; D70-A167 WeakPolarHBondContact OD1-CA 3.44Å; D70-A167 WeakPolarHBondContact OD1-CB 3.37Å; K163-A167 WeakPolarHBondContact O-CB 3.47Å; K163-A167 PolarHBondContact O-N 2.74Å
168	K	66	Low	73.7	Confident	156 Å²	156	58.6 Å²	58.6	68%	0.678	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.5	0.8	-179.5	-65.5	177.2	-174.6	166	0	113.3	E166	E166-K168 PolarHBondContact O-N 2.84Å
169	V	77.7	Confident	75.3	Confident	17 Å²	17	59.1 Å²	59.1	10%	0.103	30%	0.298	C	S	.	.	S	Bend	trans	-77.3	125.4	178.5	-173	0	0	0	0	108.9	K165 E166 K171 D189 E190 R191	K165-V169 WeakPolarHBondContact O-CG2 3.47Å; E166-V169 WeakPolarHBondContact O-CB 3.44Å; E166-V169 WeakPolarHBondContact O-CG2 3.37Å; E166-V169 PolarHBondContact O-N 3.22Å; V169-K171 PolarHBondContact O-N 2.6Å; V169-D189 HydrophobicContact CG1-CB 3.65Å; V169-D189 WeakPolarHBondContact CG1-OD1 3.49Å; V169-E190 WeakPolarHBondContact CA-OE1 3.42Å; V169-E190 HydrophobicContact CG1-CG 4.08Å; V169-R191 HydrophobicContact CG1-CG 4.14Å; V169-R191 VanDerWaalsContact CG2-NE 3.29Å
170	K	82.9	Confident	77	Confident	76 Å²	76	60.6 Å²	60.6	33%	0.33	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-65.8	121.1	172.3	-60.2	179.5	-156.2	112.9	0	109.2	I39 D189 E190 L239	I39-K170 HydrophobicContact CD1-CD 4.04Å; I39-K170 HydrophobicContact CD1-CG 4.48Å; K170-D189 CarbonylContact O-C 3.51Å; K170-D189 WeakPolarHBondContact O-CA 3.21Å; K170-E190 HydrophobicContact CB-CB 4.29Å; K170-E190 WeakPolarHBondContact CD-OE2 3.41Å; K170-E190 PolarHBondContact N-OE1 3.27Å; K170-E190 IonicContact NZ-OE2 2.68Å; K170-E190 PolarHBondContact NZ-OE2 3.16Å; K170-E190 PolarHBondContact O-N 2.95Å; K170-L239 HydrophobicContact CD-CD1 4.43Å
171	K	86.6	Confident	79.1	Confident	50 Å²	50	61.5 Å²	61.5	22%	0.217	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	144	171.9	-70	168.4	177.3	174.3	0	109.6	D66 V169 M187 V188 D189	D66-K171 IonicContact OD2-NZ 2.74Å; D66-K171 PolarHBondContact OD2-NZ 3.01Å; V169-K171 PolarHBondContact O-N 2.6Å; K171-M187 HydrophobicContact CB-CG 4.43Å; K171-M187 HydrophobicContact CD-SD 3.98Å; K171-V188 CarbonylContact C-O 3.59Å; K171-V188 WeakPolarHBondContact CA-O 3.39Å; K171-D189 HydrophobicContact CG-CB 3.95Å
172	L	90.8	Very high	81.1	Confident	3 Å²	3	59 Å²	59	2%	0.016	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	125.4	-174.1	174.7	56.1	0	0	0	108.6	N40 V43 V174 V188 V235 L238	N40-L172 WeakPolarHBondContact O-CD1 3.46Å; V43-L172 HydrophobicContact CB-CD1 4.34Å; V43-L172 HydrophobicContact CG2-CD1 3.99Å; V43-L172 HydrophobicContact CG2-CD2 4.27Å; L172-V174 HydrophobicContact CB-CG2 4.47Å; L172-V174 HydrophobicContact CD2-CG2 3.93Å; L172-V174 HydrophobicContact CG-CG2 3.72Å; L172-V188 PolarHBondContact N-O 3.24Å; L172-V188 PolarHBondContact O-N 3.38Å; L172-V235 HydrophobicContact CB-CG1 4.33Å; L172-V235 HydrophobicContact CB-CG2 4.09Å; L172-V235 HydrophobicContact CD2-CB 4.44Å; L172-V235 HydrophobicContact CD2-CG1 4.1Å; L172-V235 HydrophobicContact CD2-CG2 4.27Å; L172-L238 HydrophobicContact CD2-CB 3.76Å; L172-L238 HydrophobicContact CD2-CD1 3.84Å; L172-L238 HydrophobicContact CD2-CG 4.46Å
173	V	91.6	Very high	82.5	Confident	7 Å²	7	57.7 Å²	57.7	4%	0.042	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	113.6	173.5	-173.1	0	0	0	0	109.1	F41 S42 V43 F45 S51 L52 L55 T185 L186	F41-V173 PolarHBondContact O-N 2.88Å; S42-V173 CarbonylContact C-O 3.54Å; S42-V173 WeakPolarHBondContact CA-O 3.01Å; V43-V173 PolarHBondContact N-O 3.08Å; F45-V173 HydrophobicContact CE2-CG1 4.45Å; S51-V173 VanDerWaalsContact OG-CB 3.27Å; S51-V173 WeakPolarHBondContact OG-CB 3.3Å; S51-V173 WeakPolarHBondContact OG-CG1 2.99Å; L52-V173 HydrophobicContact CD2-CG2 4.43Å; L55-V173 HydrophobicContact CD1-CG1 4.18Å; L55-V173 HydrophobicContact CD1-CG2 4.13Å; L55-V173 HydrophobicContact CD2-CG1 4.03Å; L55-V173 HydrophobicContact CG-CG1 3.99Å; V173-T185 HydrophobicContact CG1-CG2 3.45Å; V173-T185 VanDerWaalsContact CG1-CG2 3.45Å; V173-L186 CarbonylContact C-O 3.45Å; V173-L186 WeakPolarHBondContact CA-O 3.39Å
174	V	95.8	Very high	84	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	124.4	-172.1	-176.9	0	0	0	0	110.6	L172 V176 T185 L186 V188 L238 V249	L172-V174 HydrophobicContact CB-CG2 4.47Å; L172-V174 HydrophobicContact CD2-CG2 3.93Å; L172-V174 HydrophobicContact CG-CG2 3.72Å; V174-V176 HydrophobicContact CG1-CG2 4.15Å; V174-T185 WeakPolarHBondContact O-CA 3.24Å; V174-L186 PolarHBondContact N-O 2.86Å; V174-L186 PolarHBondContact O-N 3.35Å; V174-V188 HydrophobicContact CB-CG2 4.25Å; V174-V188 HydrophobicContact CG2-CB 4.14Å; V174-V188 HydrophobicContact CG2-CG2 3.92Å; V174-L238 HydrophobicContact CG1-CD1 4.05Å; V174-L238 HydrophobicContact CG2-CD1 3.78Å; V174-V249 HydrophobicContact CG1-CB 4.44Å; V174-V249 HydrophobicContact CG1-CG2 4.03Å
175	K	97.2	Very high	85.8	Confident	41 Å²	41	53.7 Å²	53.7	18%	0.178	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	114.1	166.8	-151.1	173.9	-172.4	68.2	0	110.5	V43 G44 F45 D54 S183	V43-K175 PolarHBondContact O-N 2.95Å; G44-K175 VanDerWaalsContact O-CD 3.25Å; G44-K175 WeakPolarHBondContact O-CD 3.4Å; F45-K175 HydrophobicContact CD1-CD 4.41Å; F45-K175 HydrophobicContact CD2-CB 4.11Å; F45-K175 HydrophobicContact CE1-CD 3.96Å; F45-K175 HydrophobicContact CE1-CG 4.45Å; F45-K175 HydrophobicContact CE2-CB 3.53Å; F45-K175 HydrophobicContact CE2-CD 4.13Å; F45-K175 HydrophobicContact CE2-CG 3.96Å; F45-K175 HydrophobicContact CZ-CB 3.92Å; F45-K175 HydrophobicContact CZ-CD 3.8Å; F45-K175 HydrophobicContact CZ-CG 3.8Å; D54-K175 IonicContact OD2-NZ 2.64Å; D54-K175 PolarHBondContact OD2-NZ 2.95Å; K175-S183 VanDerWaalsContact CE-OG 3.24Å; K175-S183 WeakPolarHBondContact CE-OG 3.4Å; K175-S183 PolarHBondContact NZ-OG 3.32Å
176	V	98.1	Very high	87.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	121.3	173.8	-177.3	0	0	0	0	108.7	V174 S183 K184 L186 L201 L215 V249 F251	V174-V176 HydrophobicContact CG1-CG2 4.15Å; V176-S183 CarbonylContact O-C 3.59Å; V176-S183 WeakPolarHBondContact O-CA 3.12Å; V176-S183 WeakPolarHBondContact O-CB 3.39Å; V176-K184 PolarHBondContact N-O 2.74Å; V176-K184 PolarHBondContact O-N 3.28Å; V176-L186 HydrophobicContact CG2-CD1 4.24Å; V176-L201 HydrophobicContact CG1-CD1 4.09Å; V176-L201 HydrophobicContact CG1-CD2 4.37Å; V176-L215 HydrophobicContact CG1-CD2 4.06Å; V176-V249 HydrophobicContact CG1-CG1 4.46Å; V176-V249 HydrophobicContact CG2-CG1 4.25Å; V176-F251 HydrophobicContact CG1-CB 3.62Å
177	V	97.9	Very high	89.2	Confident	36 Å²	36	46.6 Å²	46.6	22%	0.218	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	133.1	179	-176.6	0	0	0	0	110	V249 L250 F251	V177-V249 PolarHBondContact N-O 3.37Å; V177-L250 HydrophobicContact CB-CD2 3.84Å; V177-L250 HydrophobicContact CG1-CD2 4.31Å; V177-L250 HydrophobicContact CG2-CD2 4.47Å; V177-L250 CarbonylContact O-C 3.57Å; V177-L250 WeakPolarHBondContact O-CA 3.18Å; V177-F251 PolarHBondContact O-N 3.35Å
178	M	95.2	Very high	91	Very high	32 Å²	32	45 Å²	45	16%	0.158	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	160.1	-177.1	-59.5	-61.6	-67.6	0	0	111.4	D180 G181 S182 T205 F251	M178-D180 WeakPolarHBondContact CB-OD1 3.36Å; M178-D180 PolarHBondContact O-N 3.1Å; M178-D180 VanDerWaalsContact O-N 3.16Å; M178-G181 PolarHBondContact O-N 2.94Å; M178-S182 WeakPolarHBondContact CB-OG 3.4Å; M178-S182 WeakPolarHBondContact CG-OG 3.09Å; M178-S182 PolarHBondContact N-O 2.8Å; M178-T205 HydrophobicContact CE-CG2 3.54Å; M178-T205 HydrophobicContact SD-CG2 4.31Å; M178-F251 HydrophobicContact CE-CD1 3.57Å; M178-F251 HydrophobicContact CE-CE1 3.98Å; M178-F251 HydrophobicContact SD-CB 4.19Å; M178-F251 HydrophobicContact SD-CD1 3.83Å; M178-F251 HydrophobicContact SD-CG 4.39Å
179	N	90.1	Very high	92.2	Very high	136 Å²	136	39.2 Å²	39.2	73%	0.727	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-12.8	-177.5	-164.9	48.8	0	0	0	114.7
180	D	90.3	Very high	92.9	Very high	128 Å²	128	41.2 Å²	41.2	68%	0.684	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92	-1.5	171.8	66.3	-10.3	0	0	0	113.4	M178 S182	M178-D180 WeakPolarHBondContact CB-OD1 3.36Å; M178-D180 PolarHBondContact O-N 3.1Å; M178-D180 VanDerWaalsContact O-N 3.16Å; D180-S182 VanDerWaalsContact OD1-CB 3.25Å; D180-S182 WeakPolarHBondContact OD1-CB 3.14Å; D180-S182 PolarHBondContact OD1-N 3.13Å; D180-S182 PolarHBondContact OD1-OG 3.16Å; D180-S182 PolarHBondContact OD2-OG 3.05Å
181	G	90.5	Very high	93.3	Very high	64 Å²	64	43.3 Å²	43.3	66%	0.66	24%	0.238	S	C	*	.	S	Bend	trans	86.2	-0.9	-175.3	0	0	0	0	0	114.8	M178	M178-G181 PolarHBondContact O-N 2.94Å
182	S	94.6	Very high	93.8	Very high	56 Å²	56	43.7 Å²	43.7	39%	0.392	24%	0.24	S	C	.	.			trans	-72.8	180	167.1	74.2	0	0	0	0	111.2	M178 D180	M178-S182 WeakPolarHBondContact CB-OG 3.4Å; M178-S182 WeakPolarHBondContact CG-OG 3.09Å; M178-S182 PolarHBondContact N-O 2.8Å; D180-S182 VanDerWaalsContact OD1-CB 3.25Å; D180-S182 WeakPolarHBondContact OD1-CB 3.14Å; D180-S182 PolarHBondContact OD1-N 3.13Å; D180-S182 PolarHBondContact OD1-OG 3.16Å; D180-S182 PolarHBondContact OD2-OG 3.05Å
183	S	95.5	Very high	94.1	Very high	48 Å²	48	45.1 Å²	45.1	34%	0.336	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	147.5	176.7	62	0	0	0	0	112.2	K175 V176	K175-S183 VanDerWaalsContact CE-OG 3.24Å; K175-S183 WeakPolarHBondContact CE-OG 3.4Å; K175-S183 PolarHBondContact NZ-OG 3.32Å; V176-S183 CarbonylContact O-C 3.59Å; V176-S183 WeakPolarHBondContact O-CA 3.12Å; V176-S183 WeakPolarHBondContact O-CB 3.39Å
184	K	94.7	Very high	94.5	Very high	44 Å²	44	44.8 Å²	44.8	19%	0.191	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	152.6	163	-79.3	-173.5	169.5	-72.6	0	110.7	E56 V176 L201 K204 T205	E56-K184 IonicContact OE1-NZ 3.38Å; E56-K184 PolarHBondContact OE1-NZ 2.92Å; V176-K184 PolarHBondContact N-O 2.74Å; V176-K184 PolarHBondContact O-N 3.28Å; K184-L201 HydrophobicContact CB-CD2 4.47Å; K184-L201 HydrophobicContact CD-CD2 4.37Å; K184-K204 HydrophobicContact CD-CB 3.95Å; K184-K204 WeakPolarHBondContact CE-O 3.27Å; K184-K204 PolarHBondContact NZ-O 2.77Å; K184-T205 HydrophobicContact CD-CG2 3.94Å
185	T	94.9	Very high	94.6	Very high	6 Å²	6	45.8 Å²	45.8	4%	0.037	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	124.1	-179.5	-48.4	0	0	0	0	107.4	F45 D54 L55 V173 V174	F45-T185 HydrophobicContact CE2-CG2 3.82Å; F45-T185 HydrophobicContact CZ-CG2 3.52Å; D54-T185 HydrophobicContact CB-CG2 4.31Å; D54-T185 WeakPolarHBondContact O-CB 3.49Å; D54-T185 PolarHBondContact O-OG1 2.58Å; L55-T185 HydrophobicContact CD2-CG2 3.87Å; L55-T185 HydrophobicContact CG-CG2 4Å; V173-T185 HydrophobicContact CG1-CG2 3.45Å; V173-T185 VanDerWaalsContact CG1-CG2 3.45Å; V174-T185 WeakPolarHBondContact O-CA 3.24Å
186	L	94.1	Very high	94.6	Very high	4 Å²	4	48.3 Å²	48.3	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	138.3	-176.4	-57.9	-179	0	0	0	109.8	V173 V174 V176 V188 V197 N200 L201 K204	V173-L186 CarbonylContact C-O 3.45Å; V173-L186 WeakPolarHBondContact CA-O 3.39Å; V174-L186 PolarHBondContact N-O 2.86Å; V174-L186 PolarHBondContact O-N 3.35Å; V176-L186 HydrophobicContact CG2-CD1 4.24Å; L186-V188 HydrophobicContact CB-CG2 3.96Å; L186-V197 HydrophobicContact CD1-CG1 3.76Å; L186-N200 VanDerWaalsContact CD2-OD1 3.31Å; L186-N200 WeakPolarHBondContact CD2-OD1 3.24Å; L186-L201 HydrophobicContact CD1-CD1 4.34Å; L186-L201 HydrophobicContact CD1-CD2 3.88Å; L186-L201 HydrophobicContact CD1-CG 3.86Å; L186-K204 HydrophobicContact CD2-CD 3.66Å
187	M	91.6	Very high	94.6	Very high	40 Å²	40	48.5 Å²	48.5	20%	0.197	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	122.8	159.7	178	167.8	63.7	0	0	108.2	L55 A62 L63 K171	L55-M187 HydrophobicContact CD2-CB 4.43Å; A62-M187 HydrophobicContact CB-CE 4.32Å; L63-M187 HydrophobicContact CB-CE 3.93Å; L63-M187 HydrophobicContact CB-SD 3.8Å; L63-M187 HydrophobicContact CD1-SD 3.82Å; L63-M187 HydrophobicContact CD2-SD 4.45Å; L63-M187 HydrophobicContact CG-SD 4.22Å; K171-M187 HydrophobicContact CB-CG 4.43Å; K171-M187 HydrophobicContact CD-SD 3.98Å
188	V	94.9	Very high	94.6	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.012	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	134.8	-178.9	-174.2	0	0	0	0	109.6	K171 L172 V174 L186 Q192 V197 L234 V235	K171-V188 CarbonylContact C-O 3.59Å; K171-V188 WeakPolarHBondContact CA-O 3.39Å; L172-V188 PolarHBondContact N-O 3.24Å; L172-V188 PolarHBondContact O-N 3.38Å; V174-V188 HydrophobicContact CB-CG2 4.25Å; V174-V188 HydrophobicContact CG2-CB 4.14Å; V174-V188 HydrophobicContact CG2-CG2 3.92Å; L186-V188 HydrophobicContact CB-CG2 3.96Å; V188-Q192 VanDerWaalsContact CA-OE1 3.25Å; V188-Q192 HydrophobicContact CG1-CB 4.08Å; V188-V197 HydrophobicContact CG1-CG2 3.79Å; V188-V197 HydrophobicContact CG2-CG1 4.47Å; V188-V197 HydrophobicContact CG2-CG2 4.24Å; V188-L234 HydrophobicContact CG1-CB 4.26Å; V188-L234 HydrophobicContact CG1-CD2 4.33Å; V188-L234 HydrophobicContact CG2-CD2 4.48Å; V188-V235 HydrophobicContact CB-CG2 4.47Å; V188-V235 HydrophobicContact CG1-CG2 4.02Å
189	D	91.4	Very high	94.7	Very high	34 Å²	34	46.5 Å²	46.5	18%	0.182	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	159.6	-179.4	89.6	61.7	0	0	0	113.2	V169 K170 K171 R191 Q192 V235	V169-D189 HydrophobicContact CG1-CB 3.65Å; V169-D189 WeakPolarHBondContact CG1-OD1 3.49Å; K170-D189 CarbonylContact O-C 3.51Å; K170-D189 WeakPolarHBondContact O-CA 3.21Å; K171-D189 HydrophobicContact CG-CB 3.95Å; D189-R191 PolarHBondContact O-N 3.06Å; D189-R191 WeakPolarHBondContact OD1-CA 3.46Å; D189-R191 WeakPolarHBondContact OD1-CB 3.39Å; D189-R191 VanDerWaalsContact OD1-CG 3.28Å; D189-R191 WeakPolarHBondContact OD1-CG 3.45Å; D189-R191 PolarHBondContact OD1-N 3.43Å; D189-Q192 PolarHBondContact O-N 3.27Å; D189-Q192 WeakPolarHBondContact OD2-CG 3.42Å; D189-V235 WeakPolarHBondContact O-CG2 3.18Å
190	E	91.6	Very high	94.9	Very high	59 Å²	59	42.6 Å²	42.6	28%	0.276	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-5.2	-172.5	89.6	-161	122.5	0	0	115.5	V169 K170 V235	V169-E190 WeakPolarHBondContact CA-OE1 3.42Å; V169-E190 HydrophobicContact CG1-CG 4.08Å; K170-E190 HydrophobicContact CB-CB 4.29Å; K170-E190 WeakPolarHBondContact CD-OE2 3.41Å; K170-E190 PolarHBondContact N-OE1 3.27Å; K170-E190 IonicContact NZ-OE2 2.68Å; K170-E190 PolarHBondContact NZ-OE2 3.16Å; K170-E190 PolarHBondContact O-N 2.95Å; E190-V235 HydrophobicContact CB-CB 4.2Å; E190-V235 HydrophobicContact CB-CG1 4.17Å
191	R	92.4	Very high	95.2	Very high	119 Å²	119	36.5 Å²	36.5	45%	0.449	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-18.5	172	-46.8	-179.1	179.2	-63.8	-8	112.9	K165 V169 D189 T193	K165-R191 PolarHBondContact O-NH2 3.15Å; K165-R191 VanDerWaalsContact O-NH2 3.1Å; V169-R191 HydrophobicContact CG1-CG 4.14Å; V169-R191 VanDerWaalsContact CG2-NE 3.29Å; D189-R191 PolarHBondContact O-N 3.06Å; D189-R191 WeakPolarHBondContact OD1-CA 3.46Å; D189-R191 WeakPolarHBondContact OD1-CB 3.39Å; D189-R191 VanDerWaalsContact OD1-CG 3.28Å; D189-R191 WeakPolarHBondContact OD1-CG 3.45Å; D189-R191 PolarHBondContact OD1-N 3.43Å; R191-T193 PolarHBondContact O-N 3.27Å
192	Q	96.3	Very high	95.5	Very high	58 Å²	58	34.2 Å²	34.2	27%	0.271	17%	0.172	S	C	.	.			trans	-78.8	122.3	-169.9	-75.4	177.9	-32.4	0	0	112	V188 D189 V197 N233 L234	V188-Q192 VanDerWaalsContact CA-OE1 3.25Å; V188-Q192 HydrophobicContact CG1-CB 4.08Å; D189-Q192 PolarHBondContact O-N 3.27Å; D189-Q192 WeakPolarHBondContact OD2-CG 3.42Å; Q192-V197 HydrophobicContact CB-CG2 4.42Å; Q192-N233 WeakPolarHBondContact O-CA 3.45Å; Q192-L234 PolarHBondContact O-N 3.03Å
193	T	98.3	Very high	95.4	Very high	33 Å²	33	38.2 Å²	38.2	20%	0.202	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-74.9	156.1	174.1	64.3	0	0	0	0	111.3	R191 R195 E196 V197 E232	R191-T193 PolarHBondContact O-N 3.27Å; T193-R195 PolarHBondContact O-N 2.92Å; T193-R195 VanDerWaalsContact O-N 3.17Å; T193-E196 WeakPolarHBondContact CB-OE2 3.14Å; T193-E196 PolarHBondContact N-OE2 3.45Å; T193-E196 PolarHBondContact O-N 3.23Å; T193-E196 PolarHBondContact OG1-N 2.88Å; T193-E196 PolarHBondContact OG1-OE2 3.19Å; T193-V197 PolarHBondContact O-N 3.42Å; T193-V197 VanDerWaalsContact O-N 3.13Å; T193-E232 CarbonylContact C-O 3.59Å; T193-E232 WeakPolarHBondContact CA-O 3.4Å
194	V	98.6	Very high	95.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-56	-29.6	172.4	164.5	0	0	0	0	111.9	L198 L215 F228 D230 E232 L234	V194-L198 HydrophobicContact CG1-CD1 3.92Å; V194-L198 HydrophobicContact CG1-CG 4.33Å; V194-L198 VanDerWaalsContact O-CB 3.28Å; V194-L198 WeakPolarHBondContact O-CB 3.5Å; V194-L198 WeakPolarHBondContact O-CG 3.28Å; V194-L198 PolarHBondContact O-N 3.43Å; V194-L215 HydrophobicContact CG1-CB 4.29Å; V194-L215 HydrophobicContact CG1-CD1 4.27Å; V194-L215 HydrophobicContact CG1-CG 4.42Å; V194-F228 HydrophobicContact CB-CB 4.42Å; V194-F228 HydrophobicContact CG1-CB 3.97Å; V194-F228 HydrophobicContact CG2-CB 3.77Å; V194-F228 HydrophobicContact CG2-CD1 4.37Å; V194-F228 HydrophobicContact CG2-CG 4.13Å; V194-D230 PolarHBondContact N-O 2.78Å; V194-E232 HydrophobicContact CG2-CB 4.27Å; V194-E232 WeakPolarHBondContact CG2-O 3.35Å; V194-E232 PolarHBondContact N-O 3.05Å; V194-L234 HydrophobicContact CG2-CB 4.22Å; V194-L234 HydrophobicContact CG2-CD1 4.21Å
195	R	98.1	Very high	95.3	Very high	22 Å²	22	37.6 Å²	37.6	8%	0.083	18%	0.179	C	C	.	.	H	α-helix	trans	-60.3	-45.6	171.8	-173.7	58.4	-95.1	149.7	-4.7	112.8	T193 L198 D199 D230 T419	T193-R195 PolarHBondContact O-N 2.92Å; T193-R195 VanDerWaalsContact O-N 3.17Å; R195-L198 PolarHBondContact O-N 3.19Å; R195-D199 IonicContact CZ-OD1 2.71Å; R195-D199 IonicContact NE-OD1 2.76Å; R195-D199 PolarHBondContact NE-OD1 3.4Å; R195-D199 VanDerWaalsContact NE-OD1 3.11Å; R195-D199 IonicContact NE-OD2 3.61Å; R195-D199 IonicContact NH2-OD1 3.6Å; R195-D199 PolarHBondContact NH2-OD1 3.15Å; R195-D199 PolarHBondContact O-N 3.26Å; R195-D230 HydrophobicContact CB-CB 4.12Å; R195-D230 WeakPolarHBondContact CB-O 3.48Å; R195-D230 IonicContact CZ-OD2 3.57Å; R195-D230 PolarHBondContact N-O 3.43Å; R195-D230 IonicContact NH1-OD2 2.87Å; R195-D230 PolarHBondContact NH1-OD2 2.73Å; R195-T419 HydrophobicContact CG-CG2 4.38Å
196	E	97.6	Very high	95.1	Very high	94 Å²	94	44.2 Å²	44.2	44%	0.439	21%	0.209	S	C	.	.	H	α-helix	trans	-72.3	-38.4	-177.5	-69	156.2	131.7	0	0	111.1	T193 L198 D199 N200	T193-E196 WeakPolarHBondContact CB-OE2 3.14Å; T193-E196 PolarHBondContact N-OE2 3.45Å; T193-E196 PolarHBondContact O-N 3.23Å; T193-E196 PolarHBondContact OG1-N 2.88Å; T193-E196 PolarHBondContact OG1-OE2 3.19Å; E196-L198 VanDerWaalsContact C-N 3.34Å; E196-D199 PolarHBondContact O-N 2.91Å; E196-N200 PolarHBondContact O-N 3.43Å
197	V	98	Very high	95	Very high	4 Å²	4	45 Å²	45	2%	0.024	22%	0.215	C	C	.	.	H	α-helix	trans	-66.2	-37	172.5	-174.4	0	0	0	0	111.3	L186 V188 Q192 T193 N200 L201 L215 L234	L186-V197 HydrophobicContact CD1-CG1 3.76Å; V188-V197 HydrophobicContact CG1-CG2 3.79Å; V188-V197 HydrophobicContact CG2-CG1 4.47Å; V188-V197 HydrophobicContact CG2-CG2 4.24Å; Q192-V197 HydrophobicContact CB-CG2 4.42Å; T193-V197 PolarHBondContact O-N 3.42Å; T193-V197 VanDerWaalsContact O-N 3.13Å; V197-N200 PolarHBondContact O-N 3.02Å; V197-L201 HydrophobicContact CG1-CD1 4.3Å; V197-L201 WeakPolarHBondContact O-CB 3.41Å; V197-L201 WeakPolarHBondContact O-CG 3.37Å; V197-L201 PolarHBondContact O-N 3.03Å; V197-L215 HydrophobicContact CB-CD1 4.2Å; V197-L215 HydrophobicContact CG1-CD1 3.89Å; V197-L234 HydrophobicContact CB-CD2 4.26Å; V197-L234 HydrophobicContact CG1-CD2 3.91Å; V197-L234 HydrophobicContact CG2-CB 4.42Å; V197-L234 HydrophobicContact CG2-CD2 3.94Å
198	L	98	Very high	95	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.9	-39.1	172.4	-77.5	170.3	0	0	0	112.5	V194 R195 E196 L201 F202 L215 F251	V194-L198 HydrophobicContact CG1-CD1 3.92Å; V194-L198 HydrophobicContact CG1-CG 4.33Å; V194-L198 VanDerWaalsContact O-CB 3.28Å; V194-L198 WeakPolarHBondContact O-CB 3.5Å; V194-L198 WeakPolarHBondContact O-CG 3.28Å; V194-L198 PolarHBondContact O-N 3.43Å; R195-L198 PolarHBondContact O-N 3.19Å; E196-L198 VanDerWaalsContact C-N 3.34Å; L198-L201 PolarHBondContact O-N 3.04Å; L198-F202 WeakPolarHBondContact O-CD1 3.48Å; L198-F202 WeakPolarHBondContact O-CG 3.46Å; L198-F202 PolarHBondContact O-N 3.45Å; L198-L215 HydrophobicContact CD2-CD2 4.37Å; L198-L215 HydrophobicContact CD2-CG 4.02Å; L198-L215 HydrophobicContact CG-CG 4.26Å; L198-F251 HydrophobicContact CD2-CD2 3.78Å; L198-F251 HydrophobicContact CD2-CE2 3.64Å
199	D	96.4	Very high	94.9	Very high	25 Å²	25	48.3 Å²	48.3	13%	0.134	23%	0.234	C	C	.	.	H	α-helix	trans	-63.3	-44.7	175.3	-69.3	-24.9	0	0	0	111.4	R195 E196 L201 F202 E203 K423	R195-D199 IonicContact CZ-OD1 2.71Å; R195-D199 IonicContact NE-OD1 2.76Å; R195-D199 PolarHBondContact NE-OD1 3.4Å; R195-D199 VanDerWaalsContact NE-OD1 3.11Å; R195-D199 IonicContact NE-OD2 3.61Å; R195-D199 IonicContact NH2-OD1 3.6Å; R195-D199 PolarHBondContact NH2-OD1 3.15Å; R195-D199 PolarHBondContact O-N 3.26Å; E196-D199 PolarHBondContact O-N 2.91Å; D199-L201 VanDerWaalsContact C-N 3.33Å; D199-L201 PolarHBondContact O-N 3.42Å; D199-F202 WeakPolarHBondContact O-CB 3.37Å; D199-F202 PolarHBondContact O-N 3.48Å; D199-F202 VanDerWaalsContact O-N 3.14Å; D199-E203 PolarHBondContact O-N 3.06Å; D199-K423 VanDerWaalsContact CG-NZ 3.34Å; D199-K423 IonicContact OD1-NZ 2.63Å; D199-K423 VanDerWaalsContact OD2-CE 3.27Å; D199-K423 WeakPolarHBondContact OD2-CE 3.39Å; D199-K423 IonicContact OD2-NZ 2.81Å; D199-K423 PolarHBondContact OD2-NZ 2.91Å
200	N	95.6	Very high	95.1	Very high	55 Å²	55	48.3 Å²	48.3	29%	0.294	23%	0.234	S	C	.	.	H	α-helix	trans	-61.7	-39.7	175	-175.3	-87.2	0	0	0	112.1	L186 E196 V197 E203 K204	L186-N200 VanDerWaalsContact CD2-OD1 3.31Å; L186-N200 WeakPolarHBondContact CD2-OD1 3.24Å; E196-N200 PolarHBondContact O-N 3.43Å; V197-N200 PolarHBondContact O-N 3.02Å; N200-E203 PolarHBondContact O-N 2.86Å; N200-K204 WeakPolarHBondContact O-CB 3.27Å; N200-K204 WeakPolarHBondContact O-CG 3.28Å; N200-K204 PolarHBondContact O-N 3.13Å; N200-K204 VanDerWaalsContact OD1-CD 3.3Å; N200-K204 WeakPolarHBondContact OD1-CD 3.45Å; N200-K204 WeakPolarHBondContact OD1-CE 3.33Å
201	L	96.8	Very high	95.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.5	-38.1	172.7	-75.9	165.9	0	0	0	112.4	V176 K184 L186 V197 L198 D199 E203 K204 T205 L215 F251	V176-L201 HydrophobicContact CG1-CD1 4.09Å; V176-L201 HydrophobicContact CG1-CD2 4.37Å; K184-L201 HydrophobicContact CB-CD2 4.47Å; K184-L201 HydrophobicContact CD-CD2 4.37Å; L186-L201 HydrophobicContact CD1-CD1 4.34Å; L186-L201 HydrophobicContact CD1-CD2 3.88Å; L186-L201 HydrophobicContact CD1-CG 3.86Å; V197-L201 HydrophobicContact CG1-CD1 4.3Å; V197-L201 WeakPolarHBondContact O-CB 3.41Å; V197-L201 WeakPolarHBondContact O-CG 3.37Å; V197-L201 PolarHBondContact O-N 3.03Å; L198-L201 PolarHBondContact O-N 3.04Å; D199-L201 VanDerWaalsContact C-N 3.33Å; D199-L201 PolarHBondContact O-N 3.42Å; L201-E203 VanDerWaalsContact C-N 3.33Å; L201-E203 PolarHBondContact O-N 3.34Å; L201-K204 PolarHBondContact O-N 2.86Å; L201-T205 VanDerWaalsContact O-CB 3.23Å; L201-T205 WeakPolarHBondContact O-CB 3.22Å; L201-T205 WeakPolarHBondContact O-CG2 3.09Å; L201-T205 PolarHBondContact O-N 3.16Å; L201-T205 PolarHBondContact O-OG1 3.17Å; L201-L215 HydrophobicContact CD1-CD2 3.66Å; L201-F251 HydrophobicContact CB-CD2 4.26Å; L201-F251 HydrophobicContact CB-CE2 3.99Å; L201-F251 HydrophobicContact CB-CZ 4.36Å; L201-F251 HydrophobicContact CD1-CB 4.41Å; L201-F251 HydrophobicContact CD1-CD2 3.71Å; L201-F251 HydrophobicContact CD1-CE2 4.24Å; L201-F251 HydrophobicContact CD1-CG 4.21Å
202	F	95.9	Very high	95.6	Very high	15 Å²	15	41.8 Å²	41.8	7%	0.066	21%	0.211	C	C	.	.	H	α-helix	trans	-60.7	-44.7	175.1	-68.4	-2.7	0	0	0	110.9	L198 D199 H206 C207 C209 W213 F251	L198-F202 WeakPolarHBondContact O-CD1 3.48Å; L198-F202 WeakPolarHBondContact O-CG 3.46Å; L198-F202 PolarHBondContact O-N 3.45Å; D199-F202 WeakPolarHBondContact O-CB 3.37Å; D199-F202 PolarHBondContact O-N 3.48Å; D199-F202 VanDerWaalsContact O-N 3.14Å; F202-H206 WeakPolarHBondContact O-CA 3.11Å; F202-H206 PolarHBondContact O-N 2.68Å; F202-C207 WeakPolarHBondContact CD1-SG 3.19Å; F202-C209 HydrophobicContact CD2-CB 3.65Å; F202-C209 HydrophobicContact CE2-CB 3.76Å; F202-C209 HydrophobicContact CG-CB 4.29Å; F202-W213 HydrophobicContact CE1-CB 3.59Å; F202-W213 AromaticContact CE1-CG 3.98Å; F202-W213 HydrophobicContact CE1-CG 3.98Å; F202-W213 HydrophobicContact CZ-CB 3.85Å; F202-W213 HydrophobicContact CZ-CG 4.42Å; F202-F251 HydrophobicContact CD1-CE2 4.2Å; F202-F251 HydrophobicContact CD1-CZ 4.05Å; F202-F251 AromaticContact CE1-CE2 4Å; F202-F251 HydrophobicContact CE1-CE2 4Å; F202-F251 HydrophobicContact CE1-CZ 4.05Å
203	E	92.9	Very high	95.7	Very high	141 Å²	141	41 Å²	41	66%	0.659	21%	0.205	S	C	*	.	H	α-helix	trans	-62.6	-48.3	175.5	-70.2	177.1	-177.3	0	0	112.1	D199 N200 L201 T205 H206	D199-E203 PolarHBondContact O-N 3.06Å; N200-E203 PolarHBondContact O-N 2.86Å; L201-E203 VanDerWaalsContact C-N 3.33Å; L201-E203 PolarHBondContact O-N 3.34Å; E203-T205 PolarHBondContact O-N 3.14Å; E203-H206 PolarHBondContact O-CE1 3.05Å; E203-H206 PolarHBondContact O-ND1 3.15Å
204	K	93.6	Very high	95.7	Very high	39 Å²	39	39.4 Å²	39.4	17%	0.17	20%	0.196	C	C	.	.	H	α-helix	trans	-74.9	-16.4	-177.9	-71	177.8	-174.5	-105.3	0	114.8	E56 D59 K184 L186 N200 L201	E56-K204 IonicContact OE2-NZ 3.69Å; E56-K204 PolarHBondContact OE2-NZ 2.88Å; D59-K204 IonicContact OD1-NZ 2.87Å; D59-K204 PolarHBondContact OD1-NZ 3.32Å; D59-K204 IonicContact OD2-NZ 3.88Å; D59-K204 PolarHBondContact OD2-NZ 3.28Å; K184-K204 HydrophobicContact CD-CB 3.95Å; K184-K204 WeakPolarHBondContact CE-O 3.27Å; K184-K204 PolarHBondContact NZ-O 2.77Å; L186-K204 HydrophobicContact CD2-CD 3.66Å; N200-K204 WeakPolarHBondContact O-CB 3.27Å; N200-K204 WeakPolarHBondContact O-CG 3.28Å; N200-K204 PolarHBondContact O-N 3.13Å; N200-K204 VanDerWaalsContact OD1-CD 3.3Å; N200-K204 WeakPolarHBondContact OD1-CD 3.45Å; N200-K204 WeakPolarHBondContact OD1-CE 3.33Å; L201-K204 PolarHBondContact O-N 2.86Å
205	T	93.6	Very high	95.7	Very high	39 Å²	39	39.4 Å²	39.4	24%	0.239	20%	0.196	C	C	.	.	H	α-helix	trans	-113.5	-17.2	-176.8	65.4	0	0	0	0	114.3	M178 K184 L201 E203 C207	M178-T205 HydrophobicContact CE-CG2 3.54Å; M178-T205 HydrophobicContact SD-CG2 4.31Å; K184-T205 HydrophobicContact CD-CG2 3.94Å; L201-T205 VanDerWaalsContact O-CB 3.23Å; L201-T205 WeakPolarHBondContact O-CB 3.22Å; L201-T205 WeakPolarHBondContact O-CG2 3.09Å; L201-T205 PolarHBondContact O-N 3.16Å; L201-T205 PolarHBondContact O-OG1 3.17Å; E203-T205 PolarHBondContact O-N 3.14Å; T205-C207 PolarHBondContact O-N 3Å
206	H	91.4	Very high	95.7	Very high	145 Å²	145	38.3 Å²	38.3	67%	0.671	19%	0.192	S	C	*	.			trans	56.1	31.3	-176.7	-50.6	-31.3	0	0	0	114.4	F202 E203	F202-H206 WeakPolarHBondContact O-CA 3.11Å; F202-H206 PolarHBondContact O-N 2.68Å; E203-H206 PolarHBondContact O-CE1 3.05Å; E203-H206 PolarHBondContact O-ND1 3.15Å
207	C	91.9	Very high	95.7	Very high	22 Å²	22	34.1 Å²	34.1	15%	0.149	17%	0.172	C	C	.	.			trans	-65.2	167.7	171.9	73.6	0	0	0	0	112.2	F202 T205 C209 W213	F202-C207 WeakPolarHBondContact CD1-SG 3.19Å; T205-C207 PolarHBondContact O-N 3Å; C207-C209 PolarHBondContact O-N 3.1Å; C207-C209 PolarHBondContact O-SG 3.12Å; C207-C209 VanDerWaalsContact O-SG 3.32Å; C207-W213 HydrophobicContact CB-CZ2 4.08Å
208	D	91.3	Very high	95.7	Very high	97 Å²	97	35 Å²	35	52%	0.519	18%	0.177	S	C	.	.			trans	-66	-4.1	-179.9	71.7	-13.6	0	0	0	115	N210 W213	D208-N210 VanDerWaalsContact CG-ND2 3.32Å; D208-N210 PolarHBondContact O-N 2.79Å; D208-N210 PolarHBondContact OD1-N 2.83Å; D208-N210 VanDerWaalsContact OD1-N 3.1Å; D208-N210 PolarHBondContact OD1-ND2 3.33Å; D208-N210 WeakPolarHBondContact OD2-CB 3.01Å; D208-N210 PolarHBondContact OD2-ND2 3.43Å; D208-W213 PolarHBondContact OD1-NE1 3.39Å
209	C	94.3	Very high	95.6	Very high	13 Å²	13	35.2 Å²	35.2	9%	0.088	18%	0.179	C	C	.	.			trans	59	24.6	-178.8	-52.5	0	0	0	0	114	F202 C207 A424 S427	F202-C209 HydrophobicContact CD2-CB 3.65Å; F202-C209 HydrophobicContact CE2-CB 3.76Å; F202-C209 HydrophobicContact CG-CB 4.29Å; C207-C209 PolarHBondContact O-N 3.1Å; C207-C209 PolarHBondContact O-SG 3.12Å; C207-C209 VanDerWaalsContact O-SG 3.32Å; C209-A424 VanDerWaalsContact O-CB 3.28Å; C209-A424 WeakPolarHBondContact O-CB 3.49Å; C209-S427 WeakPolarHBondContact CB-OG 3.31Å; C209-S427 VanDerWaalsContact SG-CB 3.6Å; C209-S427 PolarHBondContact SG-OG 3.28Å
210	N	95.4	Very high	95.6	Very high	34 Å²	34	37.9 Å²	37.9	18%	0.182	19%	0.19	C	C	.	.			trans	-63.7	158	-179.9	81.4	55.9	0	0	0	113.1	D208 D212 W213 E253	D208-N210 VanDerWaalsContact CG-ND2 3.32Å; D208-N210 PolarHBondContact O-N 2.79Å; D208-N210 PolarHBondContact OD1-N 2.83Å; D208-N210 VanDerWaalsContact OD1-N 3.1Å; D208-N210 PolarHBondContact OD1-ND2 3.33Å; D208-N210 WeakPolarHBondContact OD2-CB 3.01Å; D208-N210 PolarHBondContact OD2-ND2 3.43Å; N210-D212 PolarHBondContact O-N 3.44Å; N210-D212 VanDerWaalsContact O-N 3.16Å; N210-D212 WeakPolarHBondContact OD1-CA 3.5Å; N210-D212 WeakPolarHBondContact OD1-CB 3.5Å; N210-D212 PolarHBondContact OD1-N 3.45Å; N210-W213 PolarHBondContact ND2-NE1 3.4Å; N210-W213 PolarHBondContact O-N 3.37Å; N210-W213 PolarHBondContact OD1-N 2.92Å; N210-E253 PolarHBondContact ND2-OE1 2.71Å
211	V	97	Very high	95.5	Very high	25 Å²	25	39.4 Å²	39.4	15%	0.152	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-14.3	-173	-58.2	0	0	0	0	114.6	F258 F417 A420 E421 A424	V211-F258 HydrophobicContact CB-CD2 4.43Å; V211-F258 WeakPolarHBondContact O-CD2 3.25Å; V211-F258 VanDerWaalsContact O-CE2 3.31Å; V211-F258 WeakPolarHBondContact O-CE2 3.42Å; V211-F417 HydrophobicContact CG2-CE2 4.45Å; V211-A420 HydrophobicContact CB-CB 4.25Å; V211-A420 HydrophobicContact CG1-CB 4.09Å; V211-E421 HydrophobicContact CG1-CG 4.29Å; V211-A424 HydrophobicContact CG1-CB 4.14Å
212	D	97.1	Very high	95.5	Very high	17 Å²	17	39.5 Å²	39.5	9%	0.091	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-17.5	-178.6	-64.4	-39.3	0	0	0	112.2	N210 S214 E253 R254 K255 K262	N210-D212 PolarHBondContact O-N 3.44Å; N210-D212 VanDerWaalsContact O-N 3.16Å; N210-D212 WeakPolarHBondContact OD1-CA 3.5Å; N210-D212 WeakPolarHBondContact OD1-CB 3.5Å; N210-D212 PolarHBondContact OD1-N 3.45Å; D212-S214 PolarHBondContact O-N 3.37Å; D212-S214 PolarHBondContact O-OG 2.77Å; D212-E253 HydrophobicContact CB-CB 4.37Å; D212-E253 CarbonylContact O-C 3.54Å; D212-E253 WeakPolarHBondContact O-CA 3.48Å; D212-R254 PolarHBondContact O-N 2.72Å; D212-K255 HydrophobicContact CB-CG 4.23Å; D212-K262 IonicContact OD1-NZ 2.88Å; D212-K262 PolarHBondContact OD1-NZ 3.01Å; D212-K262 IonicContact OD2-NZ 2.65Å; D212-K262 PolarHBondContact OD2-NZ 3.11Å
213	W	97.9	Very high	95.6	Very high	40 Å²	40	41.6 Å²	41.6	15%	0.152	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	131.7	174	-74.6	106.3	0	0	0	112.6	F202 C207 D208 N210 F251 E253	F202-W213 HydrophobicContact CE1-CB 3.59Å; F202-W213 AromaticContact CE1-CG 3.98Å; F202-W213 HydrophobicContact CE1-CG 3.98Å; F202-W213 HydrophobicContact CZ-CB 3.85Å; F202-W213 HydrophobicContact CZ-CG 4.42Å; C207-W213 HydrophobicContact CB-CZ2 4.08Å; D208-W213 PolarHBondContact OD1-NE1 3.39Å; N210-W213 PolarHBondContact ND2-NE1 3.4Å; N210-W213 PolarHBondContact O-N 3.37Å; N210-W213 PolarHBondContact OD1-N 2.92Å; W213-F251 HydrophobicContact CB-CE2 4.27Å; W213-F251 HydrophobicContact CB-CZ 4.4Å; W213-F251 HydrophobicContact CD2-CE1 4.08Å; W213-F251 HydrophobicContact CD2-CE2 4.36Å; W213-F251 AromaticContact CD2-CZ 3.76Å; W213-F251 HydrophobicContact CD2-CZ 3.76Å; W213-F251 AromaticContact CE3-CD1 3.85Å; W213-F251 HydrophobicContact CE3-CD1 3.85Å; W213-F251 HydrophobicContact CE3-CD2 4.34Å; W213-F251 AromaticContact CE3-CE1 3.35Å; W213-F251 HydrophobicContact CE3-CE1 3.35Å; W213-F251 AromaticContact CE3-CE2 3.89Å; W213-F251 HydrophobicContact CE3-CE2 3.89Å; W213-F251 HydrophobicContact CE3-CG 4.33Å; W213-F251 AromaticContact CE3-CZ 3.37Å; W213-F251 HydrophobicContact CE3-CZ 3.37Å; W213-F251 HydrophobicContact CG-CZ 4.2Å; W213-F251 HydrophobicContact CH2-CE1 4.11Å; W213-F251 AromaticContact CZ3-CD1 3.7Å; W213-F251 HydrophobicContact CZ3-CD1 3.7Å; W213-F251 AromaticContact CZ3-CE1 3.36Å; W213-F251 HydrophobicContact CZ3-CE1 3.36Å; W213-F251 AromaticContact CZ3-CZ 3.92Å; W213-F251 HydrophobicContact CZ3-CZ 3.92Å; W213-E253 HydrophobicContact CD2-CG 4.26Å; W213-E253 HydrophobicContact CE3-CG 4.45Å; W213-E253 HydrophobicContact CZ2-CG 4.3Å
214	S	98.3	Very high	95.8	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	150.4	-168.9	-60.3	0	0	0	0	112.6	D212 Q252 K257	D212-S214 PolarHBondContact O-N 3.37Å; D212-S214 PolarHBondContact O-OG 2.77Å; S214-Q252 PolarHBondContact N-O 3.26Å; S214-Q252 PolarHBondContact O-N 2.77Å; S214-K257 WeakPolarHBondContact OG-CD 3.45Å; S214-K257 PolarHBondContact OG-NZ 2.78Å; S214-K257 VanDerWaalsContact OG-NZ 3.09Å
215	L	98.6	Very high	96	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	139.3	159.1	-63.9	-176.4	0	0	0	109.7	V176 V194 V197 L198 L201 F228 L234 V249 L250 F251	V176-L215 HydrophobicContact CG1-CD2 4.06Å; V194-L215 HydrophobicContact CG1-CB 4.29Å; V194-L215 HydrophobicContact CG1-CD1 4.27Å; V194-L215 HydrophobicContact CG1-CG 4.42Å; V197-L215 HydrophobicContact CB-CD1 4.2Å; V197-L215 HydrophobicContact CG1-CD1 3.89Å; L198-L215 HydrophobicContact CD2-CD2 4.37Å; L198-L215 HydrophobicContact CD2-CG 4.02Å; L198-L215 HydrophobicContact CG-CG 4.26Å; L201-L215 HydrophobicContact CD1-CD2 3.66Å; L215-F228 HydrophobicContact CB-CB 4.49Å; L215-F228 HydrophobicContact CB-CD2 3.8Å; L215-F228 PolarHBondContact O-N 3.02Å; L215-L234 HydrophobicContact CD1-CD1 4.31Å; L215-L234 HydrophobicContact CD1-CD2 3.82Å; L215-V249 HydrophobicContact CB-CG1 4.39Å; L215-V249 HydrophobicContact CD1-CG1 4.42Å; L215-V249 HydrophobicContact CD2-CG1 4Å; L215-L250 CarbonylContact C-O 3.56Å; L215-L250 VanDerWaalsContact CA-O 3.31Å; L215-L250 WeakPolarHBondContact CA-O 3.28Å; L215-F251 HydrophobicContact CD2-CB 4.21Å; L215-F251 HydrophobicContact CD2-CD2 4.24Å
216	C	98.1	Very high	96.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	139.9	170.5	-58.7	0	0	0	0	110	R226 V249 L250	C216-R226 CarbonylContact C-O 3.57Å; C216-R226 WeakPolarHBondContact CA-O 3.01Å; C216-R226 WeakPolarHBondContact CB-O 3.24Å; C216-V249 CarbonylContact O-C 3.58Å; C216-V249 WeakPolarHBondContact O-CA 3.36Å; C216-L250 HydrophobicContact CB-CB 4.39Å; C216-L250 PolarHBondContact N-O 2.79Å; C216-L250 PolarHBondContact O-N 2.96Å
217	E	97.5	Very high	96.6	Very high	5 Å²	5	26.8 Å²	26.8	2%	0.023	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	142.5	162.3	60.1	169.8	178.5	0	0	111	E225 R226 F228 W241 Y355	E217-E225 CarbonylContact O-C 3.53Å; E217-E225 VanDerWaalsContact O-CA 3.23Å; E217-E225 WeakPolarHBondContact O-CA 3.46Å; E217-R226 HydrophobicContact CG-CG 3.63Å; E217-R226 PolarHBondContact N-O 2.81Å; E217-R226 PolarHBondContact O-N 2.98Å; E217-R226 IonicContact OE1-CZ 3.77Å; E217-R226 IonicContact OE1-NE 2.64Å; E217-R226 PolarHBondContact OE1-NE 3.31Å; E217-R226 IonicContact OE1-NH2 3.11Å; E217-F228 HydrophobicContact CB-CE2 3.67Å; E217-F228 HydrophobicContact CB-CZ 3.68Å; E217-F228 HydrophobicContact CG-CE1 4.46Å; E217-F228 HydrophobicContact CG-CE2 4.15Å; E217-F228 HydrophobicContact CG-CZ 3.91Å; E217-W241 HydrophobicContact CB-CZ2 3.89Å; E217-W241 PolarHBondContact OE2-NE1 3.26Å; E217-Y355 HydrophobicContact CG-CE1 4.22Å; E217-Y355 WeakPolarHBondContact OE1-CE1 3.28Å; E217-Y355 VanDerWaalsContact OE1-CZ 3.28Å; E217-Y355 PolarHBondContact OE1-OH 2.93Å
218	T	97.5	Very high	96.9	Very high	22 Å²	22	25.8 Å²	25.8	14%	0.135	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	131.2	166.7	52.3	0	0	0	0	109.2	L224 E225 N247 K248 L250	T218-L224 WeakPolarHBondContact CA-O 3.36Å; T218-E225 HydrophobicContact CG2-CB 3.98Å; T218-N247 WeakPolarHBondContact O-CA 3.44Å; T218-N247 WeakPolarHBondContact O-CB 3.41Å; T218-K248 PolarHBondContact N-O 2.82Å; T218-K248 PolarHBondContact O-N 3.4Å; T218-K248 WeakPolarHBondContact OG1-CB 3.35Å; T218-K248 PolarHBondContact OG1-N 2.97Å; T218-K248 PolarHBondContact OG1-O 3.3Å; T218-L250 HydrophobicContact CG2-CD1 3.68Å; T218-L250 HydrophobicContact CG2-CG 4.2Å
219	N	97.2	Very high	97.2	Very high	5 Å²	5	21.3 Å²	21.3	3%	0.027	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	117.2	166.9	174.1	-62.4	0	0	0	108.9	E221 L222 Q223 L224 N247 Q380	N219-E221 PolarHBondContact OD1-N 3.13Å; N219-L222 VanDerWaalsContact OD1-CB 3.22Å; N219-L222 WeakPolarHBondContact OD1-CB 3.27Å; N219-L222 WeakPolarHBondContact OD1-CG 3.46Å; N219-L222 PolarHBondContact OD1-N 3.08Å; N219-Q223 WeakPolarHBondContact O-CA 3.45Å; N219-Q223 PolarHBondContact O-N 3.12Å; N219-L224 PolarHBondContact N-O 3.24Å; N219-L224 PolarHBondContact O-N 2.61Å; N219-N247 VanDerWaalsContact CA-OD1 3.24Å; N219-N247 WeakPolarHBondContact CA-OD1 3.1Å; N219-Q380 PolarHBondContact ND2-O 3.08Å; N219-Q380 PolarHBondContact ND2-OE1 3.06Å
220	H	95.1	Very high	97.4	Very high	81 Å²	81	20.8 Å²	20.8	38%	0.375	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-31.7	-171.9	-168.7	74.6	0	0	0	113.7	Q223 E246 N247	H220-Q223 WeakPolarHBondContact O-CG 3.09Å; H220-Q223 PolarHBondContact O-NE2 3.41Å; H220-E246 HydrophobicContact CB-CB 3.72Å; H220-E246 IonicContact CD2-OE1 3.34Å; H220-N247 PolarHBondContact N-OD1 3.12Å
221	E	94.9	Very high	97.6	Very high	87 Å²	87	22.2 Å²	22.2	41%	0.407	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-51.4	-177.8	-162.1	-176.4	117.7	0	0	110.7	N219 Q223 R363 K381	N219-E221 PolarHBondContact OD1-N 3.13Å; E221-Q223 VanDerWaalsContact C-N 3.35Å; E221-R363 PolarHBondContact O-NH1 3.32Å; E221-K381 VanDerWaalsContact OE1-CA 3.28Å; E221-K381 WeakPolarHBondContact OE1-CA 3.44Å; E221-K381 WeakPolarHBondContact OE1-CB 3.44Å; E221-K381 VanDerWaalsContact OE1-CG 3.27Å; E221-K381 WeakPolarHBondContact OE1-CG 3.12Å; E221-K381 VanDerWaalsContact OE2-CD 3.3Å; E221-K381 WeakPolarHBondContact OE2-CD 3.29Å; E221-K381 WeakPolarHBondContact OE2-CE 3.34Å; E221-K381 WeakPolarHBondContact OE2-CG 3.07Å; E221-K381 IonicContact OE2-NZ 3.98Å; E221-K381 PolarHBondContact OE2-NZ 3.42Å
222	L	96.1	Very high	97.6	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.016	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-18.9	177.9	-59.6	171.6	0	0	0	113.3	N219 L224 R363 K375 E382 I386	N219-L222 VanDerWaalsContact OD1-CB 3.22Å; N219-L222 WeakPolarHBondContact OD1-CB 3.27Å; N219-L222 WeakPolarHBondContact OD1-CG 3.46Å; N219-L222 PolarHBondContact OD1-N 3.08Å; L222-L224 HydrophobicContact CB-CD1 3.92Å; L222-L224 HydrophobicContact CB-CG 3.72Å; L222-L224 HydrophobicContact CD1-CD1 3.93Å; L222-R363 PolarHBondContact O-NH1 2.89Å; L222-K375 HydrophobicContact CD1-CD 4.01Å; L222-E382 HydrophobicContact CD2-CB 4.38Å; L222-I386 HydrophobicContact CD1-CD1 3.77Å; L222-I386 HydrophobicContact CD2-CD1 3.55Å; L222-I386 HydrophobicContact CG-CD1 4.32Å
223	Q	97.6	Very high	97.6	Very high	59 Å²	59	24.2 Å²	24.2	28%	0.276	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	57.6	-170.7	-63.3	-168.9	-2.6	0	0	113.1	N219 H220 E221 K358	N219-Q223 WeakPolarHBondContact O-CA 3.45Å; N219-Q223 PolarHBondContact O-N 3.12Å; H220-Q223 WeakPolarHBondContact O-CG 3.09Å; H220-Q223 PolarHBondContact O-NE2 3.41Å; E221-Q223 VanDerWaalsContact C-N 3.35Å; Q223-K358 HydrophobicContact CB-CB 4.35Å; Q223-K358 PolarHBondContact O-N 3.33Å
224	L	98.1	Very high	97.5	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.01	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	152.9	172.2	-55.7	-178.5	0	0	0	109.7	T218 N219 L222 Y355 Y356 V373 K375 Y388	T218-L224 WeakPolarHBondContact CA-O 3.36Å; N219-L224 PolarHBondContact N-O 3.24Å; N219-L224 PolarHBondContact O-N 2.61Å; L222-L224 HydrophobicContact CB-CD1 3.92Å; L222-L224 HydrophobicContact CB-CG 3.72Å; L222-L224 HydrophobicContact CD1-CD1 3.93Å; L224-Y355 HydrophobicContact CB-CD1 3.94Å; L224-Y355 HydrophobicContact CB-CG 4.16Å; L224-Y355 HydrophobicContact CD1-CG 4.28Å; L224-Y356 CarbonylContact C-O 3.57Å; L224-Y356 WeakPolarHBondContact CA-O 3.19Å; L224-V373 HydrophobicContact CD1-CB 4.35Å; L224-V373 HydrophobicContact CD1-CG1 3.93Å; L224-V373 HydrophobicContact CD2-CB 3.85Å; L224-V373 HydrophobicContact CD2-CG1 4.01Å; L224-V373 HydrophobicContact CD2-CG2 3.61Å; L224-K375 HydrophobicContact CD1-CD 3.94Å; L224-Y388 HydrophobicContact CD2-CE1 4.4Å
225	E	97.8	Very high	97.3	Very high	35 Å²	35	22.4 Å²	22.4	16%	0.164	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	152.4	164.7	76.5	-169.8	150.7	0	0	111.4	E217 T218 Y355 Y356 K358	E217-E225 CarbonylContact O-C 3.53Å; E217-E225 VanDerWaalsContact O-CA 3.23Å; E217-E225 WeakPolarHBondContact O-CA 3.46Å; T218-E225 HydrophobicContact CG2-CB 3.98Å; E225-Y355 CarbonylContact O-C 3.54Å; E225-Y355 WeakPolarHBondContact O-CA 3.3Å; E225-Y356 PolarHBondContact N-O 3.14Å; E225-Y356 PolarHBondContact O-N 3.2Å; E225-K358 WeakPolarHBondContact OE1-CE 3.29Å; E225-K358 IonicContact OE1-NZ 2.68Å; E225-K358 PolarHBondContact OE1-NZ 2.92Å; E225-K358 WeakPolarHBondContact OE2-CE 3.08Å; E225-K358 IonicContact OE2-NZ 3.31Å; E225-K358 PolarHBondContact OE2-NZ 2.74Å
226	R	98.1	Very high	97	Very high	6 Å²	6	29.1 Å²	29.1	2%	0.023	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	155.4	165.7	70.5	174.3	-173.2	104.3	-4.1	110.7	C216 E217 E232 N353 V354 Y355	C216-R226 CarbonylContact C-O 3.57Å; C216-R226 WeakPolarHBondContact CA-O 3.01Å; C216-R226 WeakPolarHBondContact CB-O 3.24Å; E217-R226 HydrophobicContact CG-CG 3.63Å; E217-R226 PolarHBondContact N-O 2.81Å; E217-R226 PolarHBondContact O-N 2.98Å; E217-R226 IonicContact OE1-CZ 3.77Å; E217-R226 IonicContact OE1-NE 2.64Å; E217-R226 PolarHBondContact OE1-NE 3.31Å; E217-R226 IonicContact OE1-NH2 3.11Å; R226-E232 IonicContact CZ-OE1 3.95Å; R226-E232 IonicContact CZ-OE2 2.68Å; R226-E232 VanDerWaalsContact CZ-OE2 3.31Å; R226-E232 VanDerWaalsContact NH1-CD 3.3Å; R226-E232 IonicContact NH1-OE1 3.59Å; R226-E232 PolarHBondContact NH1-OE1 2.91Å; R226-E232 IonicContact NH1-OE2 2.73Å; R226-E232 PolarHBondContact NH1-OE2 2.78Å; R226-E232 IonicContact NH2-OE1 2.68Å; R226-E232 IonicContact NH2-OE2 2.61Å; R226-E232 PolarHBondContact NH2-OE2 2.76Å; R226-N353 VanDerWaalsContact CZ-ND2 3.34Å; R226-N353 PolarHBondContact NH2-ND2 3Å; R226-V354 WeakPolarHBondContact CB-O 3.22Å; R226-Y355 HydrophobicContact CB-CD1 3.74Å; R226-Y355 HydrophobicContact CB-CE1 4.12Å; R226-Y355 HydrophobicContact CB-CG 4.24Å; R226-Y355 HydrophobicContact CG-CD1 3.77Å; R226-Y355 HydrophobicContact CG-CE1 3.6Å
227	T	98.4	Very high	96.7	Very high	10 Å²	10	29.7 Å²	29.7	6%	0.061	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	145.5	162.5	-36.2	0	0	0	0	108.9	R254 K257	T227-R254 HydrophobicContact CG2-CB 4.22Å; T227-R254 HydrophobicContact CG2-CG 3.95Å; T227-K257 HydrophobicContact CG2-CD 3.93Å; T227-K257 HydrophobicContact CG2-CG 4.34Å
228	F	98.6	Very high	96.6	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-82	145.8	163.6	-70.2	-83.3	0	0	0	110.2	V194 L215 E217 E232 L234 P237	V194-F228 HydrophobicContact CB-CB 4.42Å; V194-F228 HydrophobicContact CG1-CB 3.97Å; V194-F228 HydrophobicContact CG2-CB 3.77Å; V194-F228 HydrophobicContact CG2-CD1 4.37Å; V194-F228 HydrophobicContact CG2-CG 4.13Å; L215-F228 HydrophobicContact CB-CB 4.49Å; L215-F228 HydrophobicContact CB-CD2 3.8Å; L215-F228 PolarHBondContact O-N 3.02Å; E217-F228 HydrophobicContact CB-CE2 3.67Å; E217-F228 HydrophobicContact CB-CZ 3.68Å; E217-F228 HydrophobicContact CG-CE1 4.46Å; E217-F228 HydrophobicContact CG-CE2 4.15Å; E217-F228 HydrophobicContact CG-CZ 3.91Å; F228-E232 WeakPolarHBondContact CA-OE1 3.13Å; F228-L234 HydrophobicContact CD2-CD1 4.42Å; F228-L234 HydrophobicContact CE1-CD1 4.18Å; F228-L234 HydrophobicContact CE2-CD1 4.01Å; F228-L234 HydrophobicContact CZ-CD1 3.88Å; F228-P237 HydrophobicContact CE1-CB 3.87Å; F228-P237 HydrophobicContact CE1-CG 3.98Å
229	E	98.4	Very high	96.3	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.019	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-82.2	144.5	167.3	-52.6	-54.3	161.3	0	0	110.2	H231 E232 R405 Y409 L413	E229-H231 PolarHBondContact O-N 2.68Å; E229-E232 HydrophobicContact CB-CG 4.31Å; E229-E232 PolarHBondContact N-OE1 3.47Å; E229-E232 WeakPolarHBondContact O-CB 3.24Å; E229-E232 PolarHBondContact O-N 2.95Å; E229-R405 VanDerWaalsContact CD-NH2 3.32Å; E229-R405 IonicContact OE1-CZ 3.76Å; E229-R405 VanDerWaalsContact OE1-CZ 3.25Å; E229-R405 IonicContact OE1-NE 3.99Å; E229-R405 PolarHBondContact OE1-NE 3.22Å; E229-R405 IonicContact OE1-NH2 2.89Å; E229-R405 PolarHBondContact OE1-NH2 3.32Å; E229-R405 IonicContact OE2-CZ 3.57Å; E229-R405 IonicContact OE2-NE 3.36Å; E229-R405 IonicContact OE2-NH2 2.75Å; E229-R405 PolarHBondContact OE2-NH2 2.99Å; E229-Y409 HydrophobicContact CG-CD1 4.26Å; E229-Y409 HydrophobicContact CG-CD2 3.77Å; E229-Y409 HydrophobicContact CG-CE1 4Å; E229-Y409 HydrophobicContact CG-CE2 3.5Å; E229-Y409 VanDerWaalsContact CG-CE2 3.5Å; E229-Y409 HydrophobicContact CG-CG 4.15Å; E229-L413 VanDerWaalsContact OE2-CD1 3.28Å; E229-L413 WeakPolarHBondContact OE2-CD1 3.16Å
230	D	98.7	Very high	96.1	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.011	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-19.3	-170.5	-79.6	20.4	0	0	0	114.4	V194 R195 K257 N416	V194-D230 PolarHBondContact N-O 2.78Å; R195-D230 HydrophobicContact CB-CB 4.12Å; R195-D230 WeakPolarHBondContact CB-O 3.48Å; R195-D230 IonicContact CZ-OD2 3.57Å; R195-D230 PolarHBondContact N-O 3.43Å; R195-D230 IonicContact NH1-OD2 2.87Å; R195-D230 PolarHBondContact NH1-OD2 2.73Å; D230-K257 WeakPolarHBondContact OD1-CE 3.34Å; D230-K257 IonicContact OD1-NZ 3.16Å; D230-K257 PolarHBondContact OD1-NZ 3.06Å; D230-N416 HydrophobicContact CB-CB 4.05Å; D230-N416 PolarHBondContact N-ND2 3.34Å
231	H	98.4	Very high	96.1	Very high	63 Å²	63	29.3 Å²	29.3	29%	0.292	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-3.4	175.9	62.5	-108.2	0	0	0	114.7	E229 Y409 S412 N416	E229-H231 PolarHBondContact O-N 2.68Å; H231-Y409 AromaticContact CE1-CD1 3.84Å; H231-Y409 AromaticContact NE2-CD1 3.41Å; H231-Y409 WeakPolarHBondContact NE2-CD1 3.21Å; H231-Y409 AromaticContact NE2-CE1 3.91Å; H231-S412 PolarHBondContact ND1-O 2.62Å; H231-N416 PolarHBondContact N-OD1 2.81Å; H231-N416 PolarHBondContact ND1-ND2 3.45Å; H231-N416 PolarHBondContact ND1-OD1 3.12Å
232	E	97.8	Very high	95.9	Very high	23 Å²	23	27.5 Å²	27.5	11%	0.107	14%	0.141	C	C	.	.	S	Bend	trans	-69.6	134.7	173.8	-73	-179.4	-99.2	0	0	110	T193 V194 R226 F228 E229 L234	T193-E232 CarbonylContact C-O 3.59Å; T193-E232 WeakPolarHBondContact CA-O 3.4Å; V194-E232 HydrophobicContact CG2-CB 4.27Å; V194-E232 WeakPolarHBondContact CG2-O 3.35Å; V194-E232 PolarHBondContact N-O 3.05Å; R226-E232 IonicContact CZ-OE1 3.95Å; R226-E232 IonicContact CZ-OE2 2.68Å; R226-E232 VanDerWaalsContact CZ-OE2 3.31Å; R226-E232 VanDerWaalsContact NH1-CD 3.3Å; R226-E232 IonicContact NH1-OE1 3.59Å; R226-E232 PolarHBondContact NH1-OE1 2.91Å; R226-E232 IonicContact NH1-OE2 2.73Å; R226-E232 PolarHBondContact NH1-OE2 2.78Å; R226-E232 IonicContact NH2-OE1 2.68Å; R226-E232 IonicContact NH2-OE2 2.61Å; R226-E232 PolarHBondContact NH2-OE2 2.76Å; F228-E232 WeakPolarHBondContact CA-OE1 3.13Å; E229-E232 HydrophobicContact CB-CG 4.31Å; E229-E232 PolarHBondContact N-OE1 3.47Å; E229-E232 WeakPolarHBondContact O-CB 3.24Å; E229-E232 PolarHBondContact O-N 2.95Å; E232-L234 PolarHBondContact O-N 2.56Å
233	N	96.8	Very high	95.4	Very high	61 Å²	61	36.7 Å²	36.7	33%	0.326	18%	0.175	S	C	.	.	B	Isolated β-bridge	trans	-70.6	123	167.9	-61	-47.8	0	0	0	108.3	Q192 V235 P237	Q192-N233 WeakPolarHBondContact O-CA 3.45Å; N233-V235 VanDerWaalsContact C-N 3.33Å; N233-V235 PolarHBondContact O-N 2.8Å; N233-P237 WeakPolarHBondContact O-CD 3.37Å
234	L	96.3	Very high	95	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.19	C	C	.	.	S	Bend	trans	-68.5	-31.9	-169	-178.2	59.3	0	0	0	112.9	V188 Q192 V194 V197 L215 F228 E232 L238	V188-L234 HydrophobicContact CG1-CB 4.26Å; V188-L234 HydrophobicContact CG1-CD2 4.33Å; V188-L234 HydrophobicContact CG2-CD2 4.48Å; Q192-L234 PolarHBondContact O-N 3.03Å; V194-L234 HydrophobicContact CG2-CB 4.22Å; V194-L234 HydrophobicContact CG2-CD1 4.21Å; V197-L234 HydrophobicContact CB-CD2 4.26Å; V197-L234 HydrophobicContact CG1-CD2 3.91Å; V197-L234 HydrophobicContact CG2-CB 4.42Å; V197-L234 HydrophobicContact CG2-CD2 3.94Å; L215-L234 HydrophobicContact CD1-CD1 4.31Å; L215-L234 HydrophobicContact CD1-CD2 3.82Å; F228-L234 HydrophobicContact CD2-CD1 4.42Å; F228-L234 HydrophobicContact CE1-CD1 4.18Å; F228-L234 HydrophobicContact CE2-CD1 4.01Å; F228-L234 HydrophobicContact CZ-CD1 3.88Å; E232-L234 PolarHBondContact O-N 2.56Å; L234-L238 HydrophobicContact CD1-CD1 4.1Å; L234-L238 HydrophobicContact CD1-CG 4.41Å; L234-L238 HydrophobicContact CG-CD1 3.91Å; L234-L238 VanDerWaalsContact O-CG 3.27Å; L234-L238 WeakPolarHBondContact O-CG 3.19Å
235	V	94.4	Very high	94.7	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.012	20%	0.2	C	C	.	.	H	α-helix	trans	-69.4	-36.8	-175.2	177.2	0	0	0	0	113	L172 V188 D189 E190 N233 L238 L239	L172-V235 HydrophobicContact CB-CG1 4.33Å; L172-V235 HydrophobicContact CB-CG2 4.09Å; L172-V235 HydrophobicContact CD2-CB 4.44Å; L172-V235 HydrophobicContact CD2-CG1 4.1Å; L172-V235 HydrophobicContact CD2-CG2 4.27Å; V188-V235 HydrophobicContact CB-CG2 4.47Å; V188-V235 HydrophobicContact CG1-CG2 4.02Å; D189-V235 WeakPolarHBondContact O-CG2 3.18Å; E190-V235 HydrophobicContact CB-CB 4.2Å; E190-V235 HydrophobicContact CB-CG1 4.17Å; N233-V235 VanDerWaalsContact C-N 3.33Å; N233-V235 PolarHBondContact O-N 2.8Å; V235-L238 PolarHBondContact O-N 2.77Å; V235-L238 VanDerWaalsContact O-N 3.15Å; V235-L239 HydrophobicContact CG1-CD1 3.8Å; V235-L239 HydrophobicContact CG1-CG 3.87Å; V235-L239 WeakPolarHBondContact O-CG 3.45Å; V235-L239 PolarHBondContact O-N 2.8Å
236	E	90.9	Very high	94.6	Very high	141 Å²	141	45.2 Å²	45.2	66%	0.659	22%	0.222	S	C	*	.	H	α-helix	trans	-61.6	-49.8	-174.3	166.8	178.2	-162.3	0	0	113.2	L238 L239	E236-L238 VanDerWaalsContact C-N 3.26Å; E236-L238 PolarHBondContact O-N 3.2Å; E236-L239 PolarHBondContact O-N 2.71Å
237	P	92.3	Very high	94.6	Very high	13 Å²	13	45.3 Å²	45.3	8%	0.084	22%	0.223	C	C	.	.	H	α-helix	trans	-63.2	-28.5	173.7	-25.8	36.7	0	0	0	114.1	F228 N233 A240 W241	F228-P237 HydrophobicContact CE1-CB 3.87Å; F228-P237 HydrophobicContact CE1-CG 3.98Å; N233-P237 WeakPolarHBondContact O-CD 3.37Å; P237-A240 WeakPolarHBondContact O-CB 3.29Å; P237-A240 PolarHBondContact O-N 2.91Å; P237-W241 VanDerWaalsContact O-CD1 3.23Å; P237-W241 PolarHBondContact O-NE1 3.21Å
238	L	94.8	Very high	94.5	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-79	-33.2	-179.6	-63.8	-177.2	0	0	0	112.7	V43 L172 V174 L234 V235 E236 A240 W241 V249	V43-L238 HydrophobicContact CG1-CD1 4.42Å; V43-L238 HydrophobicContact CG1-CD2 4.35Å; V43-L238 HydrophobicContact CG2-CB 4.36Å; L172-L238 HydrophobicContact CD2-CB 3.76Å; L172-L238 HydrophobicContact CD2-CD1 3.84Å; L172-L238 HydrophobicContact CD2-CG 4.46Å; V174-L238 HydrophobicContact CG1-CD1 4.05Å; V174-L238 HydrophobicContact CG2-CD1 3.78Å; L234-L238 HydrophobicContact CD1-CD1 4.1Å; L234-L238 HydrophobicContact CD1-CG 4.41Å; L234-L238 HydrophobicContact CG-CD1 3.91Å; L234-L238 VanDerWaalsContact O-CG 3.27Å; L234-L238 WeakPolarHBondContact O-CG 3.19Å; V235-L238 PolarHBondContact O-N 2.77Å; V235-L238 VanDerWaalsContact O-N 3.15Å; E236-L238 VanDerWaalsContact C-N 3.26Å; E236-L238 PolarHBondContact O-N 3.2Å; L238-A240 PolarHBondContact O-N 3.23Å; L238-W241 HydrophobicContact CD2-CD2 3.9Å; L238-W241 VanDerWaalsContact CD2-CE2 3.47Å; L238-W241 HydrophobicContact CD2-CE3 4.06Å; L238-W241 HydrophobicContact CD2-CH2 3.48Å; L238-W241 VanDerWaalsContact CD2-CH2 3.48Å; L238-W241 HydrophobicContact CD2-CZ2 3.26Å; L238-W241 HydrophobicContact CD2-CZ3 3.88Å; L238-W241 VanDerWaalsContact O-CB 3.31Å; L238-W241 WeakPolarHBondContact O-CB 3.16Å; L238-W241 PolarHBondContact O-N 3.22Å; L238-V249 HydrophobicContact CD1-CG2 4.28Å; L238-V249 HydrophobicContact CD2-CG2 3.83Å
239	L	91.9	Very high	94.5	Very high	66 Å²	66	50.2 Å²	50.2	35%	0.346	24%	0.244	S	C	.	.	H	α-helix	trans	-63.8	-16.2	170.1	-71.6	176.4	0	0	0	112.9	I39 K170 V235 E236 W241	I39-L239 HydrophobicContact CG2-CD2 3.99Å; K170-L239 HydrophobicContact CD-CD1 4.43Å; V235-L239 HydrophobicContact CG1-CD1 3.8Å; V235-L239 HydrophobicContact CG1-CG 3.87Å; V235-L239 WeakPolarHBondContact O-CG 3.45Å; V235-L239 PolarHBondContact O-N 2.8Å; E236-L239 PolarHBondContact O-N 2.71Å; L239-W241 VanDerWaalsContact C-N 3.3Å
240	A	92.1	Very high	94.5	Very high	23 Å²	23	51.7 Å²	51.7	19%	0.19	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	1.5	173.1	0	0	0	0	0	113.8	P237 L238 Q378 Q380	P237-A240 WeakPolarHBondContact O-CB 3.29Å; P237-A240 PolarHBondContact O-N 2.91Å; L238-A240 PolarHBondContact O-N 3.23Å; A240-Q378 HydrophobicContact CB-CG 4.35Å; A240-Q380 WeakPolarHBondContact O-CG 3.27Å; A240-Q380 PolarHBondContact O-NE2 2.86Å
241	W	94.9	Very high	94.5	Very high	15 Å²	15	51.8 Å²	51.8	6%	0.057	25%	0.252	C	S	.	.	S	Bend	trans	-89.5	148.1	176	-64.7	11.8	0	0	0	111	V43 E217 P237 L238 L239 N247 V249	V43-W241 HydrophobicContact CG1-CE3 3.7Å; V43-W241 HydrophobicContact CG1-CH2 4.37Å; V43-W241 HydrophobicContact CG1-CZ3 3.44Å; V43-W241 VanDerWaalsContact CG1-CZ3 3.44Å; E217-W241 HydrophobicContact CB-CZ2 3.89Å; E217-W241 PolarHBondContact OE2-NE1 3.26Å; P237-W241 VanDerWaalsContact O-CD1 3.23Å; P237-W241 PolarHBondContact O-NE1 3.21Å; L238-W241 HydrophobicContact CD2-CD2 3.9Å; L238-W241 VanDerWaalsContact CD2-CE2 3.47Å; L238-W241 HydrophobicContact CD2-CE3 4.06Å; L238-W241 HydrophobicContact CD2-CH2 3.48Å; L238-W241 VanDerWaalsContact CD2-CH2 3.48Å; L238-W241 HydrophobicContact CD2-CZ2 3.26Å; L238-W241 HydrophobicContact CD2-CZ3 3.88Å; L238-W241 VanDerWaalsContact O-CB 3.31Å; L238-W241 WeakPolarHBondContact O-CB 3.16Å; L238-W241 PolarHBondContact O-N 3.22Å; L239-W241 VanDerWaalsContact C-N 3.3Å; W241-N247 HydrophobicContact CD2-CB 3.62Å; W241-N247 HydrophobicContact CE3-CB 3.45Å; W241-N247 VanDerWaalsContact CE3-CB 3.45Å; W241-N247 HydrophobicContact CG-CB 4.44Å; W241-N247 HydrophobicContact CH2-CB 3.58Å; W241-N247 HydrophobicContact CZ2-CB 3.75Å; W241-N247 HydrophobicContact CZ3-CB 3.42Å; W241-N247 VanDerWaalsContact CZ3-CB 3.42Å; W241-N247 WeakPolarHBondContact CZ3-O 3.48Å; W241-V249 HydrophobicContact CH2-CG2 3.83Å
242	T	90.8	Very high	94.4	Very high	49 Å²	49	50.7 Å²	50.7	30%	0.301	25%	0.247	S	C	.	.			trans	-77.2	159.1	177.5	58.9	0	0	0	0	111.9	D244 S245	T242-D244 WeakPolarHBondContact CB-OD1 3.22Å; T242-D244 PolarHBondContact O-N 3.32Å; T242-D244 PolarHBondContact OG1-OD1 3.27Å; T242-S245 WeakPolarHBondContact O-CB 3.41Å; T242-S245 PolarHBondContact O-N 2.64Å
243	R	87.3	Confident	94.4	Very high	196 Å²	196	53 Å²	53	74%	0.74	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-23	-178.8	-164.7	174.5	70.9	-163.3	5.4	113.4	E38	E38-R243 IonicContact OE2-CZ 3.87Å; E38-R243 IonicContact OE2-NH1 2.86Å; E38-R243 PolarHBondContact OE2-NH1 2.93Å
244	D	87.7	Confident	94.4	Very high	111 Å²	111	51.1 Å²	51.1	59%	0.594	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.1	10.1	175	64.8	-29.2	0	0	0	113.3	T242 E246 K381	T242-D244 WeakPolarHBondContact CB-OD1 3.22Å; T242-D244 PolarHBondContact O-N 3.32Å; T242-D244 PolarHBondContact OG1-OD1 3.27Å; D244-E246 PolarHBondContact O-N 2.82Å; D244-K381 IonicContact OD2-NZ 2.74Å
245	S	93.2	Very high	94.4	Very high	31 Å²	31	57 Å²	57	22%	0.217	27%	0.271	C	S	.	.			trans	-69.6	122.9	-168.8	-176.6	0	0	0	0	114.1	T242 N247	T242-S245 WeakPolarHBondContact O-CB 3.41Å; T242-S245 PolarHBondContact O-N 2.64Å; S245-N247 PolarHBondContact O-N 2.76Å; S245-N247 WeakPolarHBondContact OG-CB 3.31Å; S245-N247 PolarHBondContact OG-N 2.95Å; S245-N247 PolarHBondContact OG-ND2 2.9Å; S245-N247 PolarHBondContact OG-OD1 2.87Å
246	E	95.3	Very high	94.5	Very high	133 Å²	133	58.5 Å²	58.5	62%	0.621	28%	0.279	S	S	*	.			trans	-80.8	6.7	169.5	-66.7	-172	-92.6	0	0	113.7	H220 D244	H220-E246 HydrophobicContact CB-CB 3.72Å; H220-E246 IonicContact CD2-OE1 3.34Å; D244-E246 PolarHBondContact O-N 2.82Å
247	N	97.1	Very high	94.8	Very high	8 Å²	8	51.8 Å²	51.8	4%	0.043	25%	0.248	C	C	.	.			trans	-61.9	149.6	177	-65	2.1	0	0	0	111.5	T218 N219 H220 W241 S245 Q380	T218-N247 WeakPolarHBondContact O-CA 3.44Å; T218-N247 WeakPolarHBondContact O-CB 3.41Å; N219-N247 VanDerWaalsContact CA-OD1 3.24Å; N219-N247 WeakPolarHBondContact CA-OD1 3.1Å; H220-N247 PolarHBondContact N-OD1 3.12Å; W241-N247 HydrophobicContact CD2-CB 3.62Å; W241-N247 HydrophobicContact CE3-CB 3.45Å; W241-N247 VanDerWaalsContact CE3-CB 3.45Å; W241-N247 HydrophobicContact CG-CB 4.44Å; W241-N247 HydrophobicContact CH2-CB 3.58Å; W241-N247 HydrophobicContact CZ2-CB 3.75Å; W241-N247 HydrophobicContact CZ3-CB 3.42Å; W241-N247 VanDerWaalsContact CZ3-CB 3.42Å; W241-N247 WeakPolarHBondContact CZ3-O 3.48Å; S245-N247 PolarHBondContact O-N 2.76Å; S245-N247 WeakPolarHBondContact OG-CB 3.31Å; S245-N247 PolarHBondContact OG-N 2.95Å; S245-N247 PolarHBondContact OG-ND2 2.9Å; S245-N247 PolarHBondContact OG-OD1 2.87Å; N247-Q380 PolarHBondContact ND2-OE1 2.84Å
248	K	97.5	Very high	95.1	Very high	112 Å²	112	51.2 Å²	51.2	49%	0.487	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	139.1	-177.5	-53.5	-179	-175.8	-180	0	112	T218 L250	T218-K248 PolarHBondContact N-O 2.82Å; T218-K248 PolarHBondContact O-N 3.4Å; T218-K248 WeakPolarHBondContact OG1-CB 3.35Å; T218-K248 PolarHBondContact OG1-N 2.97Å; T218-K248 PolarHBondContact OG1-O 3.3Å; K248-L250 HydrophobicContact CB-CD2 3.92Å
249	V	98.3	Very high	95.2	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.006	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	125.1	164.7	-175.9	0	0	0	0	107.8	V174 V176 V177 L215 C216 L238 W241	V174-V249 HydrophobicContact CG1-CB 4.44Å; V174-V249 HydrophobicContact CG1-CG2 4.03Å; V176-V249 HydrophobicContact CG1-CG1 4.46Å; V176-V249 HydrophobicContact CG2-CG1 4.25Å; V177-V249 PolarHBondContact N-O 3.37Å; L215-V249 HydrophobicContact CB-CG1 4.39Å; L215-V249 HydrophobicContact CD1-CG1 4.42Å; L215-V249 HydrophobicContact CD2-CG1 4Å; C216-V249 CarbonylContact O-C 3.58Å; C216-V249 WeakPolarHBondContact O-CA 3.36Å; L238-V249 HydrophobicContact CD1-CG2 4.28Å; L238-V249 HydrophobicContact CD2-CG2 3.83Å; W241-V249 HydrophobicContact CH2-CG2 3.83Å
250	L	98.3	Very high	95.4	Very high	35 Å²	35	50.3 Å²	50.3	18%	0.183	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	137.9	-180	-48.1	-176.6	0	0	0	110.4	V177 L215 C216 T218 K248	V177-L250 HydrophobicContact CB-CD2 3.84Å; V177-L250 HydrophobicContact CG1-CD2 4.31Å; V177-L250 HydrophobicContact CG2-CD2 4.47Å; V177-L250 CarbonylContact O-C 3.57Å; V177-L250 WeakPolarHBondContact O-CA 3.18Å; L215-L250 CarbonylContact C-O 3.56Å; L215-L250 VanDerWaalsContact CA-O 3.31Å; L215-L250 WeakPolarHBondContact CA-O 3.28Å; C216-L250 HydrophobicContact CB-CB 4.39Å; C216-L250 PolarHBondContact N-O 2.79Å; C216-L250 PolarHBondContact O-N 2.96Å; T218-L250 HydrophobicContact CG2-CD1 3.68Å; T218-L250 HydrophobicContact CG2-CG 4.2Å; K248-L250 HydrophobicContact CB-CD2 3.92Å
251	F	98.3	Very high	95.7	Very high	3 Å²	3	49.9 Å²	49.9	1%	0.013	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	112.1	170.3	175.4	-103.1	0	0	0	110.2	V176 V177 M178 L198 L201 F202 W213 L215	V176-F251 HydrophobicContact CG1-CB 3.62Å; V177-F251 PolarHBondContact O-N 3.35Å; M178-F251 HydrophobicContact CE-CD1 3.57Å; M178-F251 HydrophobicContact CE-CE1 3.98Å; M178-F251 HydrophobicContact SD-CB 4.19Å; M178-F251 HydrophobicContact SD-CD1 3.83Å; M178-F251 HydrophobicContact SD-CG 4.39Å; L198-F251 HydrophobicContact CD2-CD2 3.78Å; L198-F251 HydrophobicContact CD2-CE2 3.64Å; L201-F251 HydrophobicContact CB-CD2 4.26Å; L201-F251 HydrophobicContact CB-CE2 3.99Å; L201-F251 HydrophobicContact CB-CZ 4.36Å; L201-F251 HydrophobicContact CD1-CB 4.41Å; L201-F251 HydrophobicContact CD1-CD2 3.71Å; L201-F251 HydrophobicContact CD1-CE2 4.24Å; L201-F251 HydrophobicContact CD1-CG 4.21Å; F202-F251 HydrophobicContact CD1-CE2 4.2Å; F202-F251 HydrophobicContact CD1-CZ 4.05Å; F202-F251 AromaticContact CE1-CE2 4Å; F202-F251 HydrophobicContact CE1-CE2 4Å; F202-F251 HydrophobicContact CE1-CZ 4.05Å; W213-F251 HydrophobicContact CB-CE2 4.27Å; W213-F251 HydrophobicContact CB-CZ 4.4Å; W213-F251 HydrophobicContact CD2-CE1 4.08Å; W213-F251 HydrophobicContact CD2-CE2 4.36Å; W213-F251 AromaticContact CD2-CZ 3.76Å; W213-F251 HydrophobicContact CD2-CZ 3.76Å; W213-F251 AromaticContact CE3-CD1 3.85Å; W213-F251 HydrophobicContact CE3-CD1 3.85Å; W213-F251 HydrophobicContact CE3-CD2 4.34Å; W213-F251 AromaticContact CE3-CE1 3.35Å; W213-F251 HydrophobicContact CE3-CE1 3.35Å; W213-F251 AromaticContact CE3-CE2 3.89Å; W213-F251 HydrophobicContact CE3-CE2 3.89Å; W213-F251 HydrophobicContact CE3-CG 4.33Å; W213-F251 AromaticContact CE3-CZ 3.37Å; W213-F251 HydrophobicContact CE3-CZ 3.37Å; W213-F251 HydrophobicContact CG-CZ 4.2Å; W213-F251 HydrophobicContact CH2-CE1 4.11Å; W213-F251 AromaticContact CZ3-CD1 3.7Å; W213-F251 HydrophobicContact CZ3-CD1 3.7Å; W213-F251 AromaticContact CZ3-CE1 3.36Å; W213-F251 HydrophobicContact CZ3-CE1 3.36Å; W213-F251 AromaticContact CZ3-CZ 3.92Å; W213-F251 HydrophobicContact CZ3-CZ 3.92Å; L215-F251 HydrophobicContact CD2-CB 4.21Å; L215-F251 HydrophobicContact CD2-CD2 4.24Å
252	Q	97.3	Very high	95.7	Very high	40 Å²	40	52 Å²	52	19%	0.187	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	161.5	-171.2	56.4	169.3	105.1	0	0	112.9	S214 R254	S214-Q252 PolarHBondContact N-O 3.26Å; S214-Q252 PolarHBondContact O-N 2.77Å; Q252-R254 HydrophobicContact CG-CG 4.49Å
253	E	97.2	Very high	96	Very high	71 Å²	71	51.7 Å²	51.7	33%	0.332	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	139.8	169.5	-64.2	-168	158	0	0	112	N210 D212 W213 K255	N210-E253 PolarHBondContact ND2-OE1 2.71Å; D212-E253 HydrophobicContact CB-CB 4.37Å; D212-E253 CarbonylContact O-C 3.54Å; D212-E253 WeakPolarHBondContact O-CA 3.48Å; W213-E253 HydrophobicContact CD2-CG 4.26Å; W213-E253 HydrophobicContact CE3-CG 4.45Å; W213-E253 HydrophobicContact CZ2-CG 4.3Å; E253-K255 WeakPolarHBondContact OE2-CE 3.08Å; E253-K255 IonicContact OE2-NZ 3.85Å; E253-K255 PolarHBondContact OE2-NZ 3.04Å
254	R	97.3	Very high	96.4	Very high	22 Å²	22	42.4 Å²	42.4	8%	0.083	20%	0.203	C	C	.	.			trans	-138	79.2	178	-68.8	-59	-57	-118.2	4.9	111	D212 T227 Q252 D256 K257	D212-R254 PolarHBondContact O-N 2.72Å; T227-R254 HydrophobicContact CG2-CB 4.22Å; T227-R254 HydrophobicContact CG2-CG 3.95Å; Q252-R254 HydrophobicContact CG-CG 4.49Å; R254-D256 IonicContact CZ-OD1 2.71Å; R254-D256 IonicContact CZ-OD2 3.7Å; R254-D256 IonicContact NE-OD1 2.71Å; R254-D256 PolarHBondContact NE-OD1 2.71Å; R254-D256 IonicContact NE-OD2 2.72Å; R254-D256 IonicContact NH2-OD1 3.04Å; R254-D256 PolarHBondContact NH2-OD1 2.65Å; R254-D256 IonicContact NH2-OD2 3.79Å; R254-D256 PolarHBondContact NH2-OD2 3.45Å; R254-D256 PolarHBondContact O-N 2.91Å; R254-D256 VanDerWaalsContact O-N 3.07Å; R254-K257 HydrophobicContact CB-CB 4.15Å; R254-K257 WeakPolarHBondContact O-CB 3.3Å; R254-K257 PolarHBondContact O-N 3.41Å
255	K	96.3	Very high	96.8	Very high	124 Å²	124	37.2 Å²	37.2	54%	0.539	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-25.1	-177.7	-55.6	-171.5	174.5	170.1	0	113	D212 E253	D212-K255 HydrophobicContact CB-CG 4.23Å; E253-K255 WeakPolarHBondContact OE2-CE 3.08Å; E253-K255 IonicContact OE2-NZ 3.85Å; E253-K255 PolarHBondContact OE2-NZ 3.04Å
256	D	95.4	Very high	96.9	Very high	33 Å²	33	37.3 Å²	37.3	18%	0.176	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-18.7	175	63.6	-51.8	0	0	0	114.7	R254 F258 Y356	R254-D256 IonicContact CZ-OD1 2.71Å; R254-D256 IonicContact CZ-OD2 3.7Å; R254-D256 IonicContact NE-OD1 2.71Å; R254-D256 PolarHBondContact NE-OD1 2.71Å; R254-D256 IonicContact NE-OD2 2.72Å; R254-D256 IonicContact NH2-OD1 3.04Å; R254-D256 PolarHBondContact NH2-OD1 2.65Å; R254-D256 IonicContact NH2-OD2 3.79Å; R254-D256 PolarHBondContact NH2-OD2 3.45Å; R254-D256 PolarHBondContact O-N 2.91Å; R254-D256 VanDerWaalsContact O-N 3.07Å; D256-F258 PolarHBondContact O-N 2.82Å; D256-Y356 PolarHBondContact OD2-OH 3.2Å
257	K	97.4	Very high	96.9	Very high	1 Å²	1	31.2 Å²	31.2	0%	0.004	15%	0.145	C	C	.	.	S	Bend	trans	-63.7	-44	-174.2	-177.3	-178.3	-178.4	-173.7	0	113.2	S214 T227 D230 R254 R405	S214-K257 WeakPolarHBondContact OG-CD 3.45Å; S214-K257 PolarHBondContact OG-NZ 2.78Å; S214-K257 VanDerWaalsContact OG-NZ 3.09Å; T227-K257 HydrophobicContact CG2-CD 3.93Å; T227-K257 HydrophobicContact CG2-CG 4.34Å; D230-K257 WeakPolarHBondContact OD1-CE 3.34Å; D230-K257 IonicContact OD1-NZ 3.16Å; D230-K257 PolarHBondContact OD1-NZ 3.06Å; R254-K257 HydrophobicContact CB-CB 4.15Å; R254-K257 WeakPolarHBondContact O-CB 3.3Å; R254-K257 PolarHBondContact O-N 3.41Å; K257-R405 PolarHBondContact O-NH1 3.5Å; K257-R405 PolarHBondContact O-NH2 2.97Å
258	F	98.1	Very high	96.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	-119.4	13.6	-175.6	-62.8	-54	0	0	0	113.6	V211 D256 V260 F261 K262 N416 F417 A420	V211-F258 HydrophobicContact CB-CD2 4.43Å; V211-F258 WeakPolarHBondContact O-CD2 3.25Å; V211-F258 VanDerWaalsContact O-CE2 3.31Å; V211-F258 WeakPolarHBondContact O-CE2 3.42Å; D256-F258 PolarHBondContact O-N 2.82Å; F258-V260 PolarHBondContact O-N 2.97Å; F258-V260 VanDerWaalsContact O-N 3.13Å; F258-F261 HydrophobicContact CB-CD2 4.18Å; F258-F261 AromaticContact CD1-CD2 3.98Å; F258-F261 HydrophobicContact CD1-CD2 3.98Å; F258-F261 HydrophobicContact CD1-CE2 4.01Å; F258-F261 PolarHBondContact O-N 3.47Å; F258-K262 PolarHBondContact O-N 2.85Å; F258-N416 HydrophobicContact CE1-CB 3.9Å; F258-N416 HydrophobicContact CZ-CB 4.06Å; F258-F417 HydrophobicContact CB-CD2 3.57Å; F258-F417 HydrophobicContact CB-CE2 4Å; F258-F417 HydrophobicContact CB-CG 4.44Å; F258-F417 HydrophobicContact CD1-CB 3.76Å; F258-F417 AromaticContact CD1-CD2 3.97Å; F258-F417 HydrophobicContact CD1-CD2 3.97Å; F258-F417 HydrophobicContact CD1-CG 4.27Å; F258-F417 HydrophobicContact CD2-CD2 4.01Å; F258-F417 HydrophobicContact CE1-CB 3.93Å; F258-F417 HydrophobicContact CG-CB 4.3Å; F258-F417 AromaticContact CG-CD2 3.61Å; F258-F417 HydrophobicContact CG-CD2 3.61Å; F258-F417 HydrophobicContact CG-CE2 4.44Å; F258-F417 HydrophobicContact CG-CG 4.36Å; F258-A420 HydrophobicContact CE2-CB 4.1Å; F258-A420 HydrophobicContact CZ-CB 4.48Å
259	E	96.7	Very high	96.8	Very high	47 Å²	47	29.2 Å²	29.2	22%	0.22	14%	0.137	C	C	.	.	H	α-helix	trans	-59.1	-27.1	-178.7	-175.8	54.1	-159.6	0	0	113.2	F261 K262 N263 F267	E259-F261 VanDerWaalsContact C-N 3.27Å; E259-F261 PolarHBondContact O-N 2.9Å; E259-K262 PolarHBondContact O-N 3.37Å; E259-N263 PolarHBondContact O-N 3.13Å; E259-N263 WeakPolarHBondContact OE1-CB 3.46Å; E259-N263 PolarHBondContact OE1-ND2 3.04Å; E259-F267 HydrophobicContact CB-CE2 4.42Å; E259-F267 HydrophobicContact CB-CZ 4.3Å; E259-F267 HydrophobicContact CG-CE2 4.05Å; E259-F267 HydrophobicContact CG-CZ 4.06Å
260	V	97.3	Very high	96.5	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-63.2	-28.2	172.7	63.9	0	0	0	0	113.5	F258 P264 F267 Y268 F293 T402 I406	F258-V260 PolarHBondContact O-N 2.97Å; F258-V260 VanDerWaalsContact O-N 3.13Å; V260-P264 WeakPolarHBondContact O-CA 3.4Å; V260-P264 WeakPolarHBondContact O-CB 3.32Å; V260-P264 WeakPolarHBondContact O-CD 3.47Å; V260-P264 VanDerWaalsContact O-N 3.09Å; V260-F267 HydrophobicContact CB-CD2 3.92Å; V260-F267 HydrophobicContact CB-CE2 4.1Å; V260-F267 HydrophobicContact CB-CG 4.32Å; V260-F267 HydrophobicContact CG2-CB 4.26Å; V260-F267 HydrophobicContact CG2-CD2 3.98Å; V260-F267 HydrophobicContact CG2-CG 4.15Å; V260-Y268 HydrophobicContact CG2-CE2 4.06Å; V260-F293 HydrophobicContact CG2-CE2 4.49Å; V260-F293 HydrophobicContact CG2-CZ 4.43Å; V260-T402 HydrophobicContact CB-CG2 3.94Å; V260-T402 HydrophobicContact CG1-CG2 4.25Å; V260-I406 HydrophobicContact CG2-CD1 3.95Å
261	F	97.6	Very high	96.2	Very high	15 Å²	15	35.8 Å²	35.8	7%	0.066	16%	0.163	C	C	.	.	H	α-helix	trans	-87.9	-30.7	177.2	-54.9	-67	0	0	0	111.8	F258 E259 V289 F293 L413 H414 F417	F258-F261 HydrophobicContact CB-CD2 4.18Å; F258-F261 AromaticContact CD1-CD2 3.98Å; F258-F261 HydrophobicContact CD1-CD2 3.98Å; F258-F261 HydrophobicContact CD1-CE2 4.01Å; F258-F261 PolarHBondContact O-N 3.47Å; E259-F261 VanDerWaalsContact C-N 3.27Å; E259-F261 PolarHBondContact O-N 2.9Å; F261-V289 HydrophobicContact CD1-CG1 3.87Å; F261-V289 HydrophobicContact CD1-CG2 4.27Å; F261-V289 HydrophobicContact CE1-CG1 4.29Å; F261-F293 HydrophobicContact CD1-CE2 4.36Å; F261-F293 HydrophobicContact CE1-CD1 4.07Å; F261-F293 AromaticContact CE1-CD2 3.98Å; F261-F293 HydrophobicContact CE1-CD2 3.98Å; F261-F293 AromaticContact CE1-CE1 3.74Å; F261-F293 HydrophobicContact CE1-CE1 3.74Å; F261-F293 AromaticContact CE1-CE2 3.64Å; F261-F293 HydrophobicContact CE1-CE2 3.64Å; F261-F293 HydrophobicContact CE1-CG 4.18Å; F261-F293 AromaticContact CE1-CZ 3.51Å; F261-F293 HydrophobicContact CE1-CZ 3.51Å; F261-F293 HydrophobicContact CZ-CD1 4.39Å; F261-F293 AromaticContact CZ-CE1 3.81Å; F261-F293 HydrophobicContact CZ-CE1 3.81Å; F261-F293 HydrophobicContact CZ-CE2 4.41Å; F261-F293 AromaticContact CZ-CZ 3.82Å; F261-F293 HydrophobicContact CZ-CZ 3.82Å; F261-L413 HydrophobicContact CE2-CG 4.05Å; F261-L413 VanDerWaalsContact CE2-O 3.31Å; F261-L413 WeakPolarHBondContact CE2-O 3.39Å; F261-L413 HydrophobicContact CZ-CB 4.48Å; F261-L413 HydrophobicContact CZ-CG 4Å; F261-L413 WeakPolarHBondContact CZ-O 3.39Å; F261-H414 AromaticContact CD1-CD2 3.79Å; F261-H414 HydrophobicContact CE1-CB 3.73Å; F261-H414 AromaticContact CE1-CD2 3.66Å; F261-H414 AromaticContact CE1-CG 3.94Å; F261-H414 VanDerWaalsContact CZ-CA 3.5Å; F261-H414 HydrophobicContact CZ-CB 3.88Å; F261-F417 HydrophobicContact CB-CD1 3.36Å; F261-F417 HydrophobicContact CB-CD2 4.24Å; F261-F417 HydrophobicContact CB-CE1 3.39Å; F261-F417 HydrophobicContact CB-CE2 4.24Å; F261-F417 HydrophobicContact CB-CG 3.81Å; F261-F417 HydrophobicContact CB-CZ 3.84Å; F261-F417 HydrophobicContact CD1-CD1 4.29Å; F261-F417 HydrophobicContact CD2-CB 3.52Å; F261-F417 AromaticContact CD2-CD1 3.89Å; F261-F417 HydrophobicContact CD2-CD1 3.89Å; F261-F417 HydrophobicContact CD2-CD2 4.12Å; F261-F417 AromaticContact CD2-CG 3.56Å; F261-F417 HydrophobicContact CD2-CG 3.56Å; F261-F417 HydrophobicContact CE2-CB 3.82Å; F261-F417 HydrophobicContact CE2-CG 4.36Å; F261-F417 HydrophobicContact CG-CB 4.08Å; F261-F417 AromaticContact CG-CD1 3.58Å; F261-F417 HydrophobicContact CG-CD1 3.58Å; F261-F417 HydrophobicContact CG-CD2 4.49Å; F261-F417 HydrophobicContact CG-CE1 4.15Å; F261-F417 AromaticContact CG-CG 3.78Å; F261-F417 HydrophobicContact CG-CG 3.78Å
262	K	95.6	Very high	95.8	Very high	60 Å²	60	41.3 Å²	41.3	26%	0.261	19%	0.187	S	C	.	.	H	α-helix	trans	-71.1	-39.3	174.5	-62.9	173.4	175.8	174.7	0	112.6	D212 F258 E259	D212-K262 IonicContact OD1-NZ 2.88Å; D212-K262 PolarHBondContact OD1-NZ 3.01Å; D212-K262 IonicContact OD2-NZ 2.65Å; D212-K262 PolarHBondContact OD2-NZ 3.11Å; F258-K262 PolarHBondContact O-N 2.85Å; E259-K262 PolarHBondContact O-N 3.37Å
263	N	96.1	Very high	95.2	Very high	42 Å²	42	45.3 Å²	45.3	23%	0.225	21%	0.209	C	C	.	.			trans	-141.4	64.4	-178.5	-67.6	-66.8	0	0	0	112.3	E259 Q265 N266	E259-N263 PolarHBondContact O-N 3.13Å; E259-N263 WeakPolarHBondContact OE1-CB 3.46Å; E259-N263 PolarHBondContact OE1-ND2 3.04Å; N263-Q265 PolarHBondContact O-N 2.94Å; N263-Q265 VanDerWaalsContact O-N 3.11Å; N263-Q265 PolarHBondContact O-OE1 2.98Å; N263-Q265 PolarHBondContact OD1-NE2 3.39Å; N263-N266 VanDerWaalsContact CB-ND2 3.35Å; N263-N266 WeakPolarHBondContact CB-ND2 3.15Å; N263-N266 WeakPolarHBondContact O-CB 3.45Å; N263-N266 PolarHBondContact O-N 3.08Å; N263-N266 VanDerWaalsContact O-N 3.07Å
264	P	96.8	Very high	94.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-30.5	-177	24.8	-37.1	0	0	0	113.6	V260 N266 F267 Y268 K285 L288 V289	V260-P264 WeakPolarHBondContact O-CA 3.4Å; V260-P264 WeakPolarHBondContact O-CB 3.32Å; V260-P264 WeakPolarHBondContact O-CD 3.47Å; V260-P264 VanDerWaalsContact O-N 3.09Å; P264-N266 PolarHBondContact O-N 3.5Å; P264-F267 PolarHBondContact O-N 3.49Å; P264-Y268 HydrophobicContact CB-CD2 4.44Å; P264-Y268 PolarHBondContact O-N 2.88Å; P264-K285 HydrophobicContact CG-CB 3.85Å; P264-K285 HydrophobicContact CG-CG 4.26Å; P264-L288 HydrophobicContact CB-CD2 3.89Å; P264-L288 HydrophobicContact CB-CG 4.16Å; P264-L288 HydrophobicContact CG-CB 4.35Å; P264-L288 HydrophobicContact CG-CD2 4.09Å; P264-L288 HydrophobicContact CG-CG 4.46Å; P264-V289 HydrophobicContact CB-CG2 4Å; P264-V289 HydrophobicContact CG-CG2 3.94Å
265	Q	95.2	Very high	93.8	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.009	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-27.1	-179.3	78.9	-75.8	7.3	0	0	112.8	N263 F267 L269 L277 M280 L288	N263-Q265 PolarHBondContact O-N 2.94Å; N263-Q265 VanDerWaalsContact O-N 3.11Å; N263-Q265 PolarHBondContact O-OE1 2.98Å; N263-Q265 PolarHBondContact OD1-NE2 3.39Å; Q265-F267 PolarHBondContact O-N 3.35Å; Q265-L269 HydrophobicContact CB-CD1 4.31Å; Q265-L269 CarbonylContact O-C 3.59Å; Q265-L269 WeakPolarHBondContact O-CA 3.39Å; Q265-L269 VanDerWaalsContact O-CB 3.29Å; Q265-L269 WeakPolarHBondContact O-CB 3.35Å; Q265-L269 PolarHBondContact O-N 3.01Å; Q265-L269 VanDerWaalsContact O-N 3.14Å; Q265-L277 HydrophobicContact CB-CD2 4.19Å; Q265-L277 HydrophobicContact CG-CB 3.99Å; Q265-L277 HydrophobicContact CG-CD2 4.17Å; Q265-L277 VanDerWaalsContact CG-O 3.28Å; Q265-L277 WeakPolarHBondContact CG-O 3.25Å; Q265-L277 PolarHBondContact NE2-O 2.99Å; Q265-M280 HydrophobicContact CB-CE 4.42Å; Q265-M280 HydrophobicContact CB-SD 3.46Å; Q265-M280 WeakPolarHBondContact CB-SD 3.41Å; Q265-M280 HydrophobicContact CG-CB 4.33Å; Q265-M280 HydrophobicContact CG-SD 3.99Å; Q265-L288 HydrophobicContact CB-CD2 4.14Å
266	N	95.3	Very high	93	Very high	34 Å²	34	53.4 Å²	53.4	18%	0.182	25%	0.253	C	S	.	.	H	α-helix	trans	-68.6	-24.7	176.3	-66.1	-22.4	0	0	0	112.4	N263 P264 W270 W395	N263-N266 VanDerWaalsContact CB-ND2 3.35Å; N263-N266 WeakPolarHBondContact CB-ND2 3.15Å; N263-N266 WeakPolarHBondContact O-CB 3.45Å; N263-N266 PolarHBondContact O-N 3.08Å; N263-N266 VanDerWaalsContact O-N 3.07Å; P264-N266 PolarHBondContact O-N 3.5Å; N266-W270 WeakPolarHBondContact O-CB 3.46Å; N266-W395 HydrophobicContact CB-CH2 3.72Å; N266-W395 HydrophobicContact CB-CZ2 4.28Å; N266-W395 WeakPolarHBondContact O-CZ2 2.97Å
267	F	96.6	Very high	92.5	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.018	25%	0.246	C	C	.	.	H	α-helix	trans	-102.5	-48.9	-176.4	-58.7	-88.9	0	0	0	112.1	E259 V260 P264 Q265 W270 W395 N398 L399 T402	E259-F267 HydrophobicContact CB-CE2 4.42Å; E259-F267 HydrophobicContact CB-CZ 4.3Å; E259-F267 HydrophobicContact CG-CE2 4.05Å; E259-F267 HydrophobicContact CG-CZ 4.06Å; V260-F267 HydrophobicContact CB-CD2 3.92Å; V260-F267 HydrophobicContact CB-CE2 4.1Å; V260-F267 HydrophobicContact CB-CG 4.32Å; V260-F267 HydrophobicContact CG2-CB 4.26Å; V260-F267 HydrophobicContact CG2-CD2 3.98Å; V260-F267 HydrophobicContact CG2-CG 4.15Å; P264-F267 PolarHBondContact O-N 3.49Å; Q265-F267 PolarHBondContact O-N 3.35Å; F267-W270 VanDerWaalsContact O-CD1 3.29Å; F267-W395 HydrophobicContact CE1-CH2 4.32Å; F267-W395 HydrophobicContact CZ-CH2 4.36Å; F267-W395 HydrophobicContact CZ-CZ3 4.48Å; F267-N398 WeakPolarHBondContact CE1-OD1 3.42Å; F267-L399 HydrophobicContact CD1-CD2 3.82Å; F267-L399 HydrophobicContact CE1-CD2 4.38Å; F267-L399 HydrophobicContact CG-CD2 4.49Å; F267-T402 HydrophobicContact CD1-CG2 3.76Å; F267-T402 HydrophobicContact CE1-CG2 3.63Å; F267-T402 HydrophobicContact CG-CG2 4.47Å; F267-T402 HydrophobicContact CZ-CG2 4.24Å
268	Y	96.3	Very high	91.8	Very high	30 Å²	30	60 Å²	60	12%	0.118	28%	0.28	C	S	.	.	H	α-helix	trans	-77.1	-25.6	-178.8	-75.6	-82.6	0	0	0	113.3	V260 P264 N292 F293 I299 P301 I406	V260-Y268 HydrophobicContact CG2-CE2 4.06Å; P264-Y268 HydrophobicContact CB-CD2 4.44Å; P264-Y268 PolarHBondContact O-N 2.88Å; Y268-N292 HydrophobicContact CD1-CB 4.28Å; Y268-N292 WeakPolarHBondContact CD1-OD1 3.37Å; Y268-N292 HydrophobicContact CE1-CB 3.62Å; Y268-N292 WeakPolarHBondContact CE1-OD1 3.22Å; Y268-N292 HydrophobicContact CE2-CB 4.18Å; Y268-F293 AromaticContact CE2-CE2 3.95Å; Y268-F293 HydrophobicContact CE2-CE2 3.95Å; Y268-F293 WeakPolarHBondContact OH-CE2 3.14Å; Y268-I299 VanDerWaalsContact CE1-O 3.29Å; Y268-I299 WeakPolarHBondContact CE1-O 3.28Å; Y268-I299 PolarHBondContact OH-O 3.45Å; Y268-P301 HydrophobicContact CD1-CB 4.42Å; Y268-P301 HydrophobicContact CD1-CG 3.94Å; Y268-P301 HydrophobicContact CE1-CG 3.68Å; Y268-P301 HydrophobicContact CE2-CG 4.3Å; Y268-P301 HydrophobicContact CG-CG 4.36Å; Y268-I406 HydrophobicContact CE2-CD1 4.44Å
269	L	94.8	Very high	91	Very high	48 Å²	48	66.6 Å²	66.6	25%	0.251	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	27.5	175.6	-51.7	177.1	0	0	0	112	Q265 K271 K272 L277	Q265-L269 HydrophobicContact CB-CD1 4.31Å; Q265-L269 CarbonylContact O-C 3.59Å; Q265-L269 WeakPolarHBondContact O-CA 3.39Å; Q265-L269 VanDerWaalsContact O-CB 3.29Å; Q265-L269 WeakPolarHBondContact O-CB 3.35Å; Q265-L269 PolarHBondContact O-N 3.01Å; Q265-L269 VanDerWaalsContact O-N 3.14Å; L269-K271 PolarHBondContact O-N 2.91Å; L269-K272 HydrophobicContact CB-CD 4.05Å; L269-K272 HydrophobicContact CB-CG 4.3Å; L269-K272 HydrophobicContact CD1-CD 4.32Å; L269-K272 WeakPolarHBondContact O-CB 3.25Å; L269-K272 PolarHBondContact O-N 2.99Å; L269-L277 HydrophobicContact CB-CD2 3.8Å; L269-L277 HydrophobicContact CD1-CD2 3.99Å
270	W	93.2	Very high	90.8	Very high	66 Å²	66	66.4 Å²	66.4	25%	0.25	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-24.3	-173.1	75.6	-90.2	0	0	0	115.3	N266 F267 K272 D302 L303 E304 L399	N266-W270 WeakPolarHBondContact O-CB 3.46Å; F267-W270 VanDerWaalsContact O-CD1 3.29Å; W270-K272 VanDerWaalsContact C-N 3.27Å; W270-K272 PolarHBondContact O-N 3.28Å; W270-D302 PolarHBondContact NE1-O 2.89Å; W270-L303 HydrophobicContact CD2-CD1 4.02Å; W270-L303 HydrophobicContact CE3-CD1 4.45Å; W270-L303 HydrophobicContact CH2-CD1 4.26Å; W270-L303 HydrophobicContact CZ2-CD1 3.8Å; W270-E304 WeakPolarHBondContact CH2-O 3.42Å; W270-E304 HydrophobicContact CZ2-CG 4.36Å; W270-L399 HydrophobicContact CB-CD1 4.05Å; W270-L399 HydrophobicContact CB-CD2 3.85Å; W270-L399 HydrophobicContact CD2-CD1 4.34Å; W270-L399 HydrophobicContact CE3-CD1 4.09Å; W270-L399 HydrophobicContact CG-CD1 4.38Å
271	K	91.5	Very high	90.6	Very high	109 Å²	109	73.2 Å²	73.2	47%	0.474	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-3.3	175.3	-60.1	-176.5	176.9	178.2	0	113.8	L269 D302 E304	L269-K271 PolarHBondContact O-N 2.91Å; K271-D302 WeakPolarHBondContact CE-O 3.39Å; K271-D302 IonicContact NZ-OD2 2.82Å; K271-D302 PolarHBondContact NZ-OD2 3.17Å; K271-E304 IonicContact NZ-OE1 2.74Å; K271-E304 PolarHBondContact NZ-OE1 2.88Å
272	K	90.3	Very high	90.5	Very high	119 Å²	119	77.9 Å²	77.9	52%	0.517	37%	0.37	S	S	.	.	S	Bend	trans	-100.4	156.6	178.7	-61.4	-172.4	-174.2	172.7	0	112.5	L269 W270 K274 L277	L269-K272 HydrophobicContact CB-CD 4.05Å; L269-K272 HydrophobicContact CB-CG 4.3Å; L269-K272 HydrophobicContact CD1-CD 4.32Å; L269-K272 WeakPolarHBondContact O-CB 3.25Å; L269-K272 PolarHBondContact O-N 2.99Å; W270-K272 VanDerWaalsContact C-N 3.27Å; W270-K272 PolarHBondContact O-N 3.28Å; K272-K274 PolarHBondContact O-N 3.25Å; K272-L277 HydrophobicContact CB-CD1 4.33Å; K272-L277 HydrophobicContact CB-CD2 4.18Å; K272-L277 HydrophobicContact CB-CG 4.31Å; K272-L277 HydrophobicContact CD-CD2 4.4Å
273	D	84.2	Confident	90.5	Very high	124 Å²	124	83.2 Å²	83.2	66%	0.663	39%	0.393	S	S	*	.			trans	-58.4	125.8	177.7	-69.3	-70.6	0	0	0	113.7	K275 T276 L277	D273-K275 PolarHBondContact O-N 2.63Å; D273-T276 PolarHBondContact O-N 3.47Å; D273-L277 PolarHBondContact O-N 2.76Å
274	K	83.6	Confident	90.4	Very high	111 Å²	111	84.2 Å²	84.2	48%	0.483	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-18.4	177.5	-68	-171.5	178	-176.7	0	114.4	K272 K278 W395	K272-K274 PolarHBondContact O-N 3.25Å; K274-K278 WeakPolarHBondContact O-CG 3.17Å; K274-W395 VanDerWaalsContact NZ-CE2 3.34Å
275	K	82	Confident	90.4	Very high	175 Å²	175	85.8 Å²	85.8	76%	0.761	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-47.7	172.4	-172.5	178.4	178	-176.5	0	110.8	D273 L277 K278	D273-K275 PolarHBondContact O-N 2.63Å; K275-L277 VanDerWaalsContact C-N 3.27Å; K275-L277 PolarHBondContact O-N 3.48Å; K275-K278 PolarHBondContact O-N 2.97Å
276	T	79.6	Confident	90.5	Very high	101 Å²	101	90.4 Å²	90.4	62%	0.62	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-23.9	-178.8	-43.9	0	0	0	0	112.7	D273	D273-T276 PolarHBondContact O-N 3.47Å
277	L	85.2	Confident	90.5	Very high	8 Å²	8	93.1 Å²	93.1	4%	0.042	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-9.4	-179.7	-64.7	178.6	0	0	0	114.8	Q265 L269 K272 D273 K275	Q265-L277 HydrophobicContact CB-CD2 4.19Å; Q265-L277 HydrophobicContact CG-CB 3.99Å; Q265-L277 HydrophobicContact CG-CD2 4.17Å; Q265-L277 VanDerWaalsContact CG-O 3.28Å; Q265-L277 WeakPolarHBondContact CG-O 3.25Å; Q265-L277 PolarHBondContact NE2-O 2.99Å; L269-L277 HydrophobicContact CB-CD2 3.8Å; L269-L277 HydrophobicContact CD1-CD2 3.99Å; K272-L277 HydrophobicContact CB-CD1 4.33Å; K272-L277 HydrophobicContact CB-CD2 4.18Å; K272-L277 HydrophobicContact CB-CG 4.31Å; K272-L277 HydrophobicContact CD-CD2 4.4Å; D273-L277 PolarHBondContact O-N 2.76Å; K275-L277 VanDerWaalsContact C-N 3.27Å; K275-L277 PolarHBondContact O-N 3.48Å
278	K	81.2	Confident	90.5	Very high	164 Å²	164	93.9 Å²	93.9	71%	0.713	45%	0.445	S	S	*	.	S	Bend	trans	-77.5	-32	-178.8	-80.8	-179.6	176.3	-167.2	0	113.9	K274 K275 M280	K274-K278 WeakPolarHBondContact O-CG 3.17Å; K275-K278 PolarHBondContact O-N 2.97Å; K278-M280 VanDerWaalsContact C-N 3.32Å; K278-M280 PolarHBondContact O-N 3.49Å
279	D	82.7	Confident	90.6	Very high	139 Å²	139	92.6 Å²	92.6	74%	0.743	44%	0.441	S	S	*	.	S	Bend	trans	-94.7	14.3	-168.3	-51.1	-36.9	0	0	0	112.9
280	M	91.3	Very high	90.6	Very high	43 Å²	43	95.5 Å²	95.5	21%	0.212	45%	0.453	C	S	.	.			trans	-75.2	126.1	179.5	-174.2	158.6	169.7	0	0	110.8	Q265 K278 D284 K285 L288	Q265-M280 HydrophobicContact CB-CE 4.42Å; Q265-M280 HydrophobicContact CB-SD 3.46Å; Q265-M280 WeakPolarHBondContact CB-SD 3.41Å; Q265-M280 HydrophobicContact CG-CB 4.33Å; Q265-M280 HydrophobicContact CG-SD 3.99Å; K278-M280 VanDerWaalsContact C-N 3.32Å; K278-M280 PolarHBondContact O-N 3.49Å; M280-D284 VanDerWaalsContact CE-C 3.44Å; M280-D284 HydrophobicContact CE-CB 3.74Å; M280-D284 WeakPolarHBondContact CE-O 3.44Å; M280-D284 HydrophobicContact CG-CB 3.87Å; M280-K285 HydrophobicContact CG-CG 4.32Å; M280-K285 WeakPolarHBondContact O-CE 3.34Å; M280-L288 HydrophobicContact CE-CB 4.12Å; M280-L288 HydrophobicContact CE-CD2 3.91Å
281	K	94.1	Very high	90.8	Very high	143 Å²	143	98.6 Å²	98.6	62%	0.622	47%	0.47	S	S	*	.			trans	-75.3	154.1	-171.8	-53.3	163.8	-172.9	161.2	0	110.6	K283 D284 K285	K281-K283 PolarHBondContact O-N 2.86Å; K281-D284 VanDerWaalsContact CB-OD2 3.3Å; K281-D284 WeakPolarHBondContact CB-OD2 3.14Å; K281-D284 PolarHBondContact N-OD2 2.66Å; K281-D284 WeakPolarHBondContact O-CA 3.26Å; K281-D284 WeakPolarHBondContact O-CB 3.36Å; K281-D284 PolarHBondContact O-N 3.28Å; K281-K285 PolarHBondContact O-N 3Å
282	D	94.3	Very high	91	Very high	113 Å²	113	94 Å²	94	60%	0.604	45%	0.45	S	S	*	.	H	α-helix	trans	-65.4	-27.2	-175.5	-50.8	-60.9	0	0	0	113.3	D284 K285 E286	D282-D284 VanDerWaalsContact C-N 3.35Å; D282-K285 PolarHBondContact O-N 3.29Å; D282-K285 WeakPolarHBondContact OD1-CE 3.23Å; D282-K285 IonicContact OD1-NZ 3.99Å; D282-K285 PolarHBondContact OD1-NZ 2.93Å; D282-E286 WeakPolarHBondContact O-CB 3.39Å; D282-E286 PolarHBondContact O-N 2.89Å
283	K	95.8	Very high	91.4	Very high	172 Å²	172	88.7 Å²	88.7	75%	0.748	43%	0.427	S	S	*	.	H	α-helix	trans	-63.6	-39.2	168.1	-69.7	-170.4	176.1	-173.5	0	112.8	K281 K285 L287	K281-K283 PolarHBondContact O-N 2.86Å; K283-K285 VanDerWaalsContact C-N 3.34Å; K283-L287 WeakPolarHBondContact O-CG 3.35Å; K283-L287 PolarHBondContact O-N 3.01Å; K283-L287 VanDerWaalsContact O-N 3.11Å
284	D	95.8	Very high	91.8	Very high	64 Å²	64	86.3 Å²	86.3	34%	0.342	42%	0.42	S	S	.	.	H	α-helix	trans	-72.9	-32.7	179.5	-44.4	-30.7	0	0	0	109.9	M280 K281 D282 L288	M280-D284 VanDerWaalsContact CE-C 3.44Å; M280-D284 HydrophobicContact CE-CB 3.74Å; M280-D284 WeakPolarHBondContact CE-O 3.44Å; M280-D284 HydrophobicContact CG-CB 3.87Å; K281-D284 VanDerWaalsContact CB-OD2 3.3Å; K281-D284 WeakPolarHBondContact CB-OD2 3.14Å; K281-D284 PolarHBondContact N-OD2 2.66Å; K281-D284 WeakPolarHBondContact O-CA 3.26Å; K281-D284 WeakPolarHBondContact O-CB 3.36Å; K281-D284 PolarHBondContact O-N 3.28Å; D282-D284 VanDerWaalsContact C-N 3.35Å; D284-L288 WeakPolarHBondContact O-CB 3.2Å; D284-L288 PolarHBondContact O-N 2.84Å; D284-L288 VanDerWaalsContact O-N 3.07Å
285	K	96.1	Very high	92.2	Very high	32 Å²	32	83.2 Å²	83.2	14%	0.139	42%	0.42	C	S	.	.	H	α-helix	trans	-67	-47.9	171.6	-62.6	178.2	-168.1	165.1	0	112.4	P264 M280 K281 D282 K283 L287 L288 V289	P264-K285 HydrophobicContact CG-CB 3.85Å; P264-K285 HydrophobicContact CG-CG 4.26Å; M280-K285 HydrophobicContact CG-CG 4.32Å; M280-K285 WeakPolarHBondContact O-CE 3.34Å; K281-K285 PolarHBondContact O-N 3Å; D282-K285 PolarHBondContact O-N 3.29Å; D282-K285 WeakPolarHBondContact OD1-CE 3.23Å; D282-K285 IonicContact OD1-NZ 3.99Å; D282-K285 PolarHBondContact OD1-NZ 2.93Å; K283-K285 VanDerWaalsContact C-N 3.34Å; K285-L287 VanDerWaalsContact C-N 3.31Å; K285-L287 PolarHBondContact O-N 3.09Å; K285-L288 CarbonylContact O-C 3.58Å; K285-L288 WeakPolarHBondContact O-CA 3.34Å; K285-L288 WeakPolarHBondContact O-CB 3.33Å; K285-L288 PolarHBondContact O-N 2.89Å; K285-L288 VanDerWaalsContact O-N 3.07Å; K285-V289 PolarHBondContact O-N 2.86Å
286	E	96.1	Very high	92.6	Very high	99 Å²	99	82.6 Å²	82.6	46%	0.463	43%	0.43	S	S	.	.	H	α-helix	trans	-59.8	-43.5	178.7	-174.3	70.4	-171.6	0	0	110.5	D282 L288 V289 Q290	D282-E286 WeakPolarHBondContact O-CB 3.39Å; D282-E286 PolarHBondContact O-N 2.89Å; E286-L288 VanDerWaalsContact C-N 3.35Å; E286-L288 PolarHBondContact O-N 2.91Å; E286-V289 PolarHBondContact O-N 2.81Å; E286-Q290 WeakPolarHBondContact O-CB 3.4Å; E286-Q290 PolarHBondContact O-N 3Å
287	L	96.6	Very high	93.2	Very high	92 Å²	92	81.9 Å²	81.9	48%	0.482	43%	0.43	S	S	.	.	H	α-helix	trans	-58.9	-43.9	172	-73.5	170.7	0	0	0	111.9	K283 K285 V289 Q290 E291	K283-L287 WeakPolarHBondContact O-CG 3.35Å; K283-L287 PolarHBondContact O-N 3.01Å; K283-L287 VanDerWaalsContact O-N 3.11Å; K285-L287 VanDerWaalsContact C-N 3.31Å; K285-L287 PolarHBondContact O-N 3.09Å; L287-V289 PolarHBondContact O-N 2.92Å; L287-Q290 PolarHBondContact O-N 2.8Å; L287-E291 WeakPolarHBondContact O-CB 3.48Å; L287-E291 WeakPolarHBondContact O-CG 3.37Å; L287-E291 PolarHBondContact O-N 2.85Å
288	L	96.6	Very high	93.6	Very high	19 Å²	19	83.7 Å²	83.7	10%	0.099	44%	0.439	C	S	.	.	H	α-helix	trans	-65.2	-35.2	177.5	-173.5	64.9	0	0	0	112.5	P264 Q265 M280 D284 K285 E286 N292	P264-L288 HydrophobicContact CB-CD2 3.89Å; P264-L288 HydrophobicContact CB-CG 4.16Å; P264-L288 HydrophobicContact CG-CB 4.35Å; P264-L288 HydrophobicContact CG-CD2 4.09Å; P264-L288 HydrophobicContact CG-CG 4.46Å; Q265-L288 HydrophobicContact CB-CD2 4.14Å; M280-L288 HydrophobicContact CE-CB 4.12Å; M280-L288 HydrophobicContact CE-CD2 3.91Å; D284-L288 WeakPolarHBondContact O-CB 3.2Å; D284-L288 PolarHBondContact O-N 2.84Å; D284-L288 VanDerWaalsContact O-N 3.07Å; K285-L288 CarbonylContact O-C 3.58Å; K285-L288 WeakPolarHBondContact O-CA 3.34Å; K285-L288 WeakPolarHBondContact O-CB 3.33Å; K285-L288 PolarHBondContact O-N 2.89Å; K285-L288 VanDerWaalsContact O-N 3.07Å; E286-L288 VanDerWaalsContact C-N 3.35Å; E286-L288 PolarHBondContact O-N 2.91Å; L288-N292 WeakPolarHBondContact CD1-ND2 3.29Å; L288-N292 PolarHBondContact O-N 3.21Å; L288-N292 PolarHBondContact O-ND2 2.76Å
289	V	97.4	Very high	94.4	Very high	4 Å²	4	79.8 Å²	79.8	2%	0.024	43%	0.425	C	S	.	.	H	α-helix	trans	-66.5	-47.5	170.4	175.6	0	0	0	0	110.2	F261 P264 K285 E286 L287 E291 N292 F293 H414	F261-V289 HydrophobicContact CD1-CG1 3.87Å; F261-V289 HydrophobicContact CD1-CG2 4.27Å; F261-V289 HydrophobicContact CE1-CG1 4.29Å; P264-V289 HydrophobicContact CB-CG2 4Å; P264-V289 HydrophobicContact CG-CG2 3.94Å; K285-V289 PolarHBondContact O-N 2.86Å; E286-V289 PolarHBondContact O-N 2.81Å; L287-V289 PolarHBondContact O-N 2.92Å; V289-E291 PolarHBondContact O-N 2.87Å; V289-N292 PolarHBondContact O-N 3.33Å; V289-F293 HydrophobicContact CG1-CD2 3.99Å; V289-F293 WeakPolarHBondContact O-CB 3.43Å; V289-F293 WeakPolarHBondContact O-CD2 3.4Å; V289-F293 PolarHBondContact O-N 3.49Å; V289-H414 WeakPolarHBondContact CG1-NE2 3.38Å
290	Q	96.2	Very high	95.1	Very high	108 Å²	108	74.3 Å²	74.3	51%	0.505	40%	0.397	S	S	.	.	H	α-helix	trans	-60.7	-45.3	-178	-171.7	-179.8	3.7	0	0	112.4	E286 L287 N292 C294	E286-Q290 WeakPolarHBondContact O-CB 3.4Å; E286-Q290 PolarHBondContact O-N 3Å; L287-Q290 PolarHBondContact O-N 2.8Å; Q290-N292 VanDerWaalsContact C-N 3.31Å; Q290-N292 PolarHBondContact O-N 2.64Å; Q290-C294 HydrophobicContact CG-CB 4.04Å; Q290-C294 WeakPolarHBondContact O-CA 3.31Å; Q290-C294 VanDerWaalsContact O-CB 3.27Å; Q290-C294 WeakPolarHBondContact O-CB 3.34Å; Q290-C294 PolarHBondContact O-N 3.49Å
291	E	95.9	Very high	95.3	Very high	131 Å²	131	72.7 Å²	72.7	61%	0.612	39%	0.389	S	S	*	.	H	α-helix	trans	-60.2	-39.1	177.3	-76.8	179.9	171.2	0	0	112.4	L287 V289 I299	L287-E291 WeakPolarHBondContact O-CB 3.48Å; L287-E291 WeakPolarHBondContact O-CG 3.37Å; L287-E291 PolarHBondContact O-N 2.85Å; V289-E291 PolarHBondContact O-N 2.87Å; E291-I299 WeakPolarHBondContact O-CD1 3.47Å
292	N	97.3	Very high	95.3	Very high	12 Å²	12	70.1 Å²	70.1	6%	0.064	38%	0.382	C	S	.	.	H	α-helix	trans	-90.9	-30.7	-173.3	-69	-86.9	0	0	0	113.7	Y268 L288 V289 Q290 I298 I299	Y268-N292 HydrophobicContact CD1-CB 4.28Å; Y268-N292 WeakPolarHBondContact CD1-OD1 3.37Å; Y268-N292 HydrophobicContact CE1-CB 3.62Å; Y268-N292 WeakPolarHBondContact CE1-OD1 3.22Å; Y268-N292 HydrophobicContact CE2-CB 4.18Å; L288-N292 WeakPolarHBondContact CD1-ND2 3.29Å; L288-N292 PolarHBondContact O-N 3.21Å; L288-N292 PolarHBondContact O-ND2 2.76Å; V289-N292 PolarHBondContact O-N 3.33Å; Q290-N292 VanDerWaalsContact C-N 3.31Å; Q290-N292 PolarHBondContact O-N 2.64Å; N292-I298 WeakPolarHBondContact O-CD1 3.17Å; N292-I299 HydrophobicContact CB-CB 4.06Å; N292-I299 PolarHBondContact O-N 3.4Å; N292-I299 VanDerWaalsContact OD1-CB 3.24Å; N292-I299 WeakPolarHBondContact OD1-CB 3.23Å; N292-I299 WeakPolarHBondContact OD1-CG2 3.03Å
293	F	97.2	Very high	95.4	Very high	8 Å²	8	65 Å²	65	4%	0.035	36%	0.355	C	S	.	.	H	α-helix	trans	-107.8	-23.4	-176.2	-70.6	-93.7	0	0	0	115.3	V260 F261 Y268 V289 I298 I406 H414	V260-F293 HydrophobicContact CG2-CE2 4.49Å; V260-F293 HydrophobicContact CG2-CZ 4.43Å; F261-F293 HydrophobicContact CD1-CE2 4.36Å; F261-F293 HydrophobicContact CE1-CD1 4.07Å; F261-F293 AromaticContact CE1-CD2 3.98Å; F261-F293 HydrophobicContact CE1-CD2 3.98Å; F261-F293 AromaticContact CE1-CE1 3.74Å; F261-F293 HydrophobicContact CE1-CE1 3.74Å; F261-F293 AromaticContact CE1-CE2 3.64Å; F261-F293 HydrophobicContact CE1-CE2 3.64Å; F261-F293 HydrophobicContact CE1-CG 4.18Å; F261-F293 AromaticContact CE1-CZ 3.51Å; F261-F293 HydrophobicContact CE1-CZ 3.51Å; F261-F293 HydrophobicContact CZ-CD1 4.39Å; F261-F293 AromaticContact CZ-CE1 3.81Å; F261-F293 HydrophobicContact CZ-CE1 3.81Å; F261-F293 HydrophobicContact CZ-CE2 4.41Å; F261-F293 AromaticContact CZ-CZ 3.82Å; F261-F293 HydrophobicContact CZ-CZ 3.82Å; Y268-F293 AromaticContact CE2-CE2 3.95Å; Y268-F293 HydrophobicContact CE2-CE2 3.95Å; Y268-F293 WeakPolarHBondContact OH-CE2 3.14Å; V289-F293 HydrophobicContact CG1-CD2 3.99Å; V289-F293 WeakPolarHBondContact O-CB 3.43Å; V289-F293 WeakPolarHBondContact O-CD2 3.4Å; V289-F293 PolarHBondContact O-N 3.49Å; F293-I298 HydrophobicContact CB-CD1 4.46Å; F293-I298 HydrophobicContact CD1-CD1 3.36Å; F293-I298 HydrophobicContact CE1-CD1 3.67Å; F293-I298 HydrophobicContact CG-CD1 3.93Å; F293-I298 HydrophobicContact CZ-CD1 4.44Å; F293-I406 HydrophobicContact CE1-CG2 4.21Å; F293-I406 HydrophobicContact CZ-CD1 4.47Å; F293-I406 HydrophobicContact CZ-CG1 4.1Å; F293-I406 HydrophobicContact CZ-CG2 4.15Å; F293-H414 HydrophobicContact CB-CB 4.1Å; F293-H414 HydrophobicContact CD1-CB 3.76Å; F293-H414 HydrophobicContact CE1-CB 4.44Å; F293-H414 HydrophobicContact CG-CB 4.07Å
294	C	93.5	Very high	95.4	Very high	75 Å²	75	58.9 Å²	58.9	51%	0.507	33%	0.329	S	S	.	.	S	Bend	trans	-107.6	9.4	-173	-56	0	0	0	0	114.1	Q290 H414	Q290-C294 HydrophobicContact CG-CB 4.04Å; Q290-C294 WeakPolarHBondContact O-CA 3.31Å; Q290-C294 VanDerWaalsContact O-CB 3.27Å; Q290-C294 WeakPolarHBondContact O-CB 3.34Å; Q290-C294 PolarHBondContact O-N 3.49Å; C294-H414 VanDerWaalsContact SG-CE1 3.6Å
295	G	90.8	Very high	95.4	Very high	46 Å²	46	56.8 Å²	56.8	47%	0.474	32%	0.323	S	S	.	.	S	Bend	trans	-78.3	178.3	170.2	0	0	0	0	0	113.1	S297	G295-S297 PolarHBondContact O-N 2.89Å
296	T	90.6	Very high	95.4	Very high	161 Å²	161	58.5 Å²	58.5	99%	0.988	34%	0.336	S	S	*	.	S	Bend	trans	-59.8	-18.7	176.7	-38.2	0	0	0	0	113.5
297	S	92.1	Very high	95.5	Very high	86 Å²	86	53.8 Å²	53.8	60%	0.601	31%	0.314	S	S	*	.	S	Bend	trans	-148.8	141.4	177.2	59.2	0	0	0	0	109.8	G295 I299	G295-S297 PolarHBondContact O-N 2.89Å; S297-I299 PolarHBondContact O-N 3.05Å
298	I	95.3	Very high	95.6	Very high	47 Å²	47	50.4 Å²	50.4	24%	0.241	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-55	131.6	171.6	-175.7	73.2	0	0	0	111.2	N292 F293 V300 I406	N292-I298 WeakPolarHBondContact O-CD1 3.17Å; F293-I298 HydrophobicContact CB-CD1 4.46Å; F293-I298 HydrophobicContact CD1-CD1 3.36Å; F293-I298 HydrophobicContact CE1-CD1 3.67Å; F293-I298 HydrophobicContact CG-CD1 3.93Å; F293-I298 HydrophobicContact CZ-CD1 4.44Å; I298-V300 HydrophobicContact CG1-CG2 4.39Å; I298-V300 HydrophobicContact CG2-CG2 4.49Å; I298-I406 HydrophobicContact CD1-CG2 3.99Å; I298-I406 HydrophobicContact CG1-CG2 3.99Å
299	I	97.3	Very high	95.6	Very high	81 Å²	81	50.2 Å²	50.2	42%	0.415	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-92.7	119.1	166.7	-53.2	-179	0	0	0	107.9	Y268 E291 N292 S297	Y268-I299 VanDerWaalsContact CE1-O 3.29Å; Y268-I299 WeakPolarHBondContact CE1-O 3.28Å; Y268-I299 PolarHBondContact OH-O 3.45Å; E291-I299 WeakPolarHBondContact O-CD1 3.47Å; N292-I299 HydrophobicContact CB-CB 4.06Å; N292-I299 PolarHBondContact O-N 3.4Å; N292-I299 VanDerWaalsContact OD1-CB 3.24Å; N292-I299 WeakPolarHBondContact OD1-CB 3.23Å; N292-I299 WeakPolarHBondContact OD1-CG2 3.03Å; S297-I299 PolarHBondContact O-N 3.05Å
300	V	97.2	Very high	95.7	Very high	25 Å²	25	50.7 Å²	50.7	15%	0.152	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-93.2	136.2	176.3	178.9	0	0	0	0	108.9	I298 D302 L324 A326 I406 A407	I298-V300 HydrophobicContact CG1-CG2 4.39Å; I298-V300 HydrophobicContact CG2-CG2 4.49Å; V300-D302 PolarHBondContact O-N 2.82Å; V300-L324 HydrophobicContact CG1-CD2 3.56Å; V300-L324 HydrophobicContact CG1-CG 3.76Å; V300-A326 HydrophobicContact CG2-CB 3.97Å; V300-I406 HydrophobicContact CG2-CG2 4.42Å; V300-A407 HydrophobicContact CG1-CB 4.01Å; V300-A407 HydrophobicContact CG2-CB 4.01Å
301	P	95.9	Very high	95.7	Very high	9 Å²	9	47.6 Å²	47.6	6%	0.058	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-53.8	139	177.9	-26.7	33.7	0	0	0	113.2	Y268 L303 I406	Y268-P301 HydrophobicContact CD1-CB 4.42Å; Y268-P301 HydrophobicContact CD1-CG 3.94Å; Y268-P301 HydrophobicContact CE1-CG 3.68Å; Y268-P301 HydrophobicContact CE2-CG 4.3Å; Y268-P301 HydrophobicContact CG-CG 4.36Å; P301-L303 PolarHBondContact O-N 2.9Å; P301-I406 HydrophobicContact CG-CD1 3.93Å
302	D	93.5	Very high	95.5	Very high	88 Å²	88	45.3 Å²	45.3	47%	0.471	27%	0.273	S	S	.	.			trans	-72.3	71.7	172.1	178	50.6	0	0	0	110.7	W270 K271 V300 R325	W270-D302 PolarHBondContact NE1-O 2.89Å; K271-D302 WeakPolarHBondContact CE-O 3.39Å; K271-D302 IonicContact NZ-OD2 2.82Å; K271-D302 PolarHBondContact NZ-OD2 3.17Å; V300-D302 PolarHBondContact O-N 2.82Å; D302-R325 IonicContact OD1-NH1 2.65Å
303	L	96.4	Very high	95.2	Very high	6 Å²	6	48.5 Å²	48.5	3%	0.031	31%	0.309	C	S	.	.			trans	-91.8	121.1	179.6	-174.5	62	0	0	0	109.9	W270 P301 Q323 L324 L399 W400	W270-L303 HydrophobicContact CD2-CD1 4.02Å; W270-L303 HydrophobicContact CE3-CD1 4.45Å; W270-L303 HydrophobicContact CH2-CD1 4.26Å; W270-L303 HydrophobicContact CZ2-CD1 3.8Å; P301-L303 PolarHBondContact O-N 2.9Å; L303-Q323 WeakPolarHBondContact O-CA 3.1Å; L303-L324 HydrophobicContact CB-CB 3.97Å; L303-L324 HydrophobicContact CB-CD2 4.04Å; L303-L324 HydrophobicContact CD2-CD2 4.34Å; L303-L324 PolarHBondContact O-N 2.91Å; L303-L399 HydrophobicContact CD1-CB 4.27Å; L303-L399 HydrophobicContact CD1-CD1 4.43Å; L303-L399 HydrophobicContact CD2-CB 4.29Å; L303-W400 HydrophobicContact CD2-CB 4.28Å; L303-W400 HydrophobicContact CD2-CD2 3.53Å; L303-W400 HydrophobicContact CD2-CE3 3.85Å; L303-W400 HydrophobicContact CD2-CG 3.74Å; L303-W400 HydrophobicContact CD2-CZ2 4.38Å; L303-W400 HydrophobicContact CD2-CZ3 4.39Å; L303-W400 HydrophobicContact CG-CD2 4.1Å; L303-W400 HydrophobicContact CG-CE3 4.44Å; L303-W400 HydrophobicContact CG-CH2 4.38Å; L303-W400 HydrophobicContact CG-CZ2 4.03Å
304	E	95.4	Very high	95.1	Very high	44 Å²	44	53.8 Å²	53.8	21%	0.206	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	147.2	172.6	62.7	174.2	147.8	0	0	108.8	W270 K271 F322 Q323 K338	W270-E304 WeakPolarHBondContact CH2-O 3.42Å; W270-E304 HydrophobicContact CZ2-CG 4.36Å; K271-E304 IonicContact NZ-OE1 2.74Å; K271-E304 PolarHBondContact NZ-OE1 2.88Å; E304-F322 VanDerWaalsContact CA-O 3.3Å; E304-F322 WeakPolarHBondContact CA-O 3.27Å; E304-Q323 HydrophobicContact CB-CG 3.95Å; E304-K338 IonicContact OE1-NZ 2.76Å; E304-K338 IonicContact OE2-NZ 3.82Å; E304-K338 PolarHBondContact OE2-NZ 3.34Å
305	G	95.5	Very high	95.2	Very high	20 Å²	20	56.3 Å²	56.3	21%	0.206	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.1	157.5	-177.4	0	0	0	0	0	113.1	F322	G305-F322 PolarHBondContact N-O 3.43Å; G305-F322 PolarHBondContact O-N 3.14Å
306	V	96.7	Very high	95.5	Very high	68 Å²	68	56.2 Å²	56.2	41%	0.412	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	126.4	169.4	179.1	0	0	0	0	108	Q319 R320	V306-Q319 HydrophobicContact CG1-CB 3.84Å; V306-Q319 HydrophobicContact CG1-CG 3.97Å; V306-R320 WeakPolarHBondContact CA-O 3.41Å
307	L	98.1	Very high	95.9	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	151.5	170	-59	174.9	0	0	0	109.8	Q319 R320 F322 F372 L389 C391 T396 W400	L307-Q319 WeakPolarHBondContact O-CA 3.3Å; L307-R320 PolarHBondContact N-O 2.64Å; L307-R320 PolarHBondContact O-N 2.98Å; L307-F322 HydrophobicContact CB-CD2 3.65Å; L307-F322 HydrophobicContact CB-CE2 3.85Å; L307-F322 HydrophobicContact CD1-CB 4.49Å; L307-F322 HydrophobicContact CD1-CD2 4.04Å; L307-F322 HydrophobicContact CD1-CG 4.44Å; L307-F322 HydrophobicContact CG-CD2 4.08Å; L307-F372 HydrophobicContact CD1-CE1 3.8Å; L307-F372 HydrophobicContact CD1-CZ 3.7Å; L307-L389 HydrophobicContact CD1-CB 4.37Å; L307-L389 HydrophobicContact CD1-CD2 3.8Å; L307-C391 HydrophobicContact CD2-CB 4.34Å; L307-C391 WeakPolarHBondContact CD2-SG 3.39Å; L307-T396 HydrophobicContact CD2-CG2 4.45Å; L307-W400 HydrophobicContact CD1-CD2 3.92Å; L307-W400 HydrophobicContact CD1-CE3 4.42Å; L307-W400 HydrophobicContact CD1-CG 4.23Å; L307-W400 HydrophobicContact CD1-CZ2 4.13Å
308	H	98.2	Very high	96.1	Very high	20 Å²	20	51.1 Å²	51.1	9%	0.093	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	110.3	172.4	-62	89.9	0	0	0	109	W317 Q319 P367 L389 C390 D392	H308-W317 HydrophobicContact CB-CB 4.48Å; H308-W317 HydrophobicContact CB-CE3 4.06Å; H308-W317 VanDerWaalsContact O-CE3 3.31Å; H308-W317 WeakPolarHBondContact O-CZ3 3.27Å; H308-Q319 WeakPolarHBondContact CD2-CG 3.28Å; H308-Q319 VanDerWaalsContact NE2-CG 3.29Å; H308-Q319 WeakPolarHBondContact NE2-CG 3.36Å; H308-Q319 PolarHBondContact NE2-NE2 3.25Å; H308-P367 HydrophobicContact CB-CG 4.21Å; H308-L389 WeakPolarHBondContact O-CA 3.48Å; H308-C390 HydrophobicContact CB-CB 3.96Å; H308-C390 PolarHBondContact N-O 3.5Å; H308-C390 PolarHBondContact ND1-O 3.26Å; H308-C390 PolarHBondContact O-N 3.32Å; H308-D392 IonicContact CE1-OD1 3.48Å; H308-D392 PolarHBondContact CE1-OD1 3.06Å; H308-D392 IonicContact ND1-OD1 2.66Å
309	L	97.9	Very high	96.1	Very high	15 Å²	15	54.4 Å²	54.4	8%	0.079	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	125.4	173.4	171.8	60	0	0	0	109.9	W317 K318 F322 F346	L309-W317 CarbonylContact O-C 3.5Å; L309-W317 WeakPolarHBondContact O-CA 3.4Å; L309-K318 PolarHBondContact N-O 3.47Å; L309-K318 PolarHBondContact O-N 2.91Å; L309-F322 HydrophobicContact CB-CE2 4.41Å; L309-F322 HydrophobicContact CB-CZ 4.09Å; L309-F322 HydrophobicContact CD2-CZ 4.24Å; L309-F346 HydrophobicContact CD1-CE1 4.42Å; L309-F346 HydrophobicContact CD1-CE2 4.07Å; L309-F346 HydrophobicContact CD1-CZ 3.52Å; L309-F346 HydrophobicContact CD2-CE2 3.64Å; L309-F346 HydrophobicContact CD2-CZ 3.96Å; L309-F346 HydrophobicContact CG-CZ 4.4Å
310	K	98	Very high	96.1	Very high	14 Å²	14	54.6 Å²	54.6	6%	0.061	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	139.6	169.4	-174.3	-174.6	164.5	-64.3	0	110.2	K314 W317 Y364 Y388	K310-K314 WeakPolarHBondContact CE-O 3.45Å; K310-K314 PolarHBondContact NZ-O 3.28Å; K310-W317 HydrophobicContact CB-CD2 3.97Å; K310-W317 HydrophobicContact CB-CE3 3.86Å; K310-W317 HydrophobicContact CB-CH2 3.76Å; K310-W317 HydrophobicContact CB-CZ2 3.82Å; K310-W317 HydrophobicContact CB-CZ3 3.76Å; K310-W317 HydrophobicContact CD-CH2 4.48Å; K310-W317 HydrophobicContact CD-CZ2 4.11Å; K310-W317 HydrophobicContact CG-CD2 4.46Å; K310-W317 HydrophobicContact CG-CH2 4.38Å; K310-W317 HydrophobicContact CG-CZ2 3.98Å; K310-W317 VanDerWaalsContact N-CE3 3.32Å; K310-Y364 HydrophobicContact CD-CD1 4.25Å; K310-Y364 HydrophobicContact CD-CG 4.2Å; K310-Y388 HydrophobicContact CD-CD2 3.75Å; K310-Y388 HydrophobicContact CD-CE2 4.43Å; K310-Y388 HydrophobicContact CD-CG 3.94Å; K310-Y388 PolarHBondContact N-O 3.32Å; K310-Y388 VanDerWaalsContact N-O 3.09Å
311	E	96	Very high	96	Very high	44 Å²	44	55.4 Å²	55.4	21%	0.206	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-78.9	143.3	172	-69	-169.4	91.2	0	0	112.7	G313 K314 S316 K318	E311-G313 PolarHBondContact O-N 3.06Å; E311-K314 HydrophobicContact CB-CB 3.99Å; E311-K314 HydrophobicContact CB-CD 4.25Å; E311-K314 PolarHBondContact O-N 2.96Å; E311-K314 VanDerWaalsContact O-N 3.12Å; E311-S316 PolarHBondContact N-O 3.41Å; E311-S316 WeakPolarHBondContact OE2-CB 3.09Å; E311-S316 PolarHBondContact OE2-OG 3.32Å; E311-K318 VanDerWaalsContact CD-NZ 3.27Å; E311-K318 HydrophobicContact CG-CD 3.94Å; E311-K318 HydrophobicContact CG-CG 4.25Å; E311-K318 VanDerWaalsContact OE1-CE 3.28Å; E311-K318 WeakPolarHBondContact OE1-CE 3.33Å; E311-K318 IonicContact OE1-NZ 2.8Å; E311-K318 PolarHBondContact OE1-NZ 2.82Å; E311-K318 VanDerWaalsContact OE2-CE 3.25Å; E311-K318 WeakPolarHBondContact OE2-CE 3.18Å; E311-K318 IonicContact OE2-NZ 2.67Å; E311-K318 PolarHBondContact OE2-NZ 3Å
312	D	93.6	Very high	96	Very high	83 Å²	83	55 Å²	55	44%	0.444	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	133.7	179.3	-62.5	-20.5	0	0	0	110.5	K314 K387	D312-K314 PolarHBondContact O-N 3.17Å; D312-K387 IonicContact OD1-NZ 3.62Å; D312-K387 PolarHBondContact OD1-NZ 3.39Å; D312-K387 IonicContact OD2-NZ 2.71Å; D312-K387 PolarHBondContact OD2-NZ 3.48Å
313	G	90.3	Very high	96.2	Very high	79 Å²	79	51.2 Å²	51.2	81%	0.814	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	-2.1	-174.4	0	0	0	0	0	116.4	E311	E311-G313 PolarHBondContact O-N 3.06Å
314	K	94.9	Very high	96.3	Very high	118 Å²	118	51 Å²	51	51%	0.513	27%	0.268	S	S	.	.	S	Bend	trans	-122.6	164	-170.4	-64.6	174.2	-172.1	174.9	0	113.2	K310 E311 D312 S316	K310-K314 WeakPolarHBondContact CE-O 3.45Å; K310-K314 PolarHBondContact NZ-O 3.28Å; E311-K314 HydrophobicContact CB-CB 3.99Å; E311-K314 HydrophobicContact CB-CD 4.25Å; E311-K314 PolarHBondContact O-N 2.96Å; E311-K314 VanDerWaalsContact O-N 3.12Å; D312-K314 PolarHBondContact O-N 3.17Å; K314-S316 WeakPolarHBondContact CB-OG 3.45Å
315	K	96.1	Very high	96.3	Very high	129 Å²	129	52.8 Å²	52.8	56%	0.561	27%	0.273	S	S	*	.	S	Bend	trans	-103.1	29.2	170.8	-59.9	-168.7	-178.9	-163.2	0	111.8	R363 Y364	K315-R363 WeakPolarHBondContact CE-O 3.45Å; K315-R363 PolarHBondContact NZ-O 2.9Å; K315-Y364 WeakPolarHBondContact CB-O 3.32Å
316	S	96.9	Very high	96.3	Very high	43 Å²	43	54.5 Å²	54.5	30%	0.301	29%	0.285	S	S	.	.			trans	-108.4	151.4	175.3	53.4	0	0	0	0	110.4	E311 K314	E311-S316 PolarHBondContact N-O 3.41Å; E311-S316 WeakPolarHBondContact OE2-CB 3.09Å; E311-S316 PolarHBondContact OE2-OG 3.32Å; K314-S316 WeakPolarHBondContact CB-OG 3.45Å
317	W	98.3	Very high	96.2	Very high	38 Å²	38	53.7 Å²	53.7	14%	0.144	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.9	-171.8	-64.7	77.2	0	0	0	110.3	H308 L309 K310 V360 Y364 K365 A366 C390	H308-W317 HydrophobicContact CB-CB 4.48Å; H308-W317 HydrophobicContact CB-CE3 4.06Å; H308-W317 VanDerWaalsContact O-CE3 3.31Å; H308-W317 WeakPolarHBondContact O-CZ3 3.27Å; L309-W317 CarbonylContact O-C 3.5Å; L309-W317 WeakPolarHBondContact O-CA 3.4Å; K310-W317 HydrophobicContact CB-CD2 3.97Å; K310-W317 HydrophobicContact CB-CE3 3.86Å; K310-W317 HydrophobicContact CB-CH2 3.76Å; K310-W317 HydrophobicContact CB-CZ2 3.82Å; K310-W317 HydrophobicContact CB-CZ3 3.76Å; K310-W317 HydrophobicContact CD-CH2 4.48Å; K310-W317 HydrophobicContact CD-CZ2 4.11Å; K310-W317 HydrophobicContact CG-CD2 4.46Å; K310-W317 HydrophobicContact CG-CH2 4.38Å; K310-W317 HydrophobicContact CG-CZ2 3.98Å; K310-W317 VanDerWaalsContact N-CE3 3.32Å; W317-V360 HydrophobicContact CH2-CG1 3.93Å; W317-V360 HydrophobicContact CZ2-CG1 4.05Å; W317-Y364 PolarHBondContact NE1-O 2.92Å; W317-K365 VanDerWaalsContact CD1-O 3.3Å; W317-K365 PolarHBondContact NE1-O 2.97Å; W317-A366 HydrophobicContact CD2-CB 4.43Å; W317-A366 HydrophobicContact CH2-CB 3.8Å; W317-A366 HydrophobicContact CZ2-CB 3.45Å; W317-A366 VanDerWaalsContact CZ2-CB 3.45Å; W317-A366 HydrophobicContact CZ3-CB 4.44Å; W317-C390 HydrophobicContact CE3-CB 3.9Å; W317-C390 HydrophobicContact CH2-CB 4.16Å; W317-C390 HydrophobicContact CZ3-CB 3.48Å; W317-C390 VanDerWaalsContact CZ3-CB 3.48Å
318	K	96.6	Very high	96.1	Very high	103 Å²	103	53.7 Å²	53.7	45%	0.448	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	119.4	-177.2	-75.2	178	173.4	166.6	0	110.7	L309 E311 R320	L309-K318 PolarHBondContact N-O 3.47Å; L309-K318 PolarHBondContact O-N 2.91Å; E311-K318 VanDerWaalsContact CD-NZ 3.27Å; E311-K318 HydrophobicContact CG-CD 3.94Å; E311-K318 HydrophobicContact CG-CG 4.25Å; E311-K318 VanDerWaalsContact OE1-CE 3.28Å; E311-K318 WeakPolarHBondContact OE1-CE 3.33Å; E311-K318 IonicContact OE1-NZ 2.8Å; E311-K318 PolarHBondContact OE1-NZ 2.82Å; E311-K318 VanDerWaalsContact OE2-CE 3.25Å; E311-K318 WeakPolarHBondContact OE2-CE 3.18Å; E311-K318 IonicContact OE2-NZ 2.67Å; E311-K318 PolarHBondContact OE2-NZ 3Å; K318-R320 PolarHBondContact O-N 2.68Å
319	Q	96.3	Very high	96.1	Very high	116 Å²	116	52.8 Å²	52.8	54%	0.542	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	132.8	170.3	-72.9	-178.7	-17.5	0	0	111	V306 L307 H308	V306-Q319 HydrophobicContact CG1-CB 3.84Å; V306-Q319 HydrophobicContact CG1-CG 3.97Å; L307-Q319 WeakPolarHBondContact O-CA 3.3Å; H308-Q319 WeakPolarHBondContact CD2-CG 3.28Å; H308-Q319 VanDerWaalsContact NE2-CG 3.29Å; H308-Q319 WeakPolarHBondContact NE2-CG 3.36Å; H308-Q319 PolarHBondContact NE2-NE2 3.25Å
320	R	95.3	Very high	96.1	Very high	84 Å²	84	54.4 Å²	54.4	32%	0.317	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	148.8	167.7	-58	-174.5	-175.8	-149.6	3.5	109.5	V306 L307 K318 F322 Y331	V306-R320 WeakPolarHBondContact CA-O 3.41Å; L307-R320 PolarHBondContact N-O 2.64Å; L307-R320 PolarHBondContact O-N 2.98Å; K318-R320 PolarHBondContact O-N 2.68Å; R320-F322 HydrophobicContact CB-CD2 4.19Å; R320-F322 HydrophobicContact CB-CE2 3.7Å; R320-F322 HydrophobicContact CB-CZ 4.04Å; R320-F322 WeakPolarHBondContact O-CD2 3.36Å; R320-F322 PolarHBondContact O-N 3.35Å; R320-Y331 PolarHBondContact NH1-OH 3.22Å
321	L	95.4	Very high	95.9	Very high	43 Å²	43	55.7 Å²	55.7	23%	0.225	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	115.1	166.8	176.6	66.2	0	0	0	108.7	Y331 V332 K338	L321-Y331 WeakPolarHBondContact O-CA 3.36Å; L321-V332 HydrophobicContact CD2-CB 4.45Å; L321-V332 HydrophobicContact CD2-CG2 4.02Å; L321-V332 HydrophobicContact CG-CG2 4.45Å; L321-V332 PolarHBondContact O-N 2.88Å; L321-V332 VanDerWaalsContact O-N 3.07Å; L321-K338 HydrophobicContact CD2-CD 4.15Å; L321-K338 HydrophobicContact CD2-CG 4.2Å
322	F	97.4	Very high	95.6	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	155.7	173.6	-67.7	-86.4	0	0	0	111.1	E304 G305 L307 L309 R320 I329 Y330 F346 L389 W400	E304-F322 VanDerWaalsContact CA-O 3.3Å; E304-F322 WeakPolarHBondContact CA-O 3.27Å; G305-F322 PolarHBondContact N-O 3.43Å; G305-F322 PolarHBondContact O-N 3.14Å; L307-F322 HydrophobicContact CB-CD2 3.65Å; L307-F322 HydrophobicContact CB-CE2 3.85Å; L307-F322 HydrophobicContact CD1-CB 4.49Å; L307-F322 HydrophobicContact CD1-CD2 4.04Å; L307-F322 HydrophobicContact CD1-CG 4.44Å; L307-F322 HydrophobicContact CG-CD2 4.08Å; L309-F322 HydrophobicContact CB-CE2 4.41Å; L309-F322 HydrophobicContact CB-CZ 4.09Å; L309-F322 HydrophobicContact CD2-CZ 4.24Å; R320-F322 HydrophobicContact CB-CD2 4.19Å; R320-F322 HydrophobicContact CB-CE2 3.7Å; R320-F322 HydrophobicContact CB-CZ 4.04Å; R320-F322 WeakPolarHBondContact O-CD2 3.36Å; R320-F322 PolarHBondContact O-N 3.35Å; F322-I329 HydrophobicContact CB-CG2 3.97Å; F322-I329 HydrophobicContact CD1-CG2 3.65Å; F322-I329 HydrophobicContact CG-CG2 4.18Å; F322-Y330 CarbonylContact C-O 3.53Å; F322-Y330 VanDerWaalsContact CA-O 3.25Å; F322-Y330 WeakPolarHBondContact CA-O 3.38Å; F322-F346 HydrophobicContact CE1-CB 4.23Å; F322-F346 AromaticContact CE1-CD1 3.86Å; F322-F346 HydrophobicContact CE1-CD1 3.86Å; F322-F346 HydrophobicContact CE1-CD2 4.24Å; F322-F346 HydrophobicContact CE1-CE1 4.32Å; F322-F346 AromaticContact CE1-CG 3.84Å; F322-F346 HydrophobicContact CE1-CG 3.84Å; F322-L389 HydrophobicContact CE1-CD2 4.34Å; F322-L389 HydrophobicContact CE2-CD2 4.16Å; F322-L389 HydrophobicContact CZ-CD2 4.04Å; F322-W400 HydrophobicContact CB-CH2 3.71Å; F322-W400 HydrophobicContact CB-CZ2 4.08Å; F322-W400 HydrophobicContact CB-CZ3 4.5Å
323	Q	96.8	Very high	95.5	Very high	9 Å²	9	52 Å²	52	4%	0.042	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	134.8	173.7	-56.8	-172.7	24.2	0	0	109.4	L303 E304 Y330 L343	L303-Q323 WeakPolarHBondContact O-CA 3.1Å; E304-Q323 HydrophobicContact CB-CG 3.95Å; Q323-Y330 PolarHBondContact N-O 2.92Å; Q323-Y330 PolarHBondContact O-N 3.03Å; Q323-L343 HydrophobicContact CG-CD2 4.48Å
324	L	97.7	Very high	95.2	Very high	2 Å²	2	58 Å²	58	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	141.6	175.5	-177.1	63.5	0	0	0	110.6	V300 L303 F349 W400 I404 A407	V300-L324 HydrophobicContact CG1-CD2 3.56Å; V300-L324 HydrophobicContact CG1-CG 3.76Å; L303-L324 HydrophobicContact CB-CB 3.97Å; L303-L324 HydrophobicContact CB-CD2 4.04Å; L303-L324 HydrophobicContact CD2-CD2 4.34Å; L303-L324 PolarHBondContact O-N 2.91Å; L324-F349 HydrophobicContact CD1-CE2 3.75Å; L324-F349 HydrophobicContact CD1-CZ 3.59Å; L324-W400 HydrophobicContact CB-CH2 4.42Å; L324-W400 HydrophobicContact CB-CZ3 3.99Å; L324-I404 HydrophobicContact CD1-CG1 4.32Å; L324-A407 HydrophobicContact CD1-CB 4.37Å
325	R	95.8	Very high	94.6	Very high	81 Å²	81	56.6 Å²	56.6	31%	0.306	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	164.6	169.5	-62.1	-64.1	-179.3	-102	2.6	108.8	D302 S327 G328 Y330 F349	D302-R325 IonicContact OD1-NH1 2.65Å; R325-S327 VanDerWaalsContact C-N 3.25Å; R325-S327 PolarHBondContact O-N 3.43Å; R325-G328 PolarHBondContact N-O 3.49Å; R325-G328 PolarHBondContact O-N 3.4Å; R325-G328 VanDerWaalsContact O-N 3.17Å; R325-Y330 HydrophobicContact CB-CD2 3.95Å; R325-Y330 HydrophobicContact CB-CE2 3.81Å; R325-Y330 HydrophobicContact CG-CD2 3.7Å; R325-Y330 HydrophobicContact CG-CE2 3.93Å; R325-F349 WeakPolarHBondContact O-CE2 3.38Å
326	A	95	Very high	94.1	Very high	56 Å²	56	56.1 Å²	56.1	46%	0.463	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-37.1	178.2	0	0	0	0	0	113.2	V300	V300-A326 HydrophobicContact CG2-CB 3.97Å
327	S	94.8	Very high	93.5	Very high	51 Å²	51	57.9 Å²	57.9	36%	0.357	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-15.6	179.3	51.6	0	0	0	0	115.3	R325 Y330 Q348 F349	R325-S327 VanDerWaalsContact C-N 3.25Å; R325-S327 PolarHBondContact O-N 3.43Å; S327-Y330 WeakPolarHBondContact OG-CE2 3.49Å; S327-Y330 PolarHBondContact OG-OH 2.62Å; S327-Q348 VanDerWaalsContact O-CA 3.29Å; S327-Q348 WeakPolarHBondContact O-CA 3.41Å; S327-F349 PolarHBondContact O-N 3.04Å
328	G	97.2	Very high	92.8	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.9	-175.4	-168.4	0	0	0	0	0	115.5	R325 V347	R325-G328 PolarHBondContact N-O 3.49Å; R325-G328 PolarHBondContact O-N 3.4Å; R325-G328 VanDerWaalsContact O-N 3.17Å; G328-V347 CarbonylContact C-O 3.59Å; G328-V347 WeakPolarHBondContact CA-O 3.33Å
329	I	98.1	Very high	92.2	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	137.7	170.1	-47	-179	0	0	0	108.9	F322 F346 V347 F349 F372 L374 W400 I404	F322-I329 HydrophobicContact CB-CG2 3.97Å; F322-I329 HydrophobicContact CD1-CG2 3.65Å; F322-I329 HydrophobicContact CG-CG2 4.18Å; I329-F346 HydrophobicContact CB-CD1 4.48Å; I329-F346 WeakPolarHBondContact O-CB 3.34Å; I329-F346 PolarHBondContact O-N 3.44Å; I329-V347 HydrophobicContact CB-CG1 4.04Å; I329-V347 HydrophobicContact CD1-CG1 4.22Å; I329-V347 HydrophobicContact CG1-CG1 4.06Å; I329-V347 PolarHBondContact N-O 3.26Å; I329-V347 PolarHBondContact O-N 2.84Å; I329-F349 HydrophobicContact CD1-CE1 4.27Å; I329-F349 HydrophobicContact CD1-CZ 4.46Å; I329-F349 HydrophobicContact CG1-CE1 3.69Å; I329-F349 HydrophobicContact CG1-CZ 3.57Å; I329-F372 HydrophobicContact CD1-CE2 4.32Å; I329-L374 HydrophobicContact CD1-CD1 3.75Å; I329-W400 HydrophobicContact CD1-CZ3 4.43Å; I329-W400 HydrophobicContact CG2-CH2 4.43Å; I329-W400 HydrophobicContact CG2-CZ3 4.01Å; I329-I404 HydrophobicContact CD1-CD1 3.88Å; I329-I404 HydrophobicContact CD1-CG1 4.26Å
330	Y	97.3	Very high	91.4	Very high	49 Å²	49	58.3 Å²	58.3	19%	0.192	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	158.9	175	-67.1	-105.7	0	0	0	109.9	F322 Q323 R325 S327 L343 I344 C345	F322-Y330 CarbonylContact C-O 3.53Å; F322-Y330 VanDerWaalsContact CA-O 3.25Å; F322-Y330 WeakPolarHBondContact CA-O 3.38Å; Q323-Y330 PolarHBondContact N-O 2.92Å; Q323-Y330 PolarHBondContact O-N 3.03Å; R325-Y330 HydrophobicContact CB-CD2 3.95Å; R325-Y330 HydrophobicContact CB-CE2 3.81Å; R325-Y330 HydrophobicContact CG-CD2 3.7Å; R325-Y330 HydrophobicContact CG-CE2 3.93Å; S327-Y330 WeakPolarHBondContact OG-CE2 3.49Å; S327-Y330 PolarHBondContact OG-OH 2.62Å; Y330-L343 HydrophobicContact CD1-CB 4.07Å; Y330-I344 CarbonylContact C-O 3.52Å; Y330-I344 VanDerWaalsContact CA-O 3.29Å; Y330-I344 WeakPolarHBondContact CA-O 3.47Å; Y330-C345 HydrophobicContact CD1-CB 3.95Å; Y330-C345 HydrophobicContact CE1-CB 3.61Å
331	Y	94.9	Very high	90.9	Very high	41 Å²	41	65.7 Å²	65.7	16%	0.161	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	154.2	172.6	74.7	-83.7	0	0	0	112.4	R320 L321 P333 I344 F346	R320-Y331 PolarHBondContact NH1-OH 3.22Å; L321-Y331 WeakPolarHBondContact O-CA 3.36Å; Y331-P333 HydrophobicContact CE2-CG 4.29Å; Y331-I344 HydrophobicContact CD1-CB 4.15Å; Y331-I344 HydrophobicContact CD1-CG2 4.4Å; Y331-I344 WeakPolarHBondContact CD1-O 3.39Å; Y331-I344 HydrophobicContact CE1-CB 3.65Å; Y331-I344 HydrophobicContact CE1-CG2 3.55Å; Y331-I344 HydrophobicContact CE2-CB 4.4Å; Y331-I344 PolarHBondContact N-O 2.96Å; Y331-I344 PolarHBondContact O-N 2.88Å; Y331-F346 HydrophobicContact CD1-CB 4.09Å
332	V	89.9	Confident	90.6	Very high	20 Å²	20	65 Å²	65	12%	0.121	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-90.5	122.1	173.2	-178	0	0	0	0	109.1	L321 K336 T337 K338 L343	L321-V332 HydrophobicContact CD2-CB 4.45Å; L321-V332 HydrophobicContact CD2-CG2 4.02Å; L321-V332 HydrophobicContact CG-CG2 4.45Å; L321-V332 PolarHBondContact O-N 2.88Å; L321-V332 VanDerWaalsContact O-N 3.07Å; V332-K336 HydrophobicContact CG1-CB 4.34Å; V332-T337 WeakPolarHBondContact CG1-O 3.39Å; V332-K338 HydrophobicContact CG2-CG 4.47Å; V332-L343 HydrophobicContact CG2-CD2 3.69Å
333	P	89.4	Confident	90.4	Very high	30 Å²	30	66.2 Å²	66.2	20%	0.195	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-64.4	151.2	172.6	-21.2	33.6	0	0	0	112.1	Y331 G335 K336 D342 I344	Y331-P333 HydrophobicContact CE2-CG 4.29Å; P333-G335 PolarHBondContact O-N 3.04Å; P333-K336 HydrophobicContact CB-CB 4.25Å; P333-K336 HydrophobicContact CB-CG 3.85Å; P333-K336 HydrophobicContact CG-CB 4.45Å; P333-K336 HydrophobicContact CG-CG 4.15Å; P333-K336 WeakPolarHBondContact O-CB 3.46Å; P333-K336 PolarHBondContact O-N 2.89Å; P333-K336 VanDerWaalsContact O-N 3.1Å; P333-D342 WeakPolarHBondContact CD-O 3.25Å; P333-I344 HydrophobicContact CG-CD1 3.55Å; P333-I344 HydrophobicContact CG-CG1 3.79Å
334	K	84.9	Confident	90.3	Very high	205 Å²	205	69.5 Å²	69.5	89%	0.891	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	132.2	175.9	-67.7	-166.4	175.6	-166.6	0	110.1	K336	K334-K336 VanDerWaalsContact C-N 3.32Å
335	G	81.8	Confident	90.2	Very high	89 Å²	89	71.9 Å²	71.9	92%	0.918	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	79	6.7	-177.5	0	0	0	0	0	115.3	P333	P333-G335 PolarHBondContact O-N 3.04Å
336	K	87.1	Confident	90.3	Very high	118 Å²	118	70 Å²	70	51%	0.513	38%	0.38	S	S	.	.			trans	-104.7	162.2	173.3	-67.7	-55	-148.2	126.6	0	112.4	V332 P333 K334 D342	V332-K336 HydrophobicContact CG1-CB 4.34Å; P333-K336 HydrophobicContact CB-CB 4.25Å; P333-K336 HydrophobicContact CB-CG 3.85Å; P333-K336 HydrophobicContact CG-CB 4.45Å; P333-K336 HydrophobicContact CG-CG 4.15Å; P333-K336 WeakPolarHBondContact O-CB 3.46Å; P333-K336 PolarHBondContact O-N 2.89Å; P333-K336 VanDerWaalsContact O-N 3.1Å; K334-K336 VanDerWaalsContact C-N 3.32Å; K336-D342 HydrophobicContact CB-CB 4Å; K336-D342 WeakPolarHBondContact CD-OD1 3.48Å; K336-D342 WeakPolarHBondContact CE-OD1 2.96Å; K336-D342 IonicContact NZ-OD1 3.67Å; K336-D342 PolarHBondContact NZ-OD1 2.87Å
337	T	83.4	Confident	90.4	Very high	80 Å²	80	68.4 Å²	68.4	49%	0.491	36%	0.364	S	S	.	.			trans	-80.4	167.4	178.8	76.4	0	0	0	0	111.1	V332 S339 D342	V332-T337 WeakPolarHBondContact CG1-O 3.39Å; T337-S339 PolarHBondContact O-N 2.95Å; T337-S339 WeakPolarHBondContact OG1-CB 3.43Å; T337-S339 PolarHBondContact OG1-N 3.15Å; T337-S339 PolarHBondContact OG1-OG 3.5Å; T337-S339 VanDerWaalsContact OG1-OG 3.08Å; T337-D342 WeakPolarHBondContact CB-OD2 3.13Å; T337-D342 PolarHBondContact N-OD2 2.71Å; T337-D342 VanDerWaalsContact N-OD2 3.14Å; T337-D342 WeakPolarHBondContact O-CB 3.27Å; T337-D342 PolarHBondContact OG1-OD2 3.11Å
338	K	84.2	Confident	90.5	Very high	118 Å²	118	71.4 Å²	71.4	51%	0.513	37%	0.373	S	S	.	.	S	Bend	trans	-73.8	7.6	167.8	-62.8	-164.1	-173.1	-170.6	0	113.7	E304 L321 V332	E304-K338 IonicContact OE1-NZ 2.76Å; E304-K338 IonicContact OE2-NZ 3.82Å; E304-K338 PolarHBondContact OE2-NZ 3.34Å; L321-K338 HydrophobicContact CD2-CD 4.15Å; L321-K338 HydrophobicContact CD2-CG 4.2Å; V332-K338 HydrophobicContact CG2-CG 4.47Å
339	S	84.1	Confident	90.5	Very high	47 Å²	47	71.5 Å²	71.5	33%	0.329	37%	0.373	S	S	.	.	S	Bend	trans	-63.6	149.2	-177.4	80.6	0	0	0	0	111.6	T337 R341 D342 L343	T337-S339 PolarHBondContact O-N 2.95Å; T337-S339 WeakPolarHBondContact OG1-CB 3.43Å; T337-S339 PolarHBondContact OG1-N 3.15Å; T337-S339 PolarHBondContact OG1-OG 3.5Å; T337-S339 VanDerWaalsContact OG1-OG 3.08Å; S339-R341 PolarHBondContact O-N 3.05Å; S339-D342 PolarHBondContact O-N 3.46Å; S339-D342 PolarHBondContact OG-N 3.19Å; S339-D342 PolarHBondContact OG-OD2 2.64Å; S339-L343 PolarHBondContact O-N 3.43Å
340	S	79.3	Confident	90.3	Very high	102 Å²	102	76.5 Å²	76.5	71%	0.713	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.3	178.2	51.7	0	0	0	0	114
341	R	84.9	Confident	90.1	Very high	238 Å²	238	79.4 Å²	79.4	90%	0.898	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-20.3	176.9	-61.2	179.6	-179.5	172	-0.2	113.7	S339	S339-R341 PolarHBondContact O-N 3.05Å
342	D	88.9	Confident	90.2	Very high	29 Å²	29	78.5 Å²	78.5	16%	0.155	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-7.9	179	-83.3	-43.2	0	0	0	113	P333 K336 T337 S339 I344	P333-D342 WeakPolarHBondContact CD-O 3.25Å; K336-D342 HydrophobicContact CB-CB 4Å; K336-D342 WeakPolarHBondContact CD-OD1 3.48Å; K336-D342 WeakPolarHBondContact CE-OD1 2.96Å; K336-D342 IonicContact NZ-OD1 3.67Å; K336-D342 PolarHBondContact NZ-OD1 2.87Å; T337-D342 WeakPolarHBondContact CB-OD2 3.13Å; T337-D342 PolarHBondContact N-OD2 2.71Å; T337-D342 VanDerWaalsContact N-OD2 3.14Å; T337-D342 WeakPolarHBondContact O-CB 3.27Å; T337-D342 PolarHBondContact OG1-OD2 3.11Å; S339-D342 PolarHBondContact O-N 3.46Å; S339-D342 PolarHBondContact OG-N 3.19Å; S339-D342 PolarHBondContact OG-OD2 2.64Å; D342-I344 PolarHBondContact O-N 3.32Å
343	L	92.6	Very high	90.6	Very high	26 Å²	26	78 Å²	78	14%	0.136	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-74.2	123.1	-178.8	-71	-179.9	0	0	0	111.8	Q323 Y330 V332 S339	Q323-L343 HydrophobicContact CG-CD2 4.48Å; Y330-L343 HydrophobicContact CD1-CB 4.07Å; V332-L343 HydrophobicContact CG2-CD2 3.69Å; S339-L343 PolarHBondContact O-N 3.43Å
344	I	95.1	Very high	91	Very high	78 Å²	78	77.1 Å²	77.1	40%	0.4	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	129.4	171	-59.2	-173.9	0	0	0	108.7	Y330 Y331 P333 D342 F346	Y330-I344 CarbonylContact C-O 3.52Å; Y330-I344 VanDerWaalsContact CA-O 3.29Å; Y330-I344 WeakPolarHBondContact CA-O 3.47Å; Y331-I344 HydrophobicContact CD1-CB 4.15Å; Y331-I344 HydrophobicContact CD1-CG2 4.4Å; Y331-I344 WeakPolarHBondContact CD1-O 3.39Å; Y331-I344 HydrophobicContact CE1-CB 3.65Å; Y331-I344 HydrophobicContact CE1-CG2 3.55Å; Y331-I344 HydrophobicContact CE2-CB 4.4Å; Y331-I344 PolarHBondContact N-O 2.96Å; Y331-I344 PolarHBondContact O-N 2.88Å; P333-I344 HydrophobicContact CG-CD1 3.55Å; P333-I344 HydrophobicContact CG-CG1 3.79Å; D342-I344 PolarHBondContact O-N 3.32Å; I344-F346 PolarHBondContact O-N 3.01Å
345	C	96.4	Very high	91.7	Very high	52 Å²	52	67.5 Å²	67.5	35%	0.351	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	128.7	172	-169.5	0	0	0	0	109.6	Y330	Y330-C345 HydrophobicContact CD1-CB 3.95Å; Y330-C345 HydrophobicContact CE1-CB 3.61Å
346	F	96.5	Very high	92.5	Very high	42 Å²	42	64.6 Å²	64.6	18%	0.184	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-43.3	176.3	179.4	-120.2	0	0	0	111.5	L309 F322 I329 Y331 I344 K387 L389	L309-F346 HydrophobicContact CD1-CE1 4.42Å; L309-F346 HydrophobicContact CD1-CE2 4.07Å; L309-F346 HydrophobicContact CD1-CZ 3.52Å; L309-F346 HydrophobicContact CD2-CE2 3.64Å; L309-F346 HydrophobicContact CD2-CZ 3.96Å; L309-F346 HydrophobicContact CG-CZ 4.4Å; F322-F346 HydrophobicContact CE1-CB 4.23Å; F322-F346 AromaticContact CE1-CD1 3.86Å; F322-F346 HydrophobicContact CE1-CD1 3.86Å; F322-F346 HydrophobicContact CE1-CD2 4.24Å; F322-F346 HydrophobicContact CE1-CE1 4.32Å; F322-F346 AromaticContact CE1-CG 3.84Å; F322-F346 HydrophobicContact CE1-CG 3.84Å; I329-F346 HydrophobicContact CB-CD1 4.48Å; I329-F346 WeakPolarHBondContact O-CB 3.34Å; I329-F346 PolarHBondContact O-N 3.44Å; Y331-F346 HydrophobicContact CD1-CB 4.09Å; I344-F346 PolarHBondContact O-N 3.01Å; F346-K387 HydrophobicContact CE1-CB 4.09Å; F346-K387 HydrophobicContact CE1-CG 4.34Å; F346-K387 HydrophobicContact CZ-CB 3.82Å; F346-K387 HydrophobicContact CZ-CD 4.28Å; F346-K387 HydrophobicContact CZ-CG 3.81Å; F346-L389 HydrophobicContact CE1-CD1 4.17Å; F346-L389 HydrophobicContact CE1-CD2 4.16Å
347	V	97.3	Very high	93	Very high	22 Å²	22	59.4 Å²	59.4	13%	0.133	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	138.2	-176	62.4	0	0	0	0	109.4	G328 I329 V352 L374	G328-V347 CarbonylContact C-O 3.59Å; G328-V347 WeakPolarHBondContact CA-O 3.33Å; I329-V347 HydrophobicContact CB-CG1 4.04Å; I329-V347 HydrophobicContact CD1-CG1 4.22Å; I329-V347 HydrophobicContact CG1-CG1 4.06Å; I329-V347 PolarHBondContact N-O 3.26Å; I329-V347 PolarHBondContact O-N 2.84Å; V347-V352 HydrophobicContact CG2-CG1 4.03Å; V347-V352 HydrophobicContact CG2-CG2 3.95Å; V347-L374 HydrophobicContact CG1-CD1 3.67Å
348	Q	97.6	Very high	93.6	Very high	113 Å²	113	59.7 Å²	59.7	53%	0.528	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	148.9	171.5	-65.4	174	-88.5	0	0	110.2	S327 V352	S327-Q348 VanDerWaalsContact O-CA 3.29Å; S327-Q348 WeakPolarHBondContact O-CA 3.41Å; Q348-V352 WeakPolarHBondContact O-CG2 3.37Å
349	F	96.8	Very high	94.2	Very high	3 Å²	3	57.7 Å²	57.7	1%	0.013	30%	0.297	C	S	.	.	S	Bend	trans	-82.8	-18	-171.1	-64.3	-46	0	0	0	115.4	L324 R325 S327 I329 N351 V352 I404 A407 K408	L324-F349 HydrophobicContact CD1-CE2 3.75Å; L324-F349 HydrophobicContact CD1-CZ 3.59Å; R325-F349 WeakPolarHBondContact O-CE2 3.38Å; S327-F349 PolarHBondContact O-N 3.04Å; I329-F349 HydrophobicContact CD1-CE1 4.27Å; I329-F349 HydrophobicContact CD1-CZ 4.46Å; I329-F349 HydrophobicContact CG1-CE1 3.69Å; I329-F349 HydrophobicContact CG1-CZ 3.57Å; F349-N351 PolarHBondContact O-N 3.33Å; F349-V352 HydrophobicContact CD1-CG2 4.45Å; F349-V352 PolarHBondContact O-N 2.89Å; F349-V352 VanDerWaalsContact O-O 3.11Å; F349-I404 HydrophobicContact CD1-CG2 3.89Å; F349-I404 HydrophobicContact CE1-CB 4.2Å; F349-I404 HydrophobicContact CE1-CG1 3.85Å; F349-I404 HydrophobicContact CE1-CG2 3.6Å; F349-I404 HydrophobicContact CZ-CB 4.27Å; F349-I404 HydrophobicContact CZ-CG1 3.81Å; F349-I404 HydrophobicContact CZ-CG2 4.12Å; F349-A407 HydrophobicContact CD2-CB 3.61Å; F349-A407 HydrophobicContact CE2-CB 3.41Å; F349-A407 VanDerWaalsContact CE2-CB 3.41Å; F349-A407 HydrophobicContact CZ-CB 4.47Å; F349-K408 HydrophobicContact CB-CB 4.02Å; F349-K408 HydrophobicContact CB-CG 4.19Å; F349-K408 PolarHBondContact O-NZ 3.07Å
350	D	94	Very high	94.8	Very high	105 Å²	105	55.5 Å²	55.5	56%	0.561	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-56.6	-174.8	-37.6	-40.4	0	0	0	111.1	K408	D350-K408 PolarHBondContact O-NZ 2.84Å
351	N	92.6	Very high	95.6	Very high	110 Å²	110	55.1 Å²	55.1	59%	0.588	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	13.2	-170.8	-57.6	-46.4	0	0	0	114.1	F349 H376	F349-N351 PolarHBondContact O-N 3.33Å; N351-H376 WeakPolarHBondContact O-CA 3.5Å; N351-H376 PolarHBondContact O-CD2 2.96Å
352	V	97.6	Very high	96.2	Very high	22 Å²	22	48.3 Å²	48.3	13%	0.133	25%	0.248	C	C	.	.			trans	-130	146.7	177.2	-57	0	0	0	0	112.4	V347 Q348 F349 L374 K375 K408	V347-V352 HydrophobicContact CG2-CG1 4.03Å; V347-V352 HydrophobicContact CG2-CG2 3.95Å; Q348-V352 WeakPolarHBondContact O-CG2 3.37Å; F349-V352 HydrophobicContact CD1-CG2 4.45Å; F349-V352 PolarHBondContact O-N 2.89Å; F349-V352 VanDerWaalsContact O-O 3.11Å; V352-L374 HydrophobicContact CG2-CD2 4.33Å; V352-K375 WeakPolarHBondContact CA-O 3.37Å; V352-K408 WeakPolarHBondContact O-CE 3.25Å; V352-K408 PolarHBondContact O-NZ 3.45Å
353	N	98.2	Very high	96.4	Very high	10 Å²	10	49.8 Å²	49.8	5%	0.053	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	151.7	167.7	-73.4	1.2	0	0	0	109.7	R226 Y355 K375 K408	R226-N353 VanDerWaalsContact CZ-ND2 3.34Å; R226-N353 PolarHBondContact NH2-ND2 3Å; N353-Y355 HydrophobicContact CB-CE2 3.74Å; N353-Y355 WeakPolarHBondContact O-CD2 3.43Å; N353-K375 PolarHBondContact N-O 3.23Å; N353-K375 PolarHBondContact O-N 2.58Å; N353-K408 WeakPolarHBondContact OD1-CE 3.49Å; N353-K408 PolarHBondContact OD1-NZ 2.9Å
354	V	98.7	Very high	96.6	Very high	11 Å²	11	49.1 Å²	49.1	7%	0.067	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	135.1	177.3	64.6	0	0	0	0	110.7	R226 F372 L374 V401 I404 R405	R226-V354 WeakPolarHBondContact CB-O 3.22Å; V354-F372 HydrophobicContact CG2-CB 4.41Å; V354-F372 HydrophobicContact CG2-CD2 4.13Å; V354-L374 HydrophobicContact CB-CD2 3.75Å; V354-L374 HydrophobicContact CG2-CD2 3.93Å; V354-V401 HydrophobicContact CG1-CG1 4.12Å; V354-V401 HydrophobicContact CG2-CB 4.47Å; V354-V401 HydrophobicContact CG2-CG1 4.13Å; V354-V401 HydrophobicContact CG2-CG2 4.05Å; V354-I404 HydrophobicContact CB-CG2 3.93Å; V354-I404 HydrophobicContact CG1-CG2 3.99Å; V354-I404 HydrophobicContact CG2-CD1 4.27Å; V354-I404 HydrophobicContact CG2-CG2 4.4Å; V354-R405 HydrophobicContact CG1-CG 3.99Å
355	Y	98.8	Very high	96.8	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.008	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	151.3	-178.3	-63.6	-99.9	0	0	0	110.4	E217 L224 E225 R226 N353 F372 V373 K375	E217-Y355 HydrophobicContact CG-CE1 4.22Å; E217-Y355 WeakPolarHBondContact OE1-CE1 3.28Å; E217-Y355 VanDerWaalsContact OE1-CZ 3.28Å; E217-Y355 PolarHBondContact OE1-OH 2.93Å; L224-Y355 HydrophobicContact CB-CD1 3.94Å; L224-Y355 HydrophobicContact CB-CG 4.16Å; L224-Y355 HydrophobicContact CD1-CG 4.28Å; E225-Y355 CarbonylContact O-C 3.54Å; E225-Y355 WeakPolarHBondContact O-CA 3.3Å; R226-Y355 HydrophobicContact CB-CD1 3.74Å; R226-Y355 HydrophobicContact CB-CE1 4.12Å; R226-Y355 HydrophobicContact CB-CG 4.24Å; R226-Y355 HydrophobicContact CG-CD1 3.77Å; R226-Y355 HydrophobicContact CG-CE1 3.6Å; N353-Y355 HydrophobicContact CB-CE2 3.74Å; N353-Y355 WeakPolarHBondContact O-CD2 3.43Å; Y355-F372 CarbonylContact O-C 3.58Å; Y355-F372 VanDerWaalsContact O-CA 3.26Å; Y355-F372 WeakPolarHBondContact O-CA 3.16Å; Y355-V373 PolarHBondContact N-O 3.33Å; Y355-V373 PolarHBondContact O-N 3.14Å; Y355-K375 HydrophobicContact CD2-CD 4.5Å; Y355-K375 HydrophobicContact CD2-CG 3.93Å; Y355-K375 HydrophobicContact CE2-CD 4.07Å; Y355-K375 HydrophobicContact CE2-CG 3.51Å; Y355-K375 VanDerWaalsContact CZ-CE 3.49Å; Y355-K375 PolarHBondContact OH-NZ 2.83Å
356	Y	98.6	Very high	96.9	Very high	29 Å²	29	49.3 Å²	49.3	11%	0.114	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	134.9	161.9	-60.9	-82.2	0	0	0	109	L224 E225 D256 M397 V401	L224-Y356 CarbonylContact C-O 3.57Å; L224-Y356 WeakPolarHBondContact CA-O 3.19Å; E225-Y356 PolarHBondContact N-O 3.14Å; E225-Y356 PolarHBondContact O-N 3.2Å; D256-Y356 PolarHBondContact OD2-OH 3.2Å; Y356-M397 HydrophobicContact CD1-CE 3.82Å; Y356-M397 HydrophobicContact CD1-CG 4.49Å; Y356-M397 HydrophobicContact CD1-SD 3.94Å; Y356-M397 HydrophobicContact CE1-CE 4.01Å; Y356-M397 HydrophobicContact CE1-CG 4.45Å; Y356-M397 HydrophobicContact CE1-SD 4.38Å; Y356-V401 HydrophobicContact CD1-CG2 4.37Å; Y356-V401 HydrophobicContact CE1-CB 4.27Å; Y356-V401 HydrophobicContact CE1-CG1 4.23Å; Y356-V401 HydrophobicContact CE1-CG2 3.89Å; Y356-V401 HydrophobicContact CE2-CG1 4.22Å
357	G	97.9	Very high	96.9	Very high	9 Å²	9	49.6 Å²	49.6	9%	0.093	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	135.5	176	0	0	0	0	0	112	V360 C371	G357-V360 VanDerWaalsContact C-CG2 3.43Å; G357-C371 PolarHBondContact N-O 3.16Å
358	K	96.3	Very high	97	Very high	86 Å²	86	49.6 Å²	49.6	37%	0.374	25%	0.247	S	C	.	.	S	Bend	trans	-98.9	143.6	176.1	-58.5	-175.7	-178.2	-177	0	110.9	Q223 E225 V360	Q223-K358 HydrophobicContact CB-CB 4.35Å; Q223-K358 PolarHBondContact O-N 3.33Å; E225-K358 WeakPolarHBondContact OE1-CE 3.29Å; E225-K358 IonicContact OE1-NZ 2.68Å; E225-K358 PolarHBondContact OE1-NZ 2.92Å; E225-K358 WeakPolarHBondContact OE2-CE 3.08Å; E225-K358 IonicContact OE2-NZ 3.31Å; E225-K358 PolarHBondContact OE2-NZ 2.74Å; K358-V360 PolarHBondContact O-N 3.04Å
359	D	95.6	Very high	97	Very high	75 Å²	75	47.2 Å²	47.2	40%	0.401	24%	0.238	S	C	.	.	S	Bend	trans	53.9	25.7	174.7	-165.2	53.9	0	0	0	115	K361 N362 R363	D359-K361 PolarHBondContact O-N 2.83Å; D359-N362 PolarHBondContact O-N 2.94Å; D359-N362 VanDerWaalsContact O-N 3.14Å; D359-N362 WeakPolarHBondContact OD1-CB 3.36Å; D359-N362 PolarHBondContact OD1-ND2 2.92Å; D359-N362 WeakPolarHBondContact OD2-CB 3.44Å; D359-R363 VanDerWaalsContact O-CB 3.22Å; D359-R363 WeakPolarHBondContact O-CB 3.31Å; D359-R363 PolarHBondContact O-N 2.85Å
360	V	96.9	Very high	97.1	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.012	25%	0.254	C	S	.	.	H	α-helix	trans	-64.3	-29	-171.5	-166.4	0	0	0	0	111.2	W317 G357 K358 Y364 A366 D369 C371 Y388	W317-V360 HydrophobicContact CH2-CG1 3.93Å; W317-V360 HydrophobicContact CZ2-CG1 4.05Å; G357-V360 VanDerWaalsContact C-CG2 3.43Å; K358-V360 PolarHBondContact O-N 3.04Å; V360-Y364 HydrophobicContact CG1-CD2 3.77Å; V360-Y364 PolarHBondContact O-N 2.91Å; V360-A366 HydrophobicContact CB-CB 4.42Å; V360-A366 HydrophobicContact CG1-CB 4.11Å; V360-D369 PolarHBondContact N-OD1 3.14Å; V360-D369 VanDerWaalsContact N-OD1 3.14Å; V360-C371 HydrophobicContact CB-CB 3.86Å; V360-C371 HydrophobicContact CG1-CB 3.96Å; V360-C371 HydrophobicContact CG2-CB 3.62Å; V360-Y388 HydrophobicContact CG1-CD1 4.25Å
361	K	96.7	Very high	97.3	Very high	93 Å²	93	45.9 Å²	45.9	40%	0.404	23%	0.227	S	C	.	.	H	α-helix	trans	-63.3	-49.1	173.3	-177.6	159.3	-174.1	154	0	112.5	D359 K365 A366 P367 D369	D359-K361 PolarHBondContact O-N 2.83Å; K361-K365 WeakPolarHBondContact O-CA 3.39Å; K361-K365 PolarHBondContact O-N 2.67Å; K361-A366 WeakPolarHBondContact CG-O 3.49Å; K361-P367 PolarHBondContact NZ-O 2.99Å; K361-D369 WeakPolarHBondContact CB-OD1 3.18Å; K361-D369 WeakPolarHBondContact CB-OD2 3.31Å; K361-D369 WeakPolarHBondContact CD-OD2 3.21Å; K361-D369 PolarHBondContact N-OD1 3.5Å
362	N	96.7	Very high	97.6	Very high	95 Å²	95	40.6 Å²	40.6	51%	0.508	20%	0.199	S	C	.	.	H	α-helix	trans	-74.1	-43.4	179.7	-67.2	-48.8	0	0	0	111.2	D359 K365	D359-N362 PolarHBondContact O-N 2.94Å; D359-N362 VanDerWaalsContact O-N 3.14Å; D359-N362 WeakPolarHBondContact OD1-CB 3.36Å; D359-N362 PolarHBondContact OD1-ND2 2.92Å; D359-N362 WeakPolarHBondContact OD2-CB 3.44Å; N362-K365 PolarHBondContact O-NZ 3.1Å
363	R	94.8	Very high	97.6	Very high	60 Å²	60	39.6 Å²	39.6	23%	0.226	19%	0.193	C	C	.	.	H	α-helix	trans	-63.5	-52	-178.2	-172.3	-179.8	-78.6	-124.2	-5.5	113.5	E221 L222 K315 D359	E221-R363 PolarHBondContact O-NH1 3.32Å; L222-R363 PolarHBondContact O-NH1 2.89Å; K315-R363 WeakPolarHBondContact CE-O 3.45Å; K315-R363 PolarHBondContact NZ-O 2.9Å; D359-R363 VanDerWaalsContact O-CB 3.22Å; D359-R363 WeakPolarHBondContact O-CB 3.31Å; D359-R363 PolarHBondContact O-N 2.85Å
364	Y	96.7	Very high	97.7	Very high	12 Å²	12	39.2 Å²	39.2	5%	0.047	19%	0.191	C	C	.	.	H	α-helix	trans	-121	9.9	-173.4	-52.9	-79.6	0	0	0	114.9	K310 K315 W317 V360 A366 E382 Y388	K310-Y364 HydrophobicContact CD-CD1 4.25Å; K310-Y364 HydrophobicContact CD-CG 4.2Å; K315-Y364 WeakPolarHBondContact CB-O 3.32Å; W317-Y364 PolarHBondContact NE1-O 2.92Å; V360-Y364 HydrophobicContact CG1-CD2 3.77Å; V360-Y364 PolarHBondContact O-N 2.91Å; Y364-A366 VanDerWaalsContact C-N 3.33Å; Y364-A366 PolarHBondContact O-N 3.38Å; Y364-E382 WeakPolarHBondContact CE1-OE2 3.28Å; Y364-E382 PolarHBondContact OH-OE2 2.93Å; Y364-Y388 HydrophobicContact CD2-CD1 4.49Å; Y364-Y388 HydrophobicContact CD2-CE1 4.27Å; Y364-Y388 HydrophobicContact CE2-CD1 4.2Å; Y364-Y388 AromaticContact CE2-CE1 3.55Å; Y364-Y388 HydrophobicContact CE2-CE1 3.55Å; Y364-Y388 AromaticContact CE2-CZ 3.86Å; Y364-Y388 AromaticContact CZ-CZ 3.83Å; Y364-Y388 PolarHBondContact OH-OH 3.48Å
365	K	98.1	Very high	97.6	Very high	129 Å²	129	38.8 Å²	38.8	56%	0.561	19%	0.188	S	C	*	.			trans	60	39.3	-179.2	-52	-47.3	-178.2	-157.8	0	113.6	W317 K361 N362	W317-K365 VanDerWaalsContact CD1-O 3.3Å; W317-K365 PolarHBondContact NE1-O 2.97Å; K361-K365 WeakPolarHBondContact O-CA 3.39Å; K361-K365 PolarHBondContact O-N 2.67Å; N362-K365 PolarHBondContact O-NZ 3.1Å
366	A	98.1	Very high	97.6	Very high	5 Å²	5	41.9 Å²	41.9	4%	0.041	20%	0.203	C	C	.	.			trans	-61.2	149.4	169.6	0	0	0	0	0	111.7	W317 V360 K361 Y364 T368 C390	W317-A366 HydrophobicContact CD2-CB 4.43Å; W317-A366 HydrophobicContact CH2-CB 3.8Å; W317-A366 HydrophobicContact CZ2-CB 3.45Å; W317-A366 VanDerWaalsContact CZ2-CB 3.45Å; W317-A366 HydrophobicContact CZ3-CB 4.44Å; V360-A366 HydrophobicContact CB-CB 4.42Å; V360-A366 HydrophobicContact CG1-CB 4.11Å; K361-A366 WeakPolarHBondContact CG-O 3.49Å; Y364-A366 VanDerWaalsContact C-N 3.33Å; Y364-A366 PolarHBondContact O-N 3.38Å; A366-T368 VanDerWaalsContact C-N 3.32Å; A366-T368 VanDerWaalsContact CB-O 3.25Å; A366-T368 WeakPolarHBondContact CB-O 3.24Å; A366-T368 PolarHBondContact O-N 3.34Å; A366-C390 HydrophobicContact CB-CB 4.48Å
367	P	98.2	Very high	97.4	Very high	49 Å²	49	42.1 Å²	42.1	32%	0.318	21%	0.208	S	C	.	.	S	Bend	trans	-56.1	-43.3	172.2	-26.9	34.4	0	0	0	113.4	H308 K361	H308-P367 HydrophobicContact CB-CG 4.21Å; K361-P367 PolarHBondContact NZ-O 2.99Å
368	T	98.3	Very high	97.2	Very high	22 Å²	22	48.5 Å²	48.5	14%	0.135	24%	0.235	C	C	.	.			trans	-133.7	170.1	179.4	83.6	0	0	0	0	110.2	A366 F370 C371 C390 C391	A366-T368 VanDerWaalsContact C-N 3.32Å; A366-T368 VanDerWaalsContact CB-O 3.25Å; A366-T368 WeakPolarHBondContact CB-O 3.24Å; A366-T368 PolarHBondContact O-N 3.34Å; T368-F370 VanDerWaalsContact C-N 3.31Å; T368-F370 HydrophobicContact CG2-CD2 4.2Å; T368-F370 WeakPolarHBondContact OG1-CB 3.49Å; T368-F370 WeakPolarHBondContact OG1-CD2 3.45Å; T368-F370 PolarHBondContact OG1-N 2.87Å; T368-C371 PolarHBondContact O-SG 3.47Å; T368-C371 VanDerWaalsContact O-SG 3.38Å; T368-C390 PolarHBondContact N-SG 3.07Å; T368-C390 VanDerWaalsContact N-SG 3.42Å; T368-C390 PolarHBondContact OG1-SG 2.87Å; T368-C391 WeakPolarHBondContact CG2-O 3.48Å; T368-C391 PolarHBondContact OG1-O 2.86Å
369	D	97.6	Very high	97.2	Very high	63 Å²	63	45.9 Å²	45.9	34%	0.337	23%	0.225	S	C	.	.	S	Bend	trans	-90.1	6.1	168.8	-67.6	-75.2	0	0	0	112.7	V360 K361 C371	V360-D369 PolarHBondContact N-OD1 3.14Å; V360-D369 VanDerWaalsContact N-OD1 3.14Å; K361-D369 WeakPolarHBondContact CB-OD1 3.18Å; K361-D369 WeakPolarHBondContact CB-OD2 3.31Å; K361-D369 WeakPolarHBondContact CD-OD2 3.21Å; K361-D369 PolarHBondContact N-OD1 3.5Å; D369-C371 PolarHBondContact O-N 2.75Å
370	F	98.5	Very high	97.2	Very high	79 Å²	79	43 Å²	43	35%	0.346	21%	0.209	S	C	.	.			trans	-80.7	63.8	174.5	-49.6	-54.4	0	0	0	109.9	T368 C391 D393 A394 M397	T368-F370 VanDerWaalsContact C-N 3.31Å; T368-F370 HydrophobicContact CG2-CD2 4.2Å; T368-F370 WeakPolarHBondContact OG1-CB 3.49Å; T368-F370 WeakPolarHBondContact OG1-CD2 3.45Å; T368-F370 PolarHBondContact OG1-N 2.87Å; F370-C391 HydrophobicContact CB-CB 4.25Å; F370-C391 WeakPolarHBondContact O-CB 3.47Å; F370-C391 PolarHBondContact O-N 3.42Å; F370-D393 VanDerWaalsContact CD2-C 3.5Å; F370-A394 HydrophobicContact CD1-CB 3.71Å; F370-A394 HydrophobicContact CE1-CB 3.67Å; F370-A394 HydrophobicContact CG-CB 4.38Å; F370-A394 HydrophobicContact CZ-CB 4.29Å; F370-M397 HydrophobicContact CB-CB 4.22Å; F370-M397 HydrophobicContact CB-SD 4.18Å
371	C	98.6	Very high	97.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	129	-173.6	-70.5	0	0	0	0	111.9	G357 V360 T368 D369 L389 C390 M397	G357-C371 PolarHBondContact N-O 3.16Å; V360-C371 HydrophobicContact CB-CB 3.86Å; V360-C371 HydrophobicContact CG1-CB 3.96Å; V360-C371 HydrophobicContact CG2-CB 3.62Å; T368-C371 PolarHBondContact O-SG 3.47Å; T368-C371 VanDerWaalsContact O-SG 3.38Å; D369-C371 PolarHBondContact O-N 2.75Å; C371-L389 CarbonylContact C-O 3.54Å; C371-L389 VanDerWaalsContact CA-O 3.27Å; C371-L389 WeakPolarHBondContact CA-O 3.3Å; C371-C390 WeakPolarHBondContact SG-CB 3.45Å; C371-M397 PolarHBondContact N-SD 3.36Å; C371-M397 VanDerWaalsContact N-SD 3.44Å
372	F	98.8	Very high	97	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	152.9	165.1	72.2	-89	0	0	0	110.8	L307 I329 V354 Y355 L374 L389 M397 W400 V401 I404	L307-F372 HydrophobicContact CD1-CE1 3.8Å; L307-F372 HydrophobicContact CD1-CZ 3.7Å; I329-F372 HydrophobicContact CD1-CE2 4.32Å; V354-F372 HydrophobicContact CG2-CB 4.41Å; V354-F372 HydrophobicContact CG2-CD2 4.13Å; Y355-F372 CarbonylContact O-C 3.58Å; Y355-F372 VanDerWaalsContact O-CA 3.26Å; Y355-F372 WeakPolarHBondContact O-CA 3.16Å; F372-L374 HydrophobicContact CE2-CD1 4.43Å; F372-L389 HydrophobicContact CD1-CB 4.24Å; F372-L389 HydrophobicContact CD2-CB 4.42Å; F372-L389 HydrophobicContact CD2-CD1 4.26Å; F372-L389 HydrophobicContact CE1-CB 3.83Å; F372-L389 HydrophobicContact CE2-CB 4.02Å; F372-L389 HydrophobicContact CE2-CD1 3.8Å; F372-L389 HydrophobicContact CE2-CD2 4.24Å; F372-L389 HydrophobicContact CE2-CG 4.24Å; F372-L389 HydrophobicContact CZ-CB 3.72Å; F372-L389 HydrophobicContact CZ-CD1 4.26Å; F372-L389 HydrophobicContact CZ-CD2 3.93Å; F372-L389 HydrophobicContact CZ-CG 4.18Å; F372-L389 PolarHBondContact N-O 3.02Å; F372-L389 PolarHBondContact O-N 3.16Å; F372-L389 VanDerWaalsContact O-O 3.11Å; F372-M397 HydrophobicContact CB-CG 4.49Å; F372-W400 HydrophobicContact CD1-CB 4.21Å; F372-W400 HydrophobicContact CE1-CB 3.57Å; F372-W400 AromaticContact CE1-CG 3.96Å; F372-W400 HydrophobicContact CE1-CG 3.96Å; F372-W400 HydrophobicContact CZ-CB 3.83Å; F372-W400 HydrophobicContact CZ-CD2 4.35Å; F372-W400 HydrophobicContact CZ-CE3 4.39Å; F372-W400 HydrophobicContact CZ-CG 4.13Å; F372-V401 HydrophobicContact CB-CG2 3.56Å; F372-V401 HydrophobicContact CG-CG2 4.05Å; F372-I404 HydrophobicContact CD2-CD1 3.96Å; F372-I404 HydrophobicContact CE2-CD1 3.46Å; F372-I404 VanDerWaalsContact CE2-CD1 3.46Å; F372-I404 HydrophobicContact CZ-CD1 4.12Å
373	V	98.8	Very high	97	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	135.2	-167.8	-174.3	0	0	0	0	109.6	L224 Y355 I386 K387 Y388	L224-V373 HydrophobicContact CD1-CB 4.35Å; L224-V373 HydrophobicContact CD1-CG1 3.93Å; L224-V373 HydrophobicContact CD2-CB 3.85Å; L224-V373 HydrophobicContact CD2-CG1 4.01Å; L224-V373 HydrophobicContact CD2-CG2 3.61Å; Y355-V373 PolarHBondContact N-O 3.33Å; Y355-V373 PolarHBondContact O-N 3.14Å; V373-I386 HydrophobicContact CG1-CG2 3.27Å; V373-K387 WeakPolarHBondContact CA-O 3.35Å; V373-Y388 HydrophobicContact CB-CD1 4.37Å; V373-Y388 HydrophobicContact CG1-CD1 4.01Å; V373-Y388 HydrophobicContact CG1-CD2 4.47Å; V373-Y388 HydrophobicContact CG1-CE1 4.03Å; V373-Y388 HydrophobicContact CG1-CE2 4.5Å; V373-Y388 HydrophobicContact CG1-CG 4.22Å; V373-Y388 HydrophobicContact CG2-CD1 3.41Å; V373-Y388 VanDerWaalsContact CG2-CD1 3.41Å; V373-Y388 HydrophobicContact CG2-CE1 3.84Å; V373-Y388 HydrophobicContact CG2-CG 4.1Å
374	L	98.7	Very high	97	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.016	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	123.9	178.9	-62.5	170.7	0	0	0	109.2	I329 V347 V352 V354 F372 K387 L389 I404	I329-L374 HydrophobicContact CD1-CD1 3.75Å; V347-L374 HydrophobicContact CG1-CD1 3.67Å; V352-L374 HydrophobicContact CG2-CD2 4.33Å; V354-L374 HydrophobicContact CB-CD2 3.75Å; V354-L374 HydrophobicContact CG2-CD2 3.93Å; F372-L374 HydrophobicContact CE2-CD1 4.43Å; L374-K387 PolarHBondContact N-O 2.94Å; L374-K387 PolarHBondContact O-N 3.09Å; L374-L389 HydrophobicContact CD1-CD1 4.18Å; L374-I404 HydrophobicContact CD2-CD1 4.49Å; L374-I404 HydrophobicContact CD2-CG2 4.42Å
375	K	97.9	Very high	96.9	Very high	1 Å²	1	54.4 Å²	54.4	0%	0.004	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	158.7	175.8	69.6	172.6	-165.7	74.5	0	111.8	L222 L224 V352 N353 Y355 P377 I379 I386	L222-K375 HydrophobicContact CD1-CD 4.01Å; L224-K375 HydrophobicContact CD1-CD 3.94Å; V352-K375 WeakPolarHBondContact CA-O 3.37Å; N353-K375 PolarHBondContact N-O 3.23Å; N353-K375 PolarHBondContact O-N 2.58Å; Y355-K375 HydrophobicContact CD2-CD 4.5Å; Y355-K375 HydrophobicContact CD2-CG 3.93Å; Y355-K375 HydrophobicContact CE2-CD 4.07Å; Y355-K375 HydrophobicContact CE2-CG 3.51Å; Y355-K375 VanDerWaalsContact CZ-CE 3.49Å; Y355-K375 PolarHBondContact OH-NZ 2.83Å; K375-P377 PolarHBondContact NZ-O 3.36Å; K375-P377 VanDerWaalsContact NZ-O 3.08Å; K375-I379 HydrophobicContact CD-CB 4.47Å; K375-I379 WeakPolarHBondContact CD-O 3.37Å; K375-I379 WeakPolarHBondContact CE-O 3.44Å; K375-I379 PolarHBondContact NZ-O 3.27Å; K375-I386 HydrophobicContact CB-CG1 4.1Å; K375-I386 HydrophobicContact CB-CG2 4.28Å
376	H	97.3	Very high	96.9	Very high	68 Å²	68	48.5 Å²	48.5	32%	0.315	23%	0.234	S	C	.	.			trans	-64.4	144.2	164.2	-162.8	-98.5	0	0	0	110.2	N351 Q378 I379	N351-H376 WeakPolarHBondContact O-CA 3.5Å; N351-H376 PolarHBondContact O-CD2 2.96Å; H376-Q378 VanDerWaalsContact C-N 3.31Å; H376-Q378 PolarHBondContact CE1-OE1 2.81Å; H376-Q378 PolarHBondContact ND1-N 2.94Å; H376-Q378 PolarHBondContact ND1-OE1 3.47Å; H376-Q378 PolarHBondContact O-N 2.97Å; H376-I379 HydrophobicContact CB-CD1 3.81Å; H376-I379 HydrophobicContact CB-CG1 4.05Å; H376-I379 PolarHBondContact O-N 2.89Å; H376-I379 VanDerWaalsContact O-N 3.13Å
377	P	94.6	Very high	96.9	Very high	34 Å²	34	50.1 Å²	50.1	22%	0.221	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-45.5	177.4	-29.4	36.8	0	0	0	113.2	K375 I379 Q380	K375-P377 PolarHBondContact NZ-O 3.36Å; K375-P377 VanDerWaalsContact NZ-O 3.08Å; P377-I379 PolarHBondContact O-N 2.9Å; P377-I379 VanDerWaalsContact O-N 3.12Å; P377-Q380 PolarHBondContact O-NE2 3.4Å; P377-Q380 VanDerWaalsContact O-NE2 3.12Å
378	Q	95	Very high	96.9	Very high	142 Å²	142	48 Å²	48	66%	0.664	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-14.1	179.4	-61.8	170.7	-25.2	0	0	115.7	A240 H376 Q380	A240-Q378 HydrophobicContact CB-CG 4.35Å; H376-Q378 VanDerWaalsContact C-N 3.31Å; H376-Q378 PolarHBondContact CE1-OE1 2.81Å; H376-Q378 PolarHBondContact ND1-N 2.94Å; H376-Q378 PolarHBondContact ND1-OE1 3.47Å; H376-Q378 PolarHBondContact O-N 2.97Å; Q378-Q380 PolarHBondContact O-N 3.05Å
379	I	95.9	Very high	96.9	Very high	32 Å²	32	47 Å²	47	16%	0.164	22%	0.22	C	C	.	.			trans	-81.7	106.9	176.1	-62.2	167.2	0	0	0	108.4	K375 H376 P377 K381 I386	K375-I379 HydrophobicContact CD-CB 4.47Å; K375-I379 WeakPolarHBondContact CD-O 3.37Å; K375-I379 WeakPolarHBondContact CE-O 3.44Å; K375-I379 PolarHBondContact NZ-O 3.27Å; H376-I379 HydrophobicContact CB-CD1 3.81Å; H376-I379 HydrophobicContact CB-CG1 4.05Å; H376-I379 PolarHBondContact O-N 2.89Å; H376-I379 VanDerWaalsContact O-N 3.13Å; P377-I379 PolarHBondContact O-N 2.9Å; P377-I379 VanDerWaalsContact O-N 3.12Å; I379-K381 WeakPolarHBondContact CG2-O 3.34Å; I379-I386 HydrophobicContact CG2-CD1 3.76Å; I379-I386 HydrophobicContact CG2-CG1 3.73Å
380	Q	95.7	Very high	97	Very high	14 Å²	14	44 Å²	44	7%	0.065	20%	0.204	C	C	.	.			trans	-104.5	-15.1	177.6	-61.6	-61.7	-21.7	0	0	114.2	N219 A240 N247 P377 Q378	N219-Q380 PolarHBondContact ND2-O 3.08Å; N219-Q380 PolarHBondContact ND2-OE1 3.06Å; A240-Q380 WeakPolarHBondContact O-CG 3.27Å; A240-Q380 PolarHBondContact O-NE2 2.86Å; N247-Q380 PolarHBondContact ND2-OE1 2.84Å; P377-Q380 PolarHBondContact O-NE2 3.4Å; P377-Q380 VanDerWaalsContact O-NE2 3.12Å; Q378-Q380 PolarHBondContact O-N 3.05Å
381	K	94.9	Very high	97	Very high	88 Å²	88	40.2 Å²	40.2	38%	0.383	19%	0.187	S	C	.	.	S	Bend	trans	-123.5	162.4	-174.2	-55.7	-157.7	179.3	-108.4	0	111.3	E221 D244 I379 S383	E221-K381 VanDerWaalsContact OE1-CA 3.28Å; E221-K381 WeakPolarHBondContact OE1-CA 3.44Å; E221-K381 WeakPolarHBondContact OE1-CB 3.44Å; E221-K381 VanDerWaalsContact OE1-CG 3.27Å; E221-K381 WeakPolarHBondContact OE1-CG 3.12Å; E221-K381 VanDerWaalsContact OE2-CD 3.3Å; E221-K381 WeakPolarHBondContact OE2-CD 3.29Å; E221-K381 WeakPolarHBondContact OE2-CE 3.34Å; E221-K381 WeakPolarHBondContact OE2-CG 3.07Å; E221-K381 IonicContact OE2-NZ 3.98Å; E221-K381 PolarHBondContact OE2-NZ 3.42Å; D244-K381 IonicContact OD2-NZ 2.74Å; I379-K381 WeakPolarHBondContact CG2-O 3.34Å; K381-S383 PolarHBondContact O-N 3.16Å
382	E	94.5	Very high	97	Very high	104 Å²	104	44.7 Å²	44.7	49%	0.486	21%	0.211	S	C	.	.			trans	-53.7	130.1	-175.5	177.6	79.3	-143.1	0	0	111.6	L222 Y364	L222-E382 HydrophobicContact CD2-CB 4.38Å; Y364-E382 WeakPolarHBondContact CE1-OE2 3.28Å; Y364-E382 PolarHBondContact OH-OE2 2.93Å
383	S	95.5	Very high	96.9	Very high	34 Å²	34	47.4 Å²	47.4	24%	0.238	23%	0.226	C	C	.	.			trans	-156.9	143.6	-173.3	176.8	0	0	0	0	112.6	K381 Y385 I386	K381-S383 PolarHBondContact O-N 3.16Å; S383-Y385 PolarHBondContact O-N 3.4Å; S383-Y385 VanDerWaalsContact O-N 3.11Å; S383-Y385 WeakPolarHBondContact OG-CD2 3.42Å; S383-Y385 PolarHBondContact OG-N 2.8Å; S383-I386 WeakPolarHBondContact O-CB 3.48Å; S383-I386 WeakPolarHBondContact O-CG1 3.41Å; S383-I386 PolarHBondContact O-N 2.98Å
384	Q	94.6	Very high	96.8	Very high	116 Å²	116	49.7 Å²	49.7	54%	0.542	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-16.7	175.7	66.8	179.8	-2.3	0	0	114.2	I386 K387	Q384-I386 VanDerWaalsContact C-N 3.31Å; Q384-K387 PolarHBondContact O-NZ 2.96Å
385	Y	95.8	Very high	96.7	Very high	160 Å²	160	52.7 Å²	52.7	63%	0.627	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-10.7	175.6	-57.7	-63.4	0	0	0	113	S383	S383-Y385 PolarHBondContact O-N 3.4Å; S383-Y385 VanDerWaalsContact O-N 3.11Å; S383-Y385 WeakPolarHBondContact OG-CD2 3.42Å; S383-Y385 PolarHBondContact OG-N 2.8Å
386	I	97.7	Very high	96.7	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	27%	0.267	C	S	.	.			trans	-80.4	121.7	172.5	-53.1	172.4	0	0	0	109	L222 V373 K375 I379 S383 Q384 Y388	L222-I386 HydrophobicContact CD1-CD1 3.77Å; L222-I386 HydrophobicContact CD2-CD1 3.55Å; L222-I386 HydrophobicContact CG-CD1 4.32Å; V373-I386 HydrophobicContact CG1-CG2 3.27Å; K375-I386 HydrophobicContact CB-CG1 4.1Å; K375-I386 HydrophobicContact CB-CG2 4.28Å; I379-I386 HydrophobicContact CG2-CD1 3.76Å; I379-I386 HydrophobicContact CG2-CG1 3.73Å; S383-I386 WeakPolarHBondContact O-CB 3.48Å; S383-I386 WeakPolarHBondContact O-CG1 3.41Å; S383-I386 PolarHBondContact O-N 2.98Å; Q384-I386 VanDerWaalsContact C-N 3.31Å; I386-Y388 HydrophobicContact CB-CD2 4.49Å; I386-Y388 HydrophobicContact CB-CE2 3.82Å; I386-Y388 HydrophobicContact CG2-CD2 3.89Å; I386-Y388 HydrophobicContact CG2-CE1 4.49Å; I386-Y388 HydrophobicContact CG2-CE2 3.3Å
387	K	98.1	Very high	96.7	Very high	40 Å²	40	52.4 Å²	52.4	17%	0.174	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	115.9	179.5	-59.7	-46.6	-173.3	-164.3	0	110.9	D312 F346 V373 L374 Q384 L389	D312-K387 IonicContact OD1-NZ 3.62Å; D312-K387 PolarHBondContact OD1-NZ 3.39Å; D312-K387 IonicContact OD2-NZ 2.71Å; D312-K387 PolarHBondContact OD2-NZ 3.48Å; F346-K387 HydrophobicContact CE1-CB 4.09Å; F346-K387 HydrophobicContact CE1-CG 4.34Å; F346-K387 HydrophobicContact CZ-CB 3.82Å; F346-K387 HydrophobicContact CZ-CD 4.28Å; F346-K387 HydrophobicContact CZ-CG 3.81Å; V373-K387 WeakPolarHBondContact CA-O 3.35Å; L374-K387 PolarHBondContact N-O 2.94Å; L374-K387 PolarHBondContact O-N 3.09Å; Q384-K387 PolarHBondContact O-NZ 2.96Å; K387-L389 HydrophobicContact CB-CD1 4.5Å
388	Y	98.6	Very high	96.9	Very high	4 Å²	4	52 Å²	52	2%	0.016	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	127.3	179.2	-61	-107.1	0	0	0	110.2	L224 K310 V360 Y364 V373 I386	L224-Y388 HydrophobicContact CD2-CE1 4.4Å; K310-Y388 HydrophobicContact CD-CD2 3.75Å; K310-Y388 HydrophobicContact CD-CE2 4.43Å; K310-Y388 HydrophobicContact CD-CG 3.94Å; K310-Y388 PolarHBondContact N-O 3.32Å; K310-Y388 VanDerWaalsContact N-O 3.09Å; V360-Y388 HydrophobicContact CG1-CD1 4.25Å; Y364-Y388 HydrophobicContact CD2-CD1 4.49Å; Y364-Y388 HydrophobicContact CD2-CE1 4.27Å; Y364-Y388 HydrophobicContact CE2-CD1 4.2Å; Y364-Y388 AromaticContact CE2-CE1 3.55Å; Y364-Y388 HydrophobicContact CE2-CE1 3.55Å; Y364-Y388 AromaticContact CE2-CZ 3.86Å; Y364-Y388 AromaticContact CZ-CZ 3.83Å; Y364-Y388 PolarHBondContact OH-OH 3.48Å; V373-Y388 HydrophobicContact CB-CD1 4.37Å; V373-Y388 HydrophobicContact CG1-CD1 4.01Å; V373-Y388 HydrophobicContact CG1-CD2 4.47Å; V373-Y388 HydrophobicContact CG1-CE1 4.03Å; V373-Y388 HydrophobicContact CG1-CE2 4.5Å; V373-Y388 HydrophobicContact CG1-CG 4.22Å; V373-Y388 HydrophobicContact CG2-CD1 3.41Å; V373-Y388 VanDerWaalsContact CG2-CD1 3.41Å; V373-Y388 HydrophobicContact CG2-CE1 3.84Å; V373-Y388 HydrophobicContact CG2-CG 4.1Å; I386-Y388 HydrophobicContact CB-CD2 4.49Å; I386-Y388 HydrophobicContact CB-CE2 3.82Å; I386-Y388 HydrophobicContact CG2-CD2 3.89Å; I386-Y388 HydrophobicContact CG2-CE1 4.49Å; I386-Y388 HydrophobicContact CG2-CE2 3.3Å
389	L	98.8	Very high	97	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.2	178.2	-59.9	93.9	0	0	0	109.6	L307 H308 F322 F346 C371 F372 L374 K387	L307-L389 HydrophobicContact CD1-CB 4.37Å; L307-L389 HydrophobicContact CD1-CD2 3.8Å; H308-L389 WeakPolarHBondContact O-CA 3.48Å; F322-L389 HydrophobicContact CE1-CD2 4.34Å; F322-L389 HydrophobicContact CE2-CD2 4.16Å; F322-L389 HydrophobicContact CZ-CD2 4.04Å; F346-L389 HydrophobicContact CE1-CD1 4.17Å; F346-L389 HydrophobicContact CE1-CD2 4.16Å; C371-L389 CarbonylContact C-O 3.54Å; C371-L389 VanDerWaalsContact CA-O 3.27Å; C371-L389 WeakPolarHBondContact CA-O 3.3Å; F372-L389 HydrophobicContact CD1-CB 4.24Å; F372-L389 HydrophobicContact CD2-CB 4.42Å; F372-L389 HydrophobicContact CD2-CD1 4.26Å; F372-L389 HydrophobicContact CE1-CB 3.83Å; F372-L389 HydrophobicContact CE2-CB 4.02Å; F372-L389 HydrophobicContact CE2-CD1 3.8Å; F372-L389 HydrophobicContact CE2-CD2 4.24Å; F372-L389 HydrophobicContact CE2-CG 4.24Å; F372-L389 HydrophobicContact CZ-CB 3.72Å; F372-L389 HydrophobicContact CZ-CD1 4.26Å; F372-L389 HydrophobicContact CZ-CD2 3.93Å; F372-L389 HydrophobicContact CZ-CG 4.18Å; F372-L389 PolarHBondContact N-O 3.02Å; F372-L389 PolarHBondContact O-N 3.16Å; F372-L389 VanDerWaalsContact O-O 3.11Å; L374-L389 HydrophobicContact CD1-CD1 4.18Å; K387-L389 HydrophobicContact CB-CD1 4.5Å
390	C	98.8	Very high	97.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	126.6	-178.5	171.3	0	0	0	0	110.3	H308 W317 A366 T368 C371	H308-C390 HydrophobicContact CB-CB 3.96Å; H308-C390 PolarHBondContact N-O 3.5Å; H308-C390 PolarHBondContact ND1-O 3.26Å; H308-C390 PolarHBondContact O-N 3.32Å; W317-C390 HydrophobicContact CE3-CB 3.9Å; W317-C390 HydrophobicContact CH2-CB 4.16Å; W317-C390 HydrophobicContact CZ3-CB 3.48Å; W317-C390 VanDerWaalsContact CZ3-CB 3.48Å; A366-C390 HydrophobicContact CB-CB 4.48Å; T368-C390 PolarHBondContact N-SG 3.07Å; T368-C390 VanDerWaalsContact N-SG 3.42Å; T368-C390 PolarHBondContact OG1-SG 2.87Å; C371-C390 WeakPolarHBondContact SG-CB 3.45Å
391	C	98.7	Very high	97.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.214	C	C	.	.			trans	-89.9	164.3	173.4	-59.2	0	0	0	0	110.9	L307 T368 F370 T396 M397	L307-C391 HydrophobicContact CD2-CB 4.34Å; L307-C391 WeakPolarHBondContact CD2-SG 3.39Å; T368-C391 WeakPolarHBondContact CG2-O 3.48Å; T368-C391 PolarHBondContact OG1-O 2.86Å; F370-C391 HydrophobicContact CB-CB 4.25Å; F370-C391 WeakPolarHBondContact O-CB 3.47Å; F370-C391 PolarHBondContact O-N 3.42Å; C391-T396 HydrophobicContact CB-CG2 3.96Å; C391-M397 HydrophobicContact CB-CB 4.16Å; C391-M397 VanDerWaalsContact SG-CA 3.54Å
392	D	97.9	Very high	97.5	Very high	94 Å²	94	39.5 Å²	39.5	50%	0.503	20%	0.196	S	C	.	.	S	Bend	trans	-78.1	-25.8	174.9	-61.3	-29.4	0	0	0	112	H308	H308-D392 IonicContact CE1-OD1 3.48Å; H308-D392 PolarHBondContact CE1-OD1 3.06Å; H308-D392 IonicContact ND1-OD1 2.66Å
393	D	97.6	Very high	97.6	Very high	57 Å²	57	34.7 Å²	34.7	31%	0.305	18%	0.175	S	C	.	.	S	Bend	trans	-149.4	163.2	-176.5	75.7	89.9	0	0	0	113.4	F370 W395 T396 M397	F370-D393 VanDerWaalsContact CD2-C 3.5Å; D393-W395 VanDerWaalsContact C-N 3.34Å; D393-W395 PolarHBondContact O-N 2.94Å; D393-W395 VanDerWaalsContact OD1-CA 3.26Å; D393-W395 WeakPolarHBondContact OD1-CA 3.2Å; D393-W395 WeakPolarHBondContact OD1-CB 3.19Å; D393-W395 PolarHBondContact OD1-N 3.08Å; D393-T396 PolarHBondContact O-N 2.88Å; D393-T396 PolarHBondContact OD1-N 3.16Å; D393-T396 WeakPolarHBondContact OD2-CB 3.46Å; D393-T396 PolarHBondContact OD2-OG1 3.22Å; D393-M397 PolarHBondContact O-N 3.26Å; D393-M397 VanDerWaalsContact O-N 3.11Å
394	A	97.1	Very high	97.8	Very high	48 Å²	48	33.2 Å²	33.2	40%	0.397	16%	0.164	S	C	.	.	H	α-helix	trans	-65.6	-30.5	-178.3	0	0	0	0	0	114.3	F370 M397 N398	F370-A394 HydrophobicContact CD1-CB 3.71Å; F370-A394 HydrophobicContact CE1-CB 3.67Å; F370-A394 HydrophobicContact CG-CB 4.38Å; F370-A394 HydrophobicContact CZ-CB 4.29Å; A394-M397 PolarHBondContact O-N 2.87Å; A394-N398 WeakPolarHBondContact O-CB 3.4Å; A394-N398 PolarHBondContact O-N 3.14Å
395	W	95.8	Very high	98	Very high	66 Å²	66	28.2 Å²	28.2	25%	0.25	14%	0.14	C	C	.	.	H	α-helix	trans	-73.6	-41.8	178.7	167.6	-103	0	0	0	111	N266 F267 K274 D393 M397 N398 L399	N266-W395 HydrophobicContact CB-CH2 3.72Å; N266-W395 HydrophobicContact CB-CZ2 4.28Å; N266-W395 WeakPolarHBondContact O-CZ2 2.97Å; F267-W395 HydrophobicContact CE1-CH2 4.32Å; F267-W395 HydrophobicContact CZ-CH2 4.36Å; F267-W395 HydrophobicContact CZ-CZ3 4.48Å; K274-W395 VanDerWaalsContact NZ-CE2 3.34Å; D393-W395 VanDerWaalsContact C-N 3.34Å; D393-W395 PolarHBondContact O-N 2.94Å; D393-W395 VanDerWaalsContact OD1-CA 3.26Å; D393-W395 WeakPolarHBondContact OD1-CA 3.2Å; D393-W395 WeakPolarHBondContact OD1-CB 3.19Å; D393-W395 PolarHBondContact OD1-N 3.08Å; W395-M397 VanDerWaalsContact C-N 3.32Å; W395-M397 PolarHBondContact O-N 3.31Å; W395-N398 PolarHBondContact O-N 2.98Å; W395-L399 HydrophobicContact CD2-CG 4.43Å; W395-L399 HydrophobicContact CH2-CD2 3.91Å; W395-L399 HydrophobicContact CH2-CG 4.2Å; W395-L399 HydrophobicContact CZ2-CD1 3.99Å; W395-L399 HydrophobicContact CZ2-CD2 3.56Å; W395-L399 HydrophobicContact CZ2-CG 3.68Å; W395-L399 PolarHBondContact O-N 3.42Å
396	T	97.6	Very high	98.1	Very high	38 Å²	38	20.6 Å²	20.6	23%	0.233	11%	0.11	C	C	.	.	H	α-helix	trans	-60.5	-40.5	170.4	-63.3	0	0	0	0	111.5	L307 C391 D393 L399 W400	L307-T396 HydrophobicContact CD2-CG2 4.45Å; C391-T396 HydrophobicContact CB-CG2 3.96Å; D393-T396 PolarHBondContact O-N 2.88Å; D393-T396 PolarHBondContact OD1-N 3.16Å; D393-T396 WeakPolarHBondContact OD2-CB 3.46Å; D393-T396 PolarHBondContact OD2-OG1 3.22Å; T396-L399 PolarHBondContact O-N 3.34Å; T396-W400 VanDerWaalsContact O-CD1 3.29Å; T396-W400 PolarHBondContact O-N 2.99Å; T396-W400 VanDerWaalsContact O-N 3.1Å
397	M	98.1	Very high	98.2	Very high	26 Å²	26	21.1 Å²	21.1	13%	0.128	12%	0.115	C	C	.	.	H	α-helix	trans	-61.4	-45.4	172.3	-176.2	179.7	67.1	0	0	112.6	Y356 F370 C371 F372 C391 D393 A394 W395 L399 W400 V401	Y356-M397 HydrophobicContact CD1-CE 3.82Å; Y356-M397 HydrophobicContact CD1-CG 4.49Å; Y356-M397 HydrophobicContact CD1-SD 3.94Å; Y356-M397 HydrophobicContact CE1-CE 4.01Å; Y356-M397 HydrophobicContact CE1-CG 4.45Å; Y356-M397 HydrophobicContact CE1-SD 4.38Å; F370-M397 HydrophobicContact CB-CB 4.22Å; F370-M397 HydrophobicContact CB-SD 4.18Å; C371-M397 PolarHBondContact N-SD 3.36Å; C371-M397 VanDerWaalsContact N-SD 3.44Å; F372-M397 HydrophobicContact CB-CG 4.49Å; C391-M397 HydrophobicContact CB-CB 4.16Å; C391-M397 VanDerWaalsContact SG-CA 3.54Å; D393-M397 PolarHBondContact O-N 3.26Å; D393-M397 VanDerWaalsContact O-N 3.11Å; A394-M397 PolarHBondContact O-N 2.87Å; W395-M397 VanDerWaalsContact C-N 3.32Å; W395-M397 PolarHBondContact O-N 3.31Å; M397-L399 PolarHBondContact O-N 2.9Å; M397-W400 PolarHBondContact O-N 3.39Å; M397-V401 HydrophobicContact CG-CG2 4.33Å; M397-V401 WeakPolarHBondContact O-CG2 3.47Å; M397-V401 PolarHBondContact O-N 3.41Å
398	N	97.6	Very high	98.2	Very high	24 Å²	24	21.8 Å²	21.8	13%	0.128	12%	0.118	C	C	.	.	H	α-helix	trans	-63.3	-40.3	178.1	177.5	-106.6	0	0	0	112.5	F267 A394 W395 T402	F267-N398 WeakPolarHBondContact CE1-OD1 3.42Å; A394-N398 WeakPolarHBondContact O-CB 3.4Å; A394-N398 PolarHBondContact O-N 3.14Å; W395-N398 PolarHBondContact O-N 2.98Å; N398-T402 WeakPolarHBondContact O-CB 3.46Å; N398-T402 PolarHBondContact O-N 3.22Å; N398-T402 PolarHBondContact O-OG1 3.48Å
399	L	97.9	Very high	98.1	Very high	9 Å²	9	23 Å²	23	5%	0.047	12%	0.123	C	C	.	.	H	α-helix	trans	-57	-49.6	172	-79.2	176.5	0	0	0	112.1	F267 W270 L303 W395 T396 M397 G403	F267-L399 HydrophobicContact CD1-CD2 3.82Å; F267-L399 HydrophobicContact CE1-CD2 4.38Å; F267-L399 HydrophobicContact CG-CD2 4.49Å; W270-L399 HydrophobicContact CB-CD1 4.05Å; W270-L399 HydrophobicContact CB-CD2 3.85Å; W270-L399 HydrophobicContact CD2-CD1 4.34Å; W270-L399 HydrophobicContact CE3-CD1 4.09Å; W270-L399 HydrophobicContact CG-CD1 4.38Å; L303-L399 HydrophobicContact CD1-CB 4.27Å; L303-L399 HydrophobicContact CD1-CD1 4.43Å; L303-L399 HydrophobicContact CD2-CB 4.29Å; W395-L399 HydrophobicContact CD2-CG 4.43Å; W395-L399 HydrophobicContact CH2-CD2 3.91Å; W395-L399 HydrophobicContact CH2-CG 4.2Å; W395-L399 HydrophobicContact CZ2-CD1 3.99Å; W395-L399 HydrophobicContact CZ2-CD2 3.56Å; W395-L399 HydrophobicContact CZ2-CG 3.68Å; W395-L399 PolarHBondContact O-N 3.42Å; T396-L399 PolarHBondContact O-N 3.34Å; M397-L399 PolarHBondContact O-N 2.9Å; L399-G403 PolarHBondContact O-N 3.35Å
400	W	98.7	Very high	98	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.008	13%	0.127	C	C	.	.	H	α-helix	trans	-66.2	-48.5	-179.1	-83.6	99.5	0	0	0	112.7	L303 L307 F322 L324 I329 F372 T396 M397 T402 G403 I404	L303-W400 HydrophobicContact CD2-CB 4.28Å; L303-W400 HydrophobicContact CD2-CD2 3.53Å; L303-W400 HydrophobicContact CD2-CE3 3.85Å; L303-W400 HydrophobicContact CD2-CG 3.74Å; L303-W400 HydrophobicContact CD2-CZ2 4.38Å; L303-W400 HydrophobicContact CD2-CZ3 4.39Å; L303-W400 HydrophobicContact CG-CD2 4.1Å; L303-W400 HydrophobicContact CG-CE3 4.44Å; L303-W400 HydrophobicContact CG-CH2 4.38Å; L303-W400 HydrophobicContact CG-CZ2 4.03Å; L307-W400 HydrophobicContact CD1-CD2 3.92Å; L307-W400 HydrophobicContact CD1-CE3 4.42Å; L307-W400 HydrophobicContact CD1-CG 4.23Å; L307-W400 HydrophobicContact CD1-CZ2 4.13Å; F322-W400 HydrophobicContact CB-CH2 3.71Å; F322-W400 HydrophobicContact CB-CZ2 4.08Å; F322-W400 HydrophobicContact CB-CZ3 4.5Å; L324-W400 HydrophobicContact CB-CH2 4.42Å; L324-W400 HydrophobicContact CB-CZ3 3.99Å; I329-W400 HydrophobicContact CD1-CZ3 4.43Å; I329-W400 HydrophobicContact CG2-CH2 4.43Å; I329-W400 HydrophobicContact CG2-CZ3 4.01Å; F372-W400 HydrophobicContact CD1-CB 4.21Å; F372-W400 HydrophobicContact CE1-CB 3.57Å; F372-W400 AromaticContact CE1-CG 3.96Å; F372-W400 HydrophobicContact CE1-CG 3.96Å; F372-W400 HydrophobicContact CZ-CB 3.83Å; F372-W400 HydrophobicContact CZ-CD2 4.35Å; F372-W400 HydrophobicContact CZ-CE3 4.39Å; F372-W400 HydrophobicContact CZ-CG 4.13Å; T396-W400 VanDerWaalsContact O-CD1 3.29Å; T396-W400 PolarHBondContact O-N 2.99Å; T396-W400 VanDerWaalsContact O-N 3.1Å; M397-W400 PolarHBondContact O-N 3.39Å; W400-T402 VanDerWaalsContact C-N 3.32Å; W400-T402 PolarHBondContact O-N 3.17Å; W400-G403 PolarHBondContact O-N 3.22Å; W400-I404 WeakPolarHBondContact O-CB 3.05Å; W400-I404 VanDerWaalsContact O-CD1 3.3Å; W400-I404 WeakPolarHBondContact O-CD1 3.19Å; W400-I404 WeakPolarHBondContact O-CG1 3.29Å; W400-I404 PolarHBondContact O-N 3.47Å
401	V	98.8	Very high	97.9	Very high	3 Å²	3	25.8 Å²	25.8	2%	0.018	15%	0.147	C	C	.	.	H	α-helix	trans	-61.8	-41.4	178.7	175.8	0	0	0	0	111.1	V354 Y356 F372 M397 I404 R405	V354-V401 HydrophobicContact CG1-CG1 4.12Å; V354-V401 HydrophobicContact CG2-CB 4.47Å; V354-V401 HydrophobicContact CG2-CG1 4.13Å; V354-V401 HydrophobicContact CG2-CG2 4.05Å; Y356-V401 HydrophobicContact CD1-CG2 4.37Å; Y356-V401 HydrophobicContact CE1-CB 4.27Å; Y356-V401 HydrophobicContact CE1-CG1 4.23Å; Y356-V401 HydrophobicContact CE1-CG2 3.89Å; Y356-V401 HydrophobicContact CE2-CG1 4.22Å; F372-V401 HydrophobicContact CB-CG2 3.56Å; F372-V401 HydrophobicContact CG-CG2 4.05Å; M397-V401 HydrophobicContact CG-CG2 4.33Å; M397-V401 WeakPolarHBondContact O-CG2 3.47Å; M397-V401 PolarHBondContact O-N 3.41Å; V401-I404 PolarHBondContact O-N 3.37Å; V401-R405 VanDerWaalsContact O-CG 3.28Å; V401-R405 WeakPolarHBondContact O-CG 3.49Å; V401-R405 PolarHBondContact O-N 3.04Å
402	T	98.6	Very high	97.8	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-69.1	-43.6	178.7	-51.7	0	0	0	0	111.4	V260 F267 N398 W400 I404 R405 I406	V260-T402 HydrophobicContact CB-CG2 3.94Å; V260-T402 HydrophobicContact CG1-CG2 4.25Å; F267-T402 HydrophobicContact CD1-CG2 3.76Å; F267-T402 HydrophobicContact CE1-CG2 3.63Å; F267-T402 HydrophobicContact CG-CG2 4.47Å; F267-T402 HydrophobicContact CZ-CG2 4.24Å; N398-T402 WeakPolarHBondContact O-CB 3.46Å; N398-T402 PolarHBondContact O-N 3.22Å; N398-T402 PolarHBondContact O-OG1 3.48Å; W400-T402 VanDerWaalsContact C-N 3.32Å; W400-T402 PolarHBondContact O-N 3.17Å; T402-I404 VanDerWaalsContact C-N 3.33Å; T402-I404 PolarHBondContact O-N 2.97Å; T402-R405 PolarHBondContact O-N 2.97Å; T402-R405 VanDerWaalsContact O-N 3.16Å; T402-I406 HydrophobicContact CG2-CD1 4.25Å; T402-I406 VanDerWaalsContact O-CG1 3.29Å; T402-I406 WeakPolarHBondContact O-CG1 3.43Å; T402-I406 PolarHBondContact O-N 3.16Å
403	G	98.6	Very high	97.9	Very high	3 Å²	3	23.6 Å²	23.6	3%	0.031	14%	0.138	C	C	.	.	H	α-helix	trans	-59.6	-40.2	174.8	0	0	0	0	0	113.3	L399 W400 I406 A407	L399-G403 PolarHBondContact O-N 3.35Å; W400-G403 PolarHBondContact O-N 3.22Å; G403-I406 PolarHBondContact O-N 2.69Å; G403-A407 WeakPolarHBondContact O-CB 3.21Å; G403-A407 PolarHBondContact O-N 3.42Å
404	I	98.8	Very high	97.9	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.015	13%	0.129	C	C	.	.	H	α-helix	trans	-63.7	-42.3	174.4	-68.6	161	0	0	0	111	L324 I329 F349 V354 F372 L374 W400 V401 T402 A407 K408	L324-I404 HydrophobicContact CD1-CG1 4.32Å; I329-I404 HydrophobicContact CD1-CD1 3.88Å; I329-I404 HydrophobicContact CD1-CG1 4.26Å; F349-I404 HydrophobicContact CD1-CG2 3.89Å; F349-I404 HydrophobicContact CE1-CB 4.2Å; F349-I404 HydrophobicContact CE1-CG1 3.85Å; F349-I404 HydrophobicContact CE1-CG2 3.6Å; F349-I404 HydrophobicContact CZ-CB 4.27Å; F349-I404 HydrophobicContact CZ-CG1 3.81Å; F349-I404 HydrophobicContact CZ-CG2 4.12Å; V354-I404 HydrophobicContact CB-CG2 3.93Å; V354-I404 HydrophobicContact CG1-CG2 3.99Å; V354-I404 HydrophobicContact CG2-CD1 4.27Å; V354-I404 HydrophobicContact CG2-CG2 4.4Å; F372-I404 HydrophobicContact CD2-CD1 3.96Å; F372-I404 HydrophobicContact CE2-CD1 3.46Å; F372-I404 VanDerWaalsContact CE2-CD1 3.46Å; F372-I404 HydrophobicContact CZ-CD1 4.12Å; L374-I404 HydrophobicContact CD2-CD1 4.49Å; L374-I404 HydrophobicContact CD2-CG2 4.42Å; W400-I404 WeakPolarHBondContact O-CB 3.05Å; W400-I404 VanDerWaalsContact O-CD1 3.3Å; W400-I404 WeakPolarHBondContact O-CD1 3.19Å; W400-I404 WeakPolarHBondContact O-CG1 3.29Å; W400-I404 PolarHBondContact O-N 3.47Å; V401-I404 PolarHBondContact O-N 3.37Å; T402-I404 VanDerWaalsContact C-N 3.33Å; T402-I404 PolarHBondContact O-N 2.97Å; I404-A407 PolarHBondContact O-N 3.43Å; I404-K408 WeakPolarHBondContact O-CB 3.37Å; I404-K408 PolarHBondContact O-N 3.28Å
405	R	98.7	Very high	97.9	Very high	12 Å²	12	25.1 Å²	25.1	5%	0.045	14%	0.135	C	C	.	.	H	α-helix	trans	-63.6	-43.2	176	-69.5	167.5	68.7	-126.6	-6	111.9	E229 K257 V354 V401 T402 A407 K408 Y409 L413	E229-R405 VanDerWaalsContact CD-NH2 3.32Å; E229-R405 IonicContact OE1-CZ 3.76Å; E229-R405 VanDerWaalsContact OE1-CZ 3.25Å; E229-R405 IonicContact OE1-NE 3.99Å; E229-R405 PolarHBondContact OE1-NE 3.22Å; E229-R405 IonicContact OE1-NH2 2.89Å; E229-R405 PolarHBondContact OE1-NH2 3.32Å; E229-R405 IonicContact OE2-CZ 3.57Å; E229-R405 IonicContact OE2-NE 3.36Å; E229-R405 IonicContact OE2-NH2 2.75Å; E229-R405 PolarHBondContact OE2-NH2 2.99Å; K257-R405 PolarHBondContact O-NH1 3.5Å; K257-R405 PolarHBondContact O-NH2 2.97Å; V354-R405 HydrophobicContact CG1-CG 3.99Å; V401-R405 VanDerWaalsContact O-CG 3.28Å; V401-R405 WeakPolarHBondContact O-CG 3.49Å; V401-R405 PolarHBondContact O-N 3.04Å; T402-R405 PolarHBondContact O-N 2.97Å; T402-R405 VanDerWaalsContact O-N 3.16Å; R405-A407 VanDerWaalsContact C-N 3.34Å; R405-A407 PolarHBondContact O-N 3.38Å; R405-K408 PolarHBondContact O-N 3.44Å; R405-Y409 HydrophobicContact CB-CD2 4.12Å; R405-Y409 HydrophobicContact CB-CE2 4.47Å; R405-Y409 HydrophobicContact CG-CD2 4.44Å; R405-Y409 HydrophobicContact CG-CE2 4.3Å; R405-Y409 WeakPolarHBondContact O-CB 3.39Å; R405-Y409 VanDerWaalsContact O-CD2 3.3Å; R405-Y409 WeakPolarHBondContact O-CD2 3.44Å; R405-Y409 PolarHBondContact O-N 3.42Å; R405-L413 HydrophobicContact CB-CD2 4.11Å
406	I	98.5	Very high	98.1	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-59.7	-45.6	174.5	-62.2	164.1	0	0	0	110.6	V260 Y268 F293 I298 V300 P301 T402 G403 G410 L413	V260-I406 HydrophobicContact CG2-CD1 3.95Å; Y268-I406 HydrophobicContact CE2-CD1 4.44Å; F293-I406 HydrophobicContact CE1-CG2 4.21Å; F293-I406 HydrophobicContact CZ-CD1 4.47Å; F293-I406 HydrophobicContact CZ-CG1 4.1Å; F293-I406 HydrophobicContact CZ-CG2 4.15Å; I298-I406 HydrophobicContact CD1-CG2 3.99Å; I298-I406 HydrophobicContact CG1-CG2 3.99Å; V300-I406 HydrophobicContact CG2-CG2 4.42Å; P301-I406 HydrophobicContact CG-CD1 3.93Å; T402-I406 HydrophobicContact CG2-CD1 4.25Å; T402-I406 VanDerWaalsContact O-CG1 3.29Å; T402-I406 WeakPolarHBondContact O-CG1 3.43Å; T402-I406 PolarHBondContact O-N 3.16Å; G403-I406 PolarHBondContact O-N 2.69Å; I406-G410 WeakPolarHBondContact O-CA 3Å; I406-G410 PolarHBondContact O-N 2.89Å; I406-L413 HydrophobicContact CG1-CD2 4.2Å
407	A	98.3	Very high	98.1	Very high	14 Å²	14	21.3 Å²	21.3	12%	0.116	12%	0.118	C	C	.	.	H	α-helix	trans	-67.1	-38.5	-179.6	0	0	0	0	0	113.4	V300 L324 F349 G403 I404 R405	V300-A407 HydrophobicContact CG1-CB 4.01Å; V300-A407 HydrophobicContact CG2-CB 4.01Å; L324-A407 HydrophobicContact CD1-CB 4.37Å; F349-A407 HydrophobicContact CD2-CB 3.61Å; F349-A407 HydrophobicContact CE2-CB 3.41Å; F349-A407 VanDerWaalsContact CE2-CB 3.41Å; F349-A407 HydrophobicContact CZ-CB 4.47Å; G403-A407 WeakPolarHBondContact O-CB 3.21Å; G403-A407 PolarHBondContact O-N 3.42Å; I404-A407 PolarHBondContact O-N 3.43Å; R405-A407 VanDerWaalsContact C-N 3.34Å; R405-A407 PolarHBondContact O-N 3.38Å
408	K	98	Very high	98.1	Very high	55 Å²	55	23 Å²	23	24%	0.239	13%	0.125	C	C	.	.	H	α-helix	trans	-76.4	-43	179.7	-173.5	-178.7	170.3	83.7	0	113.4	F349 D350 V352 N353 I404 R405	F349-K408 HydrophobicContact CB-CB 4.02Å; F349-K408 HydrophobicContact CB-CG 4.19Å; F349-K408 PolarHBondContact O-NZ 3.07Å; D350-K408 PolarHBondContact O-NZ 2.84Å; V352-K408 WeakPolarHBondContact O-CE 3.25Å; V352-K408 PolarHBondContact O-NZ 3.45Å; N353-K408 WeakPolarHBondContact OD1-CE 3.49Å; N353-K408 PolarHBondContact OD1-NZ 2.9Å; I404-K408 WeakPolarHBondContact O-CB 3.37Å; I404-K408 PolarHBondContact O-N 3.28Å; R405-K408 PolarHBondContact O-N 3.44Å
409	Y	97.8	Very high	98.1	Very high	30 Å²	30	23.8 Å²	23.8	12%	0.118	13%	0.13	C	C	.	.	H	α-helix	trans	-108.6	-14.5	-167.4	-58.2	-66.5	0	0	0	114.5	E229 H231 R405 A411 S412 L413	E229-Y409 HydrophobicContact CG-CD1 4.26Å; E229-Y409 HydrophobicContact CG-CD2 3.77Å; E229-Y409 HydrophobicContact CG-CE1 4Å; E229-Y409 HydrophobicContact CG-CE2 3.5Å; E229-Y409 VanDerWaalsContact CG-CE2 3.5Å; E229-Y409 HydrophobicContact CG-CG 4.15Å; H231-Y409 AromaticContact CE1-CD1 3.84Å; H231-Y409 AromaticContact NE2-CD1 3.41Å; H231-Y409 WeakPolarHBondContact NE2-CD1 3.21Å; H231-Y409 AromaticContact NE2-CE1 3.91Å; R405-Y409 HydrophobicContact CB-CD2 4.12Å; R405-Y409 HydrophobicContact CB-CE2 4.47Å; R405-Y409 HydrophobicContact CG-CD2 4.44Å; R405-Y409 HydrophobicContact CG-CE2 4.3Å; R405-Y409 WeakPolarHBondContact O-CB 3.39Å; R405-Y409 VanDerWaalsContact O-CD2 3.3Å; R405-Y409 WeakPolarHBondContact O-CD2 3.44Å; R405-Y409 PolarHBondContact O-N 3.42Å; Y409-A411 PolarHBondContact O-N 2.88Å; Y409-S412 PolarHBondContact O-N 2.98Å; Y409-S412 VanDerWaalsContact O-N 3.15Å; Y409-L413 PolarHBondContact O-N 2.98Å
410	G	96.5	Very high	98	Very high	9 Å²	9	23.6 Å²	23.6	9%	0.093	13%	0.13	C	C	.	.	H	α-helix	trans	49.3	-126.1	169.8	0	0	0	0	0	115.2	I406 S412 L413	I406-G410 WeakPolarHBondContact O-CA 3Å; I406-G410 PolarHBondContact O-N 2.89Å; G410-S412 VanDerWaalsContact C-N 3.33Å; G410-S412 PolarHBondContact O-N 3.49Å; G410-L413 WeakPolarHBondContact O-CB 3.26Å; G410-L413 PolarHBondContact O-N 3.29Å
411	A	96.5	Very high	97.9	Very high	49 Å²	49	26.8 Å²	26.8	41%	0.405	15%	0.145	S	C	.	.	H	α-helix	trans	-61.3	-37.4	-178.9	0	0	0	0	0	112.9	Y409 L413 H414 E415	Y409-A411 PolarHBondContact O-N 2.88Å; A411-L413 PolarHBondContact O-N 3.1Å; A411-H414 WeakPolarHBondContact O-CA 3.09Å; A411-H414 WeakPolarHBondContact O-CB 3.32Å; A411-H414 PolarHBondContact O-N 3.11Å; A411-E415 PolarHBondContact O-N 3.45Å
412	S	97.6	Very high	97.8	Very high	47 Å²	47	33.8 Å²	33.8	33%	0.329	17%	0.171	S	C	.	.	H	α-helix	trans	-67	-21.2	-178.2	-55.8	0	0	0	0	113.2	H231 Y409 G410 H414 E415 N416	H231-S412 PolarHBondContact ND1-O 2.62Å; Y409-S412 PolarHBondContact O-N 2.98Å; Y409-S412 VanDerWaalsContact O-N 3.15Å; G410-S412 VanDerWaalsContact C-N 3.33Å; G410-S412 PolarHBondContact O-N 3.49Å; S412-H414 VanDerWaalsContact C-N 3.33Å; S412-E415 WeakPolarHBondContact CA-OE2 3.46Å; S412-E415 PolarHBondContact OG-OE2 3.01Å; S412-N416 WeakPolarHBondContact O-CB 3.48Å; S412-N416 PolarHBondContact O-N 2.92Å; S412-N416 PolarHBondContact O-ND2 3.22Å; S412-N416 PolarHBondContact O-OD1 3.07Å; S412-N416 VanDerWaalsContact O-OD1 3.05Å
413	L	98.3	Very high	97.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-68.4	-32.1	169.1	-174.1	58.6	0	0	0	112.5	E229 F261 R405 I406 Y409 G410 A411	E229-L413 VanDerWaalsContact OE2-CD1 3.28Å; E229-L413 WeakPolarHBondContact OE2-CD1 3.16Å; F261-L413 HydrophobicContact CE2-CG 4.05Å; F261-L413 VanDerWaalsContact CE2-O 3.31Å; F261-L413 WeakPolarHBondContact CE2-O 3.39Å; F261-L413 HydrophobicContact CZ-CB 4.48Å; F261-L413 HydrophobicContact CZ-CG 4Å; F261-L413 WeakPolarHBondContact CZ-O 3.39Å; R405-L413 HydrophobicContact CB-CD2 4.11Å; I406-L413 HydrophobicContact CG1-CD2 4.2Å; Y409-L413 PolarHBondContact O-N 2.98Å; G410-L413 WeakPolarHBondContact O-CB 3.26Å; G410-L413 PolarHBondContact O-N 3.29Å; A411-L413 PolarHBondContact O-N 3.1Å
414	H	98	Very high	97.2	Very high	22 Å²	22	38.5 Å²	38.5	10%	0.102	19%	0.194	C	C	.	.	H	α-helix	trans	-79.2	-39.8	174.5	-178.5	-143.4	0	0	0	111.5	F261 V289 F293 C294 A411 S412 N416 F417 K418	F261-H414 AromaticContact CD1-CD2 3.79Å; F261-H414 HydrophobicContact CE1-CB 3.73Å; F261-H414 AromaticContact CE1-CD2 3.66Å; F261-H414 AromaticContact CE1-CG 3.94Å; F261-H414 VanDerWaalsContact CZ-CA 3.5Å; F261-H414 HydrophobicContact CZ-CB 3.88Å; V289-H414 WeakPolarHBondContact CG1-NE2 3.38Å; F293-H414 HydrophobicContact CB-CB 4.1Å; F293-H414 HydrophobicContact CD1-CB 3.76Å; F293-H414 HydrophobicContact CE1-CB 4.44Å; F293-H414 HydrophobicContact CG-CB 4.07Å; C294-H414 VanDerWaalsContact SG-CE1 3.6Å; A411-H414 WeakPolarHBondContact O-CA 3.09Å; A411-H414 WeakPolarHBondContact O-CB 3.32Å; A411-H414 PolarHBondContact O-N 3.11Å; S412-H414 VanDerWaalsContact C-N 3.33Å; H414-N416 VanDerWaalsContact C-N 3.32Å; H414-N416 PolarHBondContact O-N 2.7Å; H414-F417 WeakPolarHBondContact O-CB 3.37Å; H414-F417 PolarHBondContact O-N 2.87Å; H414-F417 VanDerWaalsContact O-N 3.08Å; H414-K418 WeakPolarHBondContact NE2-CD 3.44Å; H414-K418 PolarHBondContact O-N 3.49Å
415	E	98.2	Very high	96.9	Very high	115 Å²	115	41.4 Å²	41.4	54%	0.537	22%	0.218	S	C	.	.	H	α-helix	trans	-61.5	-39	174.8	-64.5	173.4	142.8	0	0	112.2	A411 S412 T419	A411-E415 PolarHBondContact O-N 3.45Å; S412-E415 WeakPolarHBondContact CA-OE2 3.46Å; S412-E415 PolarHBondContact OG-OE2 3.01Å; E415-T419 VanDerWaalsContact O-CB 3.27Å; E415-T419 WeakPolarHBondContact O-CB 3.41Å; E415-T419 PolarHBondContact O-N 3.46Å; E415-T419 PolarHBondContact O-OG1 2.79Å
416	N	98.5	Very high	96.5	Very high	11 Å²	11	45.1 Å²	45.1	6%	0.059	24%	0.242	C	C	.	.	H	α-helix	trans	-51.9	-54.3	168.2	-72.4	-6.1	0	0	0	110.6	D230 H231 F258 S412 H414 T419 A420	D230-N416 HydrophobicContact CB-CB 4.05Å; D230-N416 PolarHBondContact N-ND2 3.34Å; H231-N416 PolarHBondContact N-OD1 2.81Å; H231-N416 PolarHBondContact ND1-ND2 3.45Å; H231-N416 PolarHBondContact ND1-OD1 3.12Å; F258-N416 HydrophobicContact CE1-CB 3.9Å; F258-N416 HydrophobicContact CZ-CB 4.06Å; S412-N416 WeakPolarHBondContact O-CB 3.48Å; S412-N416 PolarHBondContact O-N 2.92Å; S412-N416 PolarHBondContact O-ND2 3.22Å; S412-N416 PolarHBondContact O-OD1 3.07Å; S412-N416 VanDerWaalsContact O-OD1 3.05Å; H414-N416 VanDerWaalsContact C-N 3.32Å; H414-N416 PolarHBondContact O-N 2.7Å; N416-T419 PolarHBondContact O-N 2.9Å; N416-A420 PolarHBondContact O-N 2.9Å
417	F	98.3	Very high	95.9	Very high	13 Å²	13	47 Å²	47	6%	0.057	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-50.5	-176.9	177.6	-113.1	0	0	0	112.5	V211 F258 F261 H414 T419 A420 E421	V211-F417 HydrophobicContact CG2-CE2 4.45Å; F258-F417 HydrophobicContact CB-CD2 3.57Å; F258-F417 HydrophobicContact CB-CE2 4Å; F258-F417 HydrophobicContact CB-CG 4.44Å; F258-F417 HydrophobicContact CD1-CB 3.76Å; F258-F417 AromaticContact CD1-CD2 3.97Å; F258-F417 HydrophobicContact CD1-CD2 3.97Å; F258-F417 HydrophobicContact CD1-CG 4.27Å; F258-F417 HydrophobicContact CD2-CD2 4.01Å; F258-F417 HydrophobicContact CE1-CB 3.93Å; F258-F417 HydrophobicContact CG-CB 4.3Å; F258-F417 AromaticContact CG-CD2 3.61Å; F258-F417 HydrophobicContact CG-CD2 3.61Å; F258-F417 HydrophobicContact CG-CE2 4.44Å; F258-F417 HydrophobicContact CG-CG 4.36Å; F261-F417 HydrophobicContact CB-CD1 3.36Å; F261-F417 HydrophobicContact CB-CD2 4.24Å; F261-F417 HydrophobicContact CB-CE1 3.39Å; F261-F417 HydrophobicContact CB-CE2 4.24Å; F261-F417 HydrophobicContact CB-CG 3.81Å; F261-F417 HydrophobicContact CB-CZ 3.84Å; F261-F417 HydrophobicContact CD1-CD1 4.29Å; F261-F417 HydrophobicContact CD2-CB 3.52Å; F261-F417 AromaticContact CD2-CD1 3.89Å; F261-F417 HydrophobicContact CD2-CD1 3.89Å; F261-F417 HydrophobicContact CD2-CD2 4.12Å; F261-F417 AromaticContact CD2-CG 3.56Å; F261-F417 HydrophobicContact CD2-CG 3.56Å; F261-F417 HydrophobicContact CE2-CB 3.82Å; F261-F417 HydrophobicContact CE2-CG 4.36Å; F261-F417 HydrophobicContact CG-CB 4.08Å; F261-F417 AromaticContact CG-CD1 3.58Å; F261-F417 HydrophobicContact CG-CD1 3.58Å; F261-F417 HydrophobicContact CG-CD2 4.49Å; F261-F417 HydrophobicContact CG-CE1 4.15Å; F261-F417 AromaticContact CG-CG 3.78Å; F261-F417 HydrophobicContact CG-CG 3.78Å; H414-F417 WeakPolarHBondContact O-CB 3.37Å; H414-F417 PolarHBondContact O-N 2.87Å; H414-F417 VanDerWaalsContact O-N 3.08Å; F417-T419 PolarHBondContact O-N 2.82Å; F417-T419 VanDerWaalsContact O-N 3.16Å; F417-A420 PolarHBondContact O-N 2.81Å; F417-A420 VanDerWaalsContact O-N 3.14Å; F417-E421 HydrophobicContact CD1-CG 4.38Å; F417-E421 HydrophobicContact CD2-CG 4.29Å; F417-E421 HydrophobicContact CE1-CG 3.9Å; F417-E421 WeakPolarHBondContact CE1-OE1 3.2Å; F417-E421 HydrophobicContact CE2-CG 3.81Å; F417-E421 HydrophobicContact CZ-CG 3.6Å; F417-E421 VanDerWaalsContact CZ-OE1 3.26Å; F417-E421 WeakPolarHBondContact CZ-OE1 3.26Å; F417-E421 WeakPolarHBondContact O-CG 3.45Å; F417-E421 PolarHBondContact O-N 2.77Å
418	K	97.6	Very high	95.3	Very high	63 Å²	63	48.9 Å²	48.9	27%	0.274	27%	0.271	S	S	.	.	H	α-helix	trans	-62.5	-24.8	178.2	-57	-49.9	-69.4	-179.8	0	112.5	H414 E421 R422	H414-K418 WeakPolarHBondContact NE2-CD 3.44Å; H414-K418 PolarHBondContact O-N 3.49Å; K418-E421 WeakPolarHBondContact CD-OE2 3.18Å; K418-E421 WeakPolarHBondContact CE-OE2 3.49Å; K418-E421 IonicContact NZ-OE2 2.7Å; K418-E421 PolarHBondContact NZ-OE2 3.39Å; K418-R422 WeakPolarHBondContact O-CB 3.35Å; K418-R422 PolarHBondContact O-N 2.87Å
419	T	97.8	Very high	94.7	Very high	40 Å²	40	48.6 Å²	48.6	25%	0.245	28%	0.278	C	S	.	.	H	α-helix	trans	-80.5	-40.3	174.9	-60.1	0	0	0	0	112.2	R195 E415 N416 F417 R422 K423	R195-T419 HydrophobicContact CG-CG2 4.38Å; E415-T419 VanDerWaalsContact O-CB 3.27Å; E415-T419 WeakPolarHBondContact O-CB 3.41Å; E415-T419 PolarHBondContact O-N 3.46Å; E415-T419 PolarHBondContact O-OG1 2.79Å; N416-T419 PolarHBondContact O-N 2.9Å; F417-T419 PolarHBondContact O-N 2.82Å; F417-T419 VanDerWaalsContact O-N 3.16Å; T419-R422 PolarHBondContact O-N 2.77Å; T419-R422 PolarHBondContact OG1-NH1 3.49Å; T419-K423 WeakPolarHBondContact O-CG 3.35Å; T419-K423 PolarHBondContact O-N 3.01Å
420	A	97.2	Very high	93.9	Very high	4 Å²	4	51.4 Å²	51.4	3%	0.033	30%	0.299	C	S	.	.	H	α-helix	trans	-61.3	-45.7	171.4	0	0	0	0	0	111.8	V211 F258 N416 F417 R422 K423 A424	V211-A420 HydrophobicContact CB-CB 4.25Å; V211-A420 HydrophobicContact CG1-CB 4.09Å; F258-A420 HydrophobicContact CE2-CB 4.1Å; F258-A420 HydrophobicContact CZ-CB 4.48Å; N416-A420 PolarHBondContact O-N 2.9Å; F417-A420 PolarHBondContact O-N 2.81Å; F417-A420 VanDerWaalsContact O-N 3.14Å; A420-R422 VanDerWaalsContact C-N 3.34Å; A420-R422 PolarHBondContact O-N 2.86Å; A420-K423 PolarHBondContact O-N 3.1Å; A420-A424 WeakPolarHBondContact O-CB 3.45Å; A420-A424 PolarHBondContact O-N 2.63Å
421	E	96.3	Very high	92.6	Very high	70 Å²	70	58.1 Å²	58.1	33%	0.327	32%	0.321	S	S	.	.	H	α-helix	trans	-56.2	-47	173.7	-73.8	-172.5	125.9	0	0	112	V211 F417 K418 K423 A424 A425	V211-E421 HydrophobicContact CG1-CG 4.29Å; F417-E421 HydrophobicContact CD1-CG 4.38Å; F417-E421 HydrophobicContact CD2-CG 4.29Å; F417-E421 HydrophobicContact CE1-CG 3.9Å; F417-E421 WeakPolarHBondContact CE1-OE1 3.2Å; F417-E421 HydrophobicContact CE2-CG 3.81Å; F417-E421 HydrophobicContact CZ-CG 3.6Å; F417-E421 VanDerWaalsContact CZ-OE1 3.26Å; F417-E421 WeakPolarHBondContact CZ-OE1 3.26Å; F417-E421 WeakPolarHBondContact O-CG 3.45Å; F417-E421 PolarHBondContact O-N 2.77Å; K418-E421 WeakPolarHBondContact CD-OE2 3.18Å; K418-E421 WeakPolarHBondContact CE-OE2 3.49Å; K418-E421 IonicContact NZ-OE2 2.7Å; K418-E421 PolarHBondContact NZ-OE2 3.39Å; E421-K423 PolarHBondContact O-N 2.82Å; E421-A424 PolarHBondContact O-N 3.36Å; E421-A425 WeakPolarHBondContact O-CB 3.37Å; E421-A425 PolarHBondContact O-N 2.92Å
422	R	95.7	Very high	91.5	Very high	149 Å²	149	59.8 Å²	59.8	56%	0.562	33%	0.327	S	S	*	.	H	α-helix	trans	-62.8	-42.2	-179.8	-167.7	-171	-55.9	109.2	2.2	111.8	K418 T419 A420 V426	K418-R422 WeakPolarHBondContact O-CB 3.35Å; K418-R422 PolarHBondContact O-N 2.87Å; T419-R422 PolarHBondContact O-N 2.77Å; T419-R422 PolarHBondContact OG1-NH1 3.49Å; A420-R422 VanDerWaalsContact C-N 3.34Å; A420-R422 PolarHBondContact O-N 2.86Å; R422-V426 WeakPolarHBondContact O-CG2 3.45Å; R422-V426 PolarHBondContact O-N 3.23Å
423	K	93.1	Very high	89.9	Confident	86 Å²	86	63.3 Å²	63.3	37%	0.374	34%	0.342	S	S	.	.	H	α-helix	trans	-65.1	-49.1	176.2	-73.9	-86	179.1	158.4	0	111.1	D199 T419 A420 E421 A425 V426 S427	D199-K423 VanDerWaalsContact CG-NZ 3.34Å; D199-K423 IonicContact OD1-NZ 2.63Å; D199-K423 VanDerWaalsContact OD2-CE 3.27Å; D199-K423 WeakPolarHBondContact OD2-CE 3.39Å; D199-K423 IonicContact OD2-NZ 2.81Å; D199-K423 PolarHBondContact OD2-NZ 2.91Å; T419-K423 WeakPolarHBondContact O-CG 3.35Å; T419-K423 PolarHBondContact O-N 3.01Å; A420-K423 PolarHBondContact O-N 3.1Å; E421-K423 PolarHBondContact O-N 2.82Å; K423-A425 VanDerWaalsContact C-N 3.33Å; K423-A425 PolarHBondContact O-N 2.93Å; K423-V426 PolarHBondContact O-N 2.76Å; K423-S427 PolarHBondContact O-N 2.68Å; K423-S427 PolarHBondContact O-OG 2.94Å
424	A	92.5	Very high	88	Confident	17 Å²	17	73.3 Å²	73.3	14%	0.14	38%	0.379	C	S	.	.	H	α-helix	trans	-57.4	-43.6	177.5	0	0	0	0	0	112.5	C209 V211 A420 E421 V426 S427 A428	C209-A424 VanDerWaalsContact O-CB 3.28Å; C209-A424 WeakPolarHBondContact O-CB 3.49Å; V211-A424 HydrophobicContact CG1-CB 4.14Å; A420-A424 WeakPolarHBondContact O-CB 3.45Å; A420-A424 PolarHBondContact O-N 2.63Å; E421-A424 PolarHBondContact O-N 3.36Å; A424-V426 PolarHBondContact O-N 3.42Å; A424-S427 PolarHBondContact O-N 2.95Å; A424-A428 WeakPolarHBondContact O-CB 3.49Å; A424-A428 PolarHBondContact O-N 3.13Å
425	A	92.3	Very high	85.9	Confident	64 Å²	64	75.9 Å²	75.9	53%	0.529	40%	0.4	S	S	.	.	H	α-helix	trans	-63.6	-38.5	177.6	0	0	0	0	0	113.1	E421 K423 A429	E421-A425 WeakPolarHBondContact O-CB 3.37Å; E421-A425 PolarHBondContact O-N 2.92Å; K423-A425 VanDerWaalsContact C-N 3.33Å; K423-A425 PolarHBondContact O-N 2.93Å; A425-A429 PolarHBondContact O-N 3.33Å; A425-A429 VanDerWaalsContact O-N 3.14Å
426	V	89.4	Confident	83.3	Confident	90 Å²	90	75.1 Å²	75.1	55%	0.545	40%	0.403	S	S	.	.	H	α-helix	trans	-67.2	-47.2	175.3	170.5	0	0	0	0	111	R422 K423 A424 A428 A429 V430	R422-V426 WeakPolarHBondContact O-CG2 3.45Å; R422-V426 PolarHBondContact O-N 3.23Å; K423-V426 PolarHBondContact O-N 2.76Å; A424-V426 PolarHBondContact O-N 3.42Å; V426-A428 VanDerWaalsContact C-N 3.34Å; V426-A428 PolarHBondContact O-N 2.88Å; V426-A429 PolarHBondContact O-N 3.25Å; V426-V430 WeakPolarHBondContact O-CG2 3.47Å; V426-V430 PolarHBondContact O-N 3.46Å
427	S	86.4	Confident	80.9	Confident	40 Å²	40	80.6 Å²	80.6	28%	0.28	44%	0.439	S	S	.	.	H	α-helix	trans	-60	-42.3	177.4	-63.6	0	0	0	0	112.2	C209 K423 A424 A429 V430 W431	C209-S427 WeakPolarHBondContact CB-OG 3.31Å; C209-S427 VanDerWaalsContact SG-CB 3.6Å; C209-S427 PolarHBondContact SG-OG 3.28Å; K423-S427 PolarHBondContact O-N 2.68Å; K423-S427 PolarHBondContact O-OG 2.94Å; A424-S427 PolarHBondContact O-N 2.95Å; S427-A429 PolarHBondContact O-N 2.95Å; S427-V430 PolarHBondContact O-N 2.95Å; S427-W431 PolarHBondContact O-N 3.14Å
428	A	86.3	Confident	78.2	Confident	53 Å²	53	85.2 Å²	85.2	44%	0.438	47%	0.473	S	S	.	.	H	α-helix	trans	-60.7	-43.6	175.8	0	0	0	0	0	112.3	A424 V426 W431 T432	A424-A428 WeakPolarHBondContact O-CB 3.49Å; A424-A428 PolarHBondContact O-N 3.13Å; V426-A428 VanDerWaalsContact C-N 3.34Å; V426-A428 PolarHBondContact O-N 2.88Å; A428-W431 PolarHBondContact O-N 3.36Å; A428-T432 PolarHBondContact O-N 3.48Å; A428-T432 PolarHBondContact O-OG1 3.27Å
429	A	83.9	Confident	75.5	Confident	48 Å²	48	87.8 Å²	87.8	40%	0.397	50%	0.499	S	S	.	.	H	α-helix	trans	-64.7	-40	178	0	0	0	0	0	112.8	A425 V426 S427 W431 T432 N433	A425-A429 PolarHBondContact O-N 3.33Å; A425-A429 VanDerWaalsContact O-N 3.14Å; V426-A429 PolarHBondContact O-N 3.25Å; S427-A429 PolarHBondContact O-N 2.95Å; A429-W431 VanDerWaalsContact C-N 3.35Å; A429-T432 WeakPolarHBondContact CA-OG1 3.44Å; A429-T432 PolarHBondContact O-N 3.03Å; A429-T432 PolarHBondContact O-OG1 3.24Å; A429-N433 PolarHBondContact O-N 3.12Å; A429-N433 VanDerWaalsContact O-N 3.12Å
430	V	80.8	Confident	72.9	Confident	90 Å²	90	91.1 Å²	91.1	55%	0.545	52%	0.524	S	S	.	.	H	α-helix	trans	-62.6	-43	173.2	172.6	0	0	0	0	110.6	V426 S427 N433 R434	V426-V430 WeakPolarHBondContact O-CG2 3.47Å; V426-V430 PolarHBondContact O-N 3.46Å; S427-V430 PolarHBondContact O-N 2.95Å; V430-N433 PolarHBondContact O-N 3.46Å; V430-R434 WeakPolarHBondContact O-CB 3.43Å; V430-R434 PolarHBondContact O-N 3.4Å
431	W	70.8	Confident	70	Confident	150 Å²	150	96 Å²	96	57%	0.568	56%	0.558	S	S	*	*	H	α-helix	trans	-63.9	-41.6	178.3	-163	-79	0	0	0	112.6	S427 A428 A429 R434 S435	S427-W431 PolarHBondContact O-N 3.14Å; A428-W431 PolarHBondContact O-N 3.36Å; A429-W431 VanDerWaalsContact C-N 3.35Å; W431-R434 PolarHBondContact O-N 3.24Å; W431-S435 WeakPolarHBondContact O-CB 3.5Å; W431-S435 PolarHBondContact O-N 3.34Å; W431-S435 VanDerWaalsContact O-N 3.08Å; W431-S435 PolarHBondContact O-OG 3.46Å
432	T	72.2	Confident	67.5	Low	84 Å²	84	98.9 Å²	98.9	52%	0.515	58%	0.583	S	S	.	*	H	α-helix	trans	-63.2	-43.7	175.7	46.7	0	0	0	0	112.1	A428 A429 R434 S435 T436	A428-T432 PolarHBondContact O-N 3.48Å; A428-T432 PolarHBondContact O-OG1 3.27Å; A429-T432 WeakPolarHBondContact CA-OG1 3.44Å; A429-T432 PolarHBondContact O-N 3.03Å; A429-T432 PolarHBondContact O-OG1 3.24Å; T432-R434 VanDerWaalsContact C-N 3.29Å; T432-R434 PolarHBondContact O-N 2.84Å; T432-S435 WeakPolarHBondContact O-CB 3.48Å; T432-S435 PolarHBondContact O-N 3.38Å; T432-T436 PolarHBondContact O-N 3.37Å
433	N	65.6	Low	64.7	Low	121 Å²	121	97.4 Å²	97.4	65%	0.647	60%	0.595	S	S	*	*	H	α-helix	trans	-65.1	-33.1	178.1	-70.8	-13	0	0	0	112.5	A429 V430 S435 T436	A429-N433 PolarHBondContact O-N 3.12Å; A429-N433 VanDerWaalsContact O-N 3.12Å; V430-N433 PolarHBondContact O-N 3.46Å; N433-S435 VanDerWaalsContact C-N 3.29Å; N433-T436 PolarHBondContact O-OG1 3.08Å
434	R	56.9	Low	61.9	Low	210 Å²	210	99.7 Å²	99.7	79%	0.792	62%	0.617	S	S	*	*	H	α-helix	trans	-77.2	-14.4	175.3	-164	169.1	-177.3	-98.8	4.9	113.3	V430 W431 T432	V430-R434 WeakPolarHBondContact O-CB 3.43Å; V430-R434 PolarHBondContact O-N 3.4Å; W431-R434 PolarHBondContact O-N 3.24Å; T432-R434 VanDerWaalsContact C-N 3.29Å; T432-R434 PolarHBondContact O-N 2.84Å
435	S	54.6	Low	59.6	Low	76 Å²	76	104.9 Å²	104.9	53%	0.531	65%	0.649	S	S	.	*	H	α-helix	trans	-91.9	-15.6	179.1	-58.5	0	0	0	0	113.5	W431 T432 N433 P437	W431-S435 WeakPolarHBondContact O-CB 3.5Å; W431-S435 PolarHBondContact O-N 3.34Å; W431-S435 VanDerWaalsContact O-N 3.08Å; W431-S435 PolarHBondContact O-OG 3.46Å; T432-S435 WeakPolarHBondContact O-CB 3.48Å; T432-S435 PolarHBondContact O-N 3.38Å; N433-S435 VanDerWaalsContact C-N 3.29Å; S435-P437 WeakPolarHBondContact O-CD 3.41Å
436	T	43.6	Very low	56.6	Low	99 Å²	99	107.2 Å²	107.2	61%	0.607	66%	0.661	S	S	*	*	S	Bend	trans	-87.6	113.4	173.1	46.7	0	0	0	0	111.1	T432 N433 S438	T432-T436 PolarHBondContact O-N 3.37Å; N433-T436 PolarHBondContact O-OG1 3.08Å; T436-S438 PolarHBondContact O-N 2.84Å
437	P	47	Very low	54.3	Low	125 Å²	125	109 Å²	109	81%	0.812	68%	0.675	S	S	*	*			trans	-69.7	116.7	175.6	28.1	-33.2	0	0	0	110.3	S435 S439	S435-P437 WeakPolarHBondContact O-CD 3.41Å; P437-S439 PolarHBondContact O-N 2.87Å
438	S	42.3	Very low	51.8	Low	110 Å²	110	113.6 Å²	113.6	77%	0.769	70%	0.701	S	S	*	*			trans	-63.8	114.9	175.9	55.9	0	0	0	0	110.6	T436 S440	T436-S438 PolarHBondContact O-N 2.84Å; S438-S440 PolarHBondContact O-N 3.21Å
439	S	42	Very low	49.3	Very low	118 Å²	118	119.1 Å²	119.1	83%	0.825	72%	0.722	S	S	*	*			trans	-71.1	88.6	176.8	57.2	0	0	0	0	111.1	P437 S441	P437-S439 PolarHBondContact O-N 2.87Å; S439-S441 PolarHBondContact O-N 3Å
440	S	41.2	Very low	46.9	Very low	110 Å²	110	128.2 Å²	128.2	77%	0.769	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-68.4	124.8	176.6	56.9	0	0	0	0	111.5	S438	S438-S440 PolarHBondContact O-N 3.21Å
441	S	37.5	Very low	44.5	Very low	106 Å²	106	128.8 Å²	128.8	74%	0.741	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-54.5	152.2	176.9	-54.7	0	0	0	0	113.3	S439 S443	S439-S441 PolarHBondContact O-N 3Å; S441-S443 PolarHBondContact O-N 2.9Å
442	P	43.8	Very low	42.7	Very low	130 Å²	130	131 Å²	131	84%	0.844	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-70	127.8	-170.1	27.2	-35.3	0	0	0	113.8
443	S	37	Very low	40.6	Very low	119 Å²	119	133.7 Å²	133.7	83%	0.832	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-71.5	145.5	175.1	-49.9	0	0	0	0	112.9	S441	S441-S443 PolarHBondContact O-N 2.9Å
444	T	33.9	Very low	38.9	Very low	134 Å²	134	131.8 Å²	131.8	82%	0.822	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-71.1	146.3	171	37.6	0	0	0	0	112.2
445	P	43.2	Very low	37.7	Very low	125 Å²	125	127.4 Å²	127.4	81%	0.812	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-85.4	141.5	-175.6	33.1	-34.9	0	0	0	113.1
446	S	29.2	Very low	36.6	Very low	114 Å²	114	132.6 Å²	132.6	80%	0.797	80%	0.804	S	S	*	*			trans	-108	147.8	159.8	-73.2	0	0	0	0	110.1
447	P	42.4	Very low	36	Very low	127 Å²	127	132 Å²	132	83%	0.825	81%	0.809	S	S	*	*			trans	-80.4	155.8	-167.6	32.1	-36.4	0	0	0	113.4
448	T	33.6	Very low	35.3	Very low	137 Å²	137	134.1 Å²	134.1	84%	0.84	81%	0.814	S	S	*	*			trans	-140.2	138.2	166.4	-60.9	0	0	0	0	109.9
449	I	34.3	Very low	34.7	Very low	169 Å²	169	132 Å²	132	87%	0.867	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-79.9	133.8	-170.3	-63.8	172.6	0	0	0	110.8
450	R	31.9	Very low	34.2	Very low	239 Å²	239	135.7 Å²	135.7	90%	0.902	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-86.3	124.8	171	-83	-171.9	172.8	-170.7	-1.4	112
451	A	30.6	Very low	33.9	Very low	102 Å²	102	134.5 Å²	134.5	84%	0.843	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-77.8	166	153.2	0	0	0	0	0	111
452	K	33.1	Very low	34.4	Very low	197 Å²	197	135.9 Å²	135.9	86%	0.857	82%	0.816	S	S	*	*			trans	-123.8	134.8	-172.8	-60.5	175.1	-178.9	174.7	0	112.9
453	T	28.9	Very low	33.9	Very low	139 Å²	139	139.1 Å²	139.1	85%	0.853	82%	0.817	S	S	*	*			trans	-177.4	138.1	138.5	32.4	0	0	0	0	106.8
454	A	30.5	Very low	34.2	Very low	82 Å²	82	139.3 Å²	139.3	68%	0.678	82%	0.815	S	S	*	*			cis	75	128.4	46	0	0	0	0	0	112.2
455	T	30.1	Very low	34.2	Very low	118 Å²	118	141.3 Å²	141.3	72%	0.724	82%	0.815	S	S	*	*			cis	-164.1	159.1	6.8	-5.1	0	0	0	0	112.4
456	Q	32.3	Very low	34.2	Very low	184 Å²	184	141.3 Å²	141.3	86%	0.86	82%	0.815	S	S	*	*			trans	47.9	152.2	149.9	-69.2	174.8	20.1	0	0	121.6
457	A	30.5	Very low	34.1	Very low	87 Å²	87	139 Å²	139	72%	0.719	81%	0.809	S	S	*	*			cis	167.1	148.6	-19.9	0	0	0	0	0	108.2
458	N	32.3	Very low	34.6	Very low	170 Å²	170	138.9 Å²	138.9	91%	0.909	81%	0.808	S	S	*	*			trans	79.3	141.2	144.7	-151.7	18.4	0	0	0	122
459	G	29.7	Very low	35.5	Very low	65 Å²	65	137.9 Å²	137.9	67%	0.67	80%	0.804	S	S	*	*			trans	157.8	62.5	164.2	0	0	0	0	0	123.6
460	H	31.9	Very low	35.6	Very low	196 Å²	196	138.6 Å²	138.6	91%	0.907	80%	0.803	S	S	*	*			trans	70.2	165.5	149.5	-92.1	60.3	0	0	0	123.5
461	A	35.8	Very low	35.7	Very low	85 Å²	85	136.3 Å²	136.3	70%	0.702	80%	0.803	S	S	*	*			trans	-145	175.8	-177.4	0	0	0	0	0	110.8
462	P	47.1	Very low	35.8	Very low	134 Å²	134	134.5 Å²	134.5	87%	0.87	80%	0.795	S	S	*	*				-155	-169.5	84.9	41.1	-19.3	0	0	0	118
463	K	33.2	Very low	35.9	Very low	198 Å²	198	134 Å²	134	86%	0.861	80%	0.799	S	S	*	*			trans	-79.2	-178	-179.6	-95.3	-179.7	178.6	179.2	0	114.4
464	P	43.5	Very low	36	Very low	123 Å²	123	130.7 Å²	130.7	80%	0.799	79%	0.793	S	S	*	*			cis	-141.5	-174.4	19	38	-14.1	0	0	0	120.3
465	Q	34.5	Very low	36.2	Very low	177 Å²	177	134.1 Å²	134.1	83%	0.827	80%	0.8	S	S	*	*			trans	-61.5	-179	179.1	-103.8	-178.5	-16.9	0	0	118.2
466	P	43.1	Very low	36.4	Very low	125 Å²	125	136 Å²	136	81%	0.812	81%	0.805	S	S	*	*			cis	-140.9	178.2	31.6	41.4	-20.4	0	0	0	120.2
467	G	26.6	Very low	36.9	Very low	64 Å²	64	133.1 Å²	133.1	66%	0.66	80%	0.802	S	S	*	*			trans	-96.4	-135.8	170.1	0	0	0	0	0	112.4
468	P	52.3	Low	37.6	Very low	126 Å²	126	133.1 Å²	133.1	82%	0.818	80%	0.802	S	S	*	*			cis	-117.7	-144.9	8	42.2	-23.9	0	0	0	110.1
469	P	52.8	Low	38.1	Very low	116 Å²	116	130.8 Å²	130.8	75%	0.753	80%	0.796	S	S	*	*			cis	-128.7	-148.8	-4.6	43	-22.6	0	0	0	114.5
470	H	36.8	Very low	39.2	Very low	183 Å²	183	133.2 Å²	133.2	85%	0.847	80%	0.8	S	S	*	*			trans	-153.1	158.5	-168	-92.1	-90.2	0	0	0	115.2
471	Q	34.6	Very low	39.9	Very low	191 Å²	191	129.4 Å²	129.4	89%	0.893	79%	0.793	S	S	*	*			trans	-144.8	168.1	137.4	-61.8	-169.8	3.1	0	0	107
472	G	33.3	Very low	40.1	Very low	65 Å²	65	133.8 Å²	133.8	67%	0.67	80%	0.804	S	S	*	*			cis	131.2	133.1	-6.5	0	0	0	0	0	112.1
473	I	34.1	Very low	39.7	Very low	185 Å²	185	134.1 Å²	134.1	95%	0.949	80%	0.798	S	S	*	*			cis	-154.3	146.1	-8.6	-50.8	176	0	0	0	107.8
474	G	31.2	Very low	40.4	Very low	71 Å²	71	134 Å²	134	73%	0.732	80%	0.8	S	S	*	*			trans	178.6	151.7	170.9	0	0	0	0	0	116.1
475	N	35.3	Very low	40.5	Very low	154 Å²	154	135 Å²	135	82%	0.824	80%	0.798	S	S	*	*			trans	-138.9	136.6	-170.6	-109.6	2.6	0	0	0	113.9
476	L	32.9	Very low	41.1	Very low	158 Å²	158	134.3 Å²	134.3	83%	0.827	80%	0.799	S	S	*	*			trans	63.9	165.7	154.9	-62	173	0	0	0	118.5
477	P	43.3	Very low	41.7	Very low	122 Å²	122	133.5 Å²	133.5	79%	0.792	79%	0.794	S	S	*	*			cis	-120	-175.1	-2.9	42	-28.9	0	0	0	114.6
478	A	44.8	Very low	43.2	Very low	88 Å²	88	136 Å²	136	73%	0.727	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-87.5	158.6	172.9	0	0	0	0	0	112.8
479	P	44.5	Very low	43.6	Very low	120 Å²	120	135.6 Å²	135.6	78%	0.779	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-74.4	154.5	178.5	31.1	-36.2	0	0	0	113.6
480	P	52.4	Low	43.9	Very low	117 Å²	117	135.5 Å²	135.5	76%	0.76	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-79.7	162.8	178.2	34.2	-36.4	0	0	0	113
481	P	46.4	Very low	45	Very low	116 Å²	116	132.8 Å²	132.8	75%	0.753	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-72.9	154.8	173.9	31.8	-36	0	0	0	112.7
482	L	38.8	Very low	46.1	Very low	176 Å²	176	130.8 Å²	130.8	92%	0.921	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-75.5	120.6	170.6	-71.9	166.1	0	0	0	110.4
483	N	39	Very low	47	Very low	141 Å²	141	133.3 Å²	133.3	75%	0.754	79%	0.794	S	S	*	*			trans	-105.8	121.5	163.4	-81.7	-6.3	0	0	0	108.9	I485	N483-I485 HydrophobicContact CB-CD1 4.37Å; N483-I485 PolarHBondContact O-N 2.59Å
484	E	49.3	Very low	48	Very low	195 Å²	195	132.4 Å²	132.4	91%	0.911	79%	0.789	S	S	*	*			trans	-76.9	106.2	171.1	-67.9	-170.8	144.1	0	0	111
485	I	45.4	Very low	48.9	Very low	144 Å²	144	136.2 Å²	136.2	74%	0.738	79%	0.792	S	S	*	*			trans	-133.6	116.5	153.4	-69.4	91.9	0	0	0	107.3	N483	N483-I485 HydrophobicContact CB-CD1 4.37Å; N483-I485 PolarHBondContact O-N 2.59Å
486	L	46.9	Very low	49.9	Very low	163 Å²	163	134 Å²	134	85%	0.853	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-73	133.2	169.3	-75.9	165.2	0	0	0	109.8
487	P	54.8	Low	51	Low	109 Å²	109	132.2 Å²	132.2	71%	0.708	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-69.1	148.9	164.3	31	-33.4	0	0	0	110
488	P	58.8	Low	51.4	Low	117 Å²	117	131.8 Å²	131.8	76%	0.76	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-65.2	154.7	173.3	29.1	-35	0	0	0	111.3
489	P	59.9	Low	51.7	Low	117 Å²	117	133.3 Å²	133.3	76%	0.76	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-63.9	152.4	178.7	27.7	-35.3	0	0	0	112
490	P	60.2	Low	51.8	Low	114 Å²	114	133.4 Å²	133.4	74%	0.74	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-66.3	149.9	174.2	30	-35.3	0	0	0	111.1
491	P	59.1	Low	51.2	Low	126 Å²	126	133.9 Å²	133.9	82%	0.818	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-69.4	152.1	174.2	30.4	-35.3	0	0	0	111.7
492	D	57.9	Low	50.7	Low	149 Å²	149	136.7 Å²	136.7	80%	0.797	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-60	146.4	-178.4	-68.2	-63.4	0	0	0	113.4	I494	D492-I494 PolarHBondContact O-N 2.87Å; D492-I494 VanDerWaalsContact O-N 3.09Å
493	P	52.2	Low	50.6	Low	117 Å²	117	132.4 Å²	132.4	76%	0.76	79%	0.788	S	S	*	*			trans	-65.4	110.4	178	-20.4	33.1	0	0	0	112.5	L495	P493-L495 PolarHBondContact O-N 3.44Å; P493-L495 VanDerWaalsContact O-N 3.08Å
494	I	53.8	Low	50.5	Low	167 Å²	167	131 Å²	131	86%	0.856	79%	0.789	S	S	*	*			trans	-67.6	107.5	168.9	-60.8	175.4	0	0	0	108.5	D492	D492-I494 PolarHBondContact O-N 2.87Å; D492-I494 VanDerWaalsContact O-N 3.09Å
495	L	50.4	Low	49.9	Very low	150 Å²	150	131.4 Å²	131.4	79%	0.785	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-67.9	133	174.4	-69.1	171.2	0	0	0	110.5	P493	P493-L495 PolarHBondContact O-N 3.44Å; P493-L495 VanDerWaalsContact O-N 3.08Å
496	P	56.8	Low	49.6	Very low	109 Å²	109	129.8 Å²	129.8	71%	0.708	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-67.7	148.9	169.5	29.8	-34.1	0	0	0	110.4
497	P	55.9	Low	49.2	Very low	119 Å²	119	128.2 Å²	128.2	77%	0.773	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-65.5	147.1	179.5	27.8	-34.9	0	0	0	111.7
498	P	51.8	Low	48.2	Very low	114 Å²	114	130.6 Å²	130.6	74%	0.74	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-68.5	147.6	-179.2	28.7	-35.2	0	0	0	111.9
499	P	52.3	Low	47.2	Very low	119 Å²	119	130.5 Å²	130.5	77%	0.773	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-66.2	150.6	172.8	29.2	-34.8	0	0	0	111.3
500	P	45.6	Very low	46	Very low	123 Å²	123	132 Å²	132	80%	0.799	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-68	143.9	-175.3	27.8	-35.2	0	0	0	112.8	L502	P500-L502 PolarHBondContact O-N 2.78Å
501	S	39	Very low	45	Very low	127 Å²	127	135.8 Å²	135.8	89%	0.888	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-71.9	119.2	177.4	43.8	0	0	0	0	111.9
502	L	37	Very low	44.4	Very low	175 Å²	175	135.1 Å²	135.1	92%	0.916	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-98.1	118.6	176.6	-111.9	165.6	0	0	0	110.7	P500	P500-L502 PolarHBondContact O-N 2.78Å
503	A	35.9	Very low	44.2	Very low	85 Å²	85	133.5 Å²	133.5	70%	0.702	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-81.7	132.3	-176.8	0	0	0	0	0	113
504	S	36.6	Very low	43.9	Very low	112 Å²	112	133.2 Å²	133.2	78%	0.783	79%	0.792	S	S	*	*			trans	21.8	114.8	149.8	60.4	0	0	0	0	119.5
505	K	36.9	Very low	43.6	Very low	204 Å²	204	131.3 Å²	131.3	89%	0.887	79%	0.791	S	S	*	*			trans	-142.1	159.7	150	-105.4	175.9	-176.3	176.6	0	110.6
506	P	39.3	Very low	43.2	Very low	110 Å²	110	132.1 Å²	132.1	71%	0.714	80%	0.795	S	S	*	*			trans	-77.6	165.7	-157.1	30.6	-36.8	0	0	0	114.9
507	P	38.2	Very low	42.4	Very low	130 Å²	130	132.2 Å²	132.2	84%	0.844	80%	0.798	S	S	*	*			trans	-71.1	142.2	-173.8	29	-36.5	0	0	0	113.5
508	L	33.6	Very low	41.8	Very low	159 Å²	159	135.2 Å²	135.2	83%	0.832	80%	0.804	S	S	*	*			trans	-110.5	122.8	166.7	-84.6	166.7	0	0	0	110	N510	L508-N510 PolarHBondContact O-N 3.42Å
509	S	39.2	Very low	41.5	Very low	114 Å²	114	137.5 Å²	137.5	80%	0.797	81%	0.81	S	S	*	*			trans	-87.7	88.7	-177.5	54.4	0	0	0	0	111.6
510	N	34.6	Very low	41.5	Very low	149 Å²	149	135.3 Å²	135.3	80%	0.797	81%	0.809	S	S	*	*			trans	-107.4	68.8	175.6	-87.2	57.5	0	0	0	112.1	L508	L508-N510 PolarHBondContact O-N 3.42Å
511	F	38.3	Very low	41.6	Very low	194 Å²	194	137.3 Å²	137.3	85%	0.851	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-76.4	140.3	152.6	-82.3	-86.7	0	0	0	108.8
512	P	46.3	Very low	42.4	Very low	111 Å²	111	136.6 Å²	136.6	72%	0.721	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-67.2	140.3	169.6	29.2	-33.5	0	0	0	110
513	P	53.7	Low	43.6	Very low	115 Å²	115	133.8 Å²	133.8	75%	0.747	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-69.6	149.8	176.7	29.7	-34.7	0	0	0	111.2
514	P	45.9	Very low	44.6	Very low	111 Å²	111	135.3 Å²	135.3	72%	0.721	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-66.5	151.7	170	30.3	-34.9	0	0	0	110.7
515	P	48.3	Very low	45.8	Very low	128 Å²	128	135.6 Å²	135.6	83%	0.831	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-65.4	139.9	176.6	28	-34.3	0	0	0	111.3
516	L	41.9	Very low	47.3	Very low	167 Å²	167	131.4 Å²	131.4	87%	0.874	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-75.5	149.2	174.5	-71.3	168.7	0	0	0	111.4	M518	L516-M518 PolarHBondContact O-N 2.95Å
517	S	41.1	Very low	48.1	Very low	111 Å²	111	131.7 Å²	131.7	78%	0.776	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-59.9	130.6	175	-50.1	0	0	0	0	111.7
518	M	41.6	Very low	49.1	Very low	181 Å²	181	131 Å²	131	89%	0.892	79%	0.79	S	S	*	*			trans	-107.1	93	166.5	-74.2	-75	-81.6	0	0	108.8	L516	L516-M518 PolarHBondContact O-N 2.95Å
519	D	46	Very low	49.9	Very low	162 Å²	162	129 Å²	129	87%	0.866	79%	0.787	S	S	*	*			trans	-67.5	141.2	161.5	-83.6	-64.6	0	0	0	109.9
520	G	51.7	Low	50.3	Low	73 Å²	73	132.3 Å²	132.3	75%	0.753	79%	0.792	S	S	*	*			trans	103.2	52.4	167.3	0	0	0	0	0	117.4
521	L	47.6	Very low	50.6	Low	165 Å²	165	132.6 Å²	132.6	86%	0.864	79%	0.793	S	S	*	*			trans	-124.6	139.4	154.7	-71.9	177.2	0	0	0	110.3
522	P	57.2	Low	50.7	Low	112 Å²	112	129.8 Å²	129.8	73%	0.727	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-74.4	153.4	-177.6	31	-35.4	0	0	0	112.4
523	P	62.1	Low	50.2	Low	117 Å²	117	134 Å²	134	76%	0.76	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-69.9	153.4	179.6	29.6	-35.6	0	0	0	112.6
524	P	56.8	Low	49.4	Very low	116 Å²	116	133.1 Å²	133.1	75%	0.753	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-68.5	155.8	175.5	30.1	-35.6	0	0	0	112.3
525	P	61.4	Low	49	Very low	118 Å²	118	136.4 Å²	136.4	77%	0.766	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-70.1	150.7	-178.4	29.4	-35.7	0	0	0	112.8
526	P	67.8	Low	48.6	Very low	116 Å²	116	138 Å²	138	75%	0.753	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-72.9	156.8	177.1	31.3	-35.8	0	0	0	112.6
527	P	57.9	Low	49	Very low	116 Å²	116	135.7 Å²	135.7	75%	0.753	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-68.7	157.4	172.9	30.5	-35.6	0	0	0	112.2
528	P	58.5	Low	49.4	Very low	116 Å²	116	135.9 Å²	135.9	75%	0.753	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-70.4	155.1	179.8	30.3	-36.1	0	0	0	112.7
529	P	50.3	Low	49.7	Very low	118 Å²	118	134 Å²	134	77%	0.766	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-72	152.4	177.6	31.4	-35.7	0	0	0	112.4
530	M	46.6	Very low	49.5	Very low	183 Å²	183	136.4 Å²	136.4	90%	0.901	79%	0.788	S	S	*	*			trans	-122.3	118.1	167.8	-80.4	-76.5	-68.3	0	0	108	N532	M530-N532 PolarHBondContact O-N 2.65Å; M530-N532 VanDerWaalsContact O-N 3.13Å
531	D	42.6	Very low	49.6	Very low	155 Å²	155	140.2 Å²	140.2	83%	0.829	79%	0.791	S	S	*	*			trans	-76.7	101.2	-178.1	-75.4	-55.8	0	0	0	112.3
532	N	39	Very low	50.1	Low	134 Å²	134	137.6 Å²	137.6	72%	0.717	78%	0.783	S	S	*	*				38.8	119.1	124.8	-165.1	26.2	0	0	0	119.8	M530	M530-N532 PolarHBondContact O-N 2.65Å; M530-N532 VanDerWaalsContact O-N 3.13Å
533	F	35.6	Very low	49.9	Very low	201 Å²	201	138 Å²	138	88%	0.882	79%	0.786	S	S	*	*			trans	-149.6	142.4	143.7	-97.7	-73	0	0	0	110.5
534	S	37.8	Very low	49.7	Very low	95 Å²	95	138.1 Å²	138.1	66%	0.664	79%	0.787	S	S	*	*			trans	-19.2	155.1	179	-43.6	0	0	0	0	119.5
535	E	36.3	Very low	49.7	Very low	181 Å²	181	138.1 Å²	138.1	85%	0.846	79%	0.787	S	S	*	*			cis	-168.5	146.3	40.8	-162.2	155.9	97.2	0	0	112.5
536	D	40.3	Very low	49.2	Very low	161 Å²	161	138 Å²	138	86%	0.861	79%	0.786	S	S	*	*			trans	-97	143.6	-177.7	-74.5	-58	0	0	0	114.7
537	P	51.2	Low	48.2	Very low	119 Å²	119	138.3 Å²	138.3	77%	0.773	79%	0.788	S	S	*	*			trans	-128.9	163.6	144.9	34.3	-20.2	0	0	0	113.4
538	P	49.6	Very low	47.3	Very low	115 Å²	115	139.2 Å²	139.2	75%	0.747	79%	0.792	S	S	*	*			trans	-106.9	166.5	-130.2	39	-39.5	0	0	0	118.5
539	D	48	Very low	46.4	Very low	142 Å²	142	139 Å²	139	76%	0.759	79%	0.793	S	S	*	*			trans	27	108.1	154.1	-77.2	-44.4	0	0	0	119.8
540	F	42.3	Very low	45.8	Very low	211 Å²	211	143.5 Å²	143.5	93%	0.925	80%	0.796	S	S	*	*			trans	-134.5	110.9	145	-109.5	-91.6	0	0	0	110
541	L	53.1	Low	45.4	Very low	153 Å²	153	140.2 Å²	140.2	80%	0.801	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-70.1	130	178.9	-66.4	172.9	0	0	0	111
542	P	57.9	Low	45.3	Very low	110 Å²	110	138.4 Å²	138.4	71%	0.714	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-72.5	147.7	170.9	30.5	-34	0	0	0	111.1
543	P	52.5	Low	45.4	Very low	121 Å²	121	139.7 Å²	139.7	79%	0.786	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-68.8	151.1	178.4	29.2	-35.2	0	0	0	112.1
544	P	58.7	Low	46.1	Very low	119 Å²	119	135.4 Å²	135.4	77%	0.773	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-69.6	149	-177.5	29	-35.6	0	0	0	112.6
545	P	56.6	Low	46.7	Very low	116 Å²	116	136.4 Å²	136.4	75%	0.753	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-71.1	148.9	176.6	30.2	-35.2	0	0	0	112
546	P	51.5	Low	47.3	Very low	115 Å²	115	133.3 Å²	133.3	75%	0.747	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-69.8	150.3	175.6	30	-35.1	0	0	0	111.9
547	P	45.9	Very low	47.7	Very low	124 Å²	124	131.6 Å²	131.6	81%	0.805	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-72.1	140.6	-174.1	28.9	-35.5	0	0	0	113.4	S549	P547-S549 PolarHBondContact O-N 2.88Å
548	T	39.4	Very low	47.6	Very low	135 Å²	135	130.4 Å²	130.4	83%	0.828	79%	0.787	S	S	*	*			trans	-81.1	89.9	176.9	42.2	0	0	0	0	112.3
549	S	38.8	Very low	47.3	Very low	110 Å²	110	131.1 Å²	131.1	77%	0.769	79%	0.791	S	S	*	*			trans	-88.3	105.3	169.2	59.8	0	0	0	0	111.6	P547	P547-S549 PolarHBondContact O-N 2.88Å
550	Y	38.7	Very low	47.1	Very low	214 Å²	214	128.7 Å²	128.7	84%	0.839	79%	0.791	S	S	*	*			trans	-67.7	127.6	166.9	-84.8	-103	0	0	0	110.6
551	S	37.7	Very low	46.8	Very low	113 Å²	113	124.7 Å²	124.7	79%	0.79	79%	0.786	S	S	*	*			trans	-149	105.8	161.5	-84.5	0	0	0	0	109.3	L553	S551-L553 PolarHBondContact O-N 2.7Å
552	S	39.8	Very low	45.9	Very low	118 Å²	118	122.4 Å²	122.4	83%	0.825	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-74.5	120.7	-178.3	-54.2	0	0	0	0	111.2
553	L	42.1	Very low	44.7	Very low	160 Å²	160	121.6 Å²	121.6	84%	0.838	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-103.7	139.7	164.5	-68.1	175.7	0	0	0	109.6	S551	S551-L553 PolarHBondContact O-N 2.7Å
554	P	49.5	Very low	43.9	Very low	111 Å²	111	123.6 Å²	123.6	72%	0.721	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-71.7	152.6	-178.4	30.3	-35.3	0	0	0	111.8
555	P	50.3	Low	42.7	Very low	117 Å²	117	127.6 Å²	127.6	76%	0.76	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.9	150	176.9	29.7	-35.2	0	0	0	111.9
556	P	50.3	Low	41.4	Very low	116 Å²	116	125.9 Å²	125.9	75%	0.753	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-67.2	154.3	172.9	29.9	-35.3	0	0	0	111.6
557	P	48.8	Very low	40.3	Very low	125 Å²	125	123.5 Å²	123.5	81%	0.812	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.1	150.5	-178.9	28.7	-35.4	0	0	0	112.7
558	A	49	Very low	39.8	Very low	94 Å²	94	125.3 Å²	125.3	78%	0.777	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-70.1	149.4	176.5	0	0	0	0	0	112.2
559	P	41.4	Very low	39.5	Very low	129 Å²	129	126.5 Å²	126.5	84%	0.838	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-69.9	140.6	178.4	28.9	-34.9	0	0	0	112.4
560	A	44	Very low	39.6	Very low	91 Å²	91	128.6 Å²	128.6	75%	0.752	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-71.4	153.9	172.6	0	0	0	0	0	111.9
561	P	37.6	Very low	39.4	Very low	127 Å²	127	127.7 Å²	127.7	83%	0.825	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-69.4	146.2	-176.2	28.4	-35.6	0	0	0	112.8
562	A	32.3	Very low	39.8	Very low	105 Å²	105	128.1 Å²	128.1	87%	0.868	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-68.9	131.6	179.5	0	0	0	0	0	112.3
563	A	34.3	Very low	39.9	Very low	93 Å²	93	130.1 Å²	130.1	77%	0.769	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-86.4	132.7	169.5	0	0	0	0	0	110.5	F565	A563-F565 PolarHBondContact O-N 2.77Å
564	N	35.4	Very low	40.4	Very low	163 Å²	163	127.9 Å²	127.9	87%	0.872	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-67.6	126.1	172.8	-97.5	-19	0	0	0	111
565	F	32.5	Very low	40.5	Very low	203 Å²	203	128 Å²	128	89%	0.89	81%	0.806	S	S	*	*			trans	-140.2	116.8	154.5	-108.2	-84.9	0	0	0	109.9	A563	A563-F565 PolarHBondContact O-N 2.77Å
566	G	29.3	Very low	40.5	Very low	80 Å²	80	127.9 Å²	127.9	83%	0.825	81%	0.806	S	S	*	*			trans	-92.6	137.7	167	0	0	0	0	0	109.8
567	G	30	Very low	40.6	Very low	65 Å²	65	128 Å²	128	67%	0.67	81%	0.806	S	S	*	*			trans	-177	78.7	-173.6	0	0	0	0	0	114.6
568	N	33.6	Very low	40.8	Very low	162 Å²	162	127.9 Å²	127.9	87%	0.866	81%	0.806	S	S	*	*			trans	6.1	110	150.7	-168.3	21.5	0	0	0	117.4
569	I	33.8	Very low	40.5	Very low	161 Å²	161	130.6 Å²	130.6	83%	0.826	81%	0.807	S	S	*	*			trans	-132.8	110	167.6	24.2	172.9	0	0	0	111.4
570	N	40.5	Very low	40.7	Very low	154 Å²	154	130.4 Å²	130.4	82%	0.824	81%	0.806	S	S	*	*			trans	-122.7	85	164.5	-170.8	-3.5	0	0	0	108.2
571	K	35.1	Very low	40.9	Very low	195 Å²	195	133.9 Å²	133.9	85%	0.848	81%	0.806	S	S	*	*			trans	-170	125.2	170	-112.1	168.2	-174.8	179.5	0	110
572	S	46.4	Very low	41.3	Very low	121 Å²	121	137.6 Å²	137.6	85%	0.846	81%	0.81	S	S	*	*			trans	-69.8	141.8	175.2	-49	0	0	0	0	111.6
573	L	41.5	Very low	41.9	Very low	161 Å²	161	140.4 Å²	140.4	84%	0.843	81%	0.809	S	S	*	*			trans	-129.1	145	161.8	-72	174	0	0	0	108.3
574	P	52.3	Low	42.6	Very low	112 Å²	112	141.2 Å²	141.2	73%	0.727	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-68.9	155.5	176.9	30.3	-35.2	0	0	0	111.3
575	P	53.1	Low	43.5	Very low	115 Å²	115	139.1 Å²	139.1	75%	0.747	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-65.1	148.2	175.5	28.5	-35	0	0	0	111.4
576	P	49	Very low	44.5	Very low	114 Å²	114	134.8 Å²	134.8	74%	0.74	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-68.3	154.4	174	30.4	-35.3	0	0	0	111.4
577	P	52.7	Low	45.6	Very low	117 Å²	117	136.2 Å²	136.2	76%	0.76	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-65.7	149.6	174.5	29.1	-35.2	0	0	0	111.5
578	P	53.3	Low	46.6	Very low	124 Å²	124	139.2 Å²	139.2	81%	0.805	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-69.3	146	177.1	29.3	-34.7	0	0	0	111.9
579	N	41.8	Very low	47.3	Very low	150 Å²	150	138.5 Å²	138.5	80%	0.802	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-68.1	144.5	173	-99.8	-7.1	0	0	0	111.2	E581	N579-E581 VanDerWaalsContact C-N 3.25Å; N579-E581 PolarHBondContact O-N 3.14Å
580	P	46.9	Very low	47.5	Very low	126 Å²	126	135.9 Å²	135.9	82%	0.818	79%	0.786	S	S	*	*	S	Bend	trans	-85.2	41.2	-171.3	36.7	-38.8	0	0	0	114.4
581	E	46.9	Very low	47.4	Very low	164 Å²	164	134.8 Å²	134.8	77%	0.766	79%	0.785	S	S	*	*			trans	-127.9	148.1	170.5	-68.1	-169.2	133.6	0	0	110.1	N579	N579-E581 VanDerWaalsContact C-N 3.25Å; N579-E581 PolarHBondContact O-N 3.14Å
582	F	46.7	Very low	47.4	Very low	205 Å²	205	134.7 Å²	134.7	90%	0.899	79%	0.785	S	S	*	*			trans	69.1	58.8	-167.8	-61.8	-86.3	0	0	0	116.2
583	L	43.9	Very low	47	Very low	163 Å²	163	134.9 Å²	134.9	85%	0.853	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-76.5	141.2	147	-66	176.8	0	0	0	109.7
584	P	49.9	Very low	46.8	Very low	111 Å²	111	132 Å²	132	72%	0.721	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-68.4	150.7	165.3	31	-34	0	0	0	110.3
585	P	53.8	Low	46.3	Very low	118 Å²	118	132 Å²	132	77%	0.766	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-66.6	147.6	179.2	28.4	-35	0	0	0	111.7
586	P	54.6	Low	45.7	Very low	112 Å²	112	130.1 Å²	130.1	73%	0.727	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-66.5	158.7	174.1	29.8	-35.5	0	0	0	111.7
587	P	51.5	Low	45.6	Very low	110 Å²	110	129.3 Å²	129.3	71%	0.714	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-63.1	151.3	168.8	29.8	-35.3	0	0	0	110.6
588	P	51.6	Low	45.6	Very low	128 Å²	128	129.4 Å²	129.4	83%	0.831	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-71.8	133.9	178.6	29.5	-34.3	0	0	0	111.7
589	D	48.8	Very low	45.5	Very low	147 Å²	147	129.1 Å²	129.1	79%	0.786	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-64.8	149.5	173.3	-77.1	-56.1	0	0	0	112.6	V591	D589-V591 PolarHBondContact O-N 2.95Å
590	P	37	Very low	46.3	Very low	106 Å²	106	127.5 Å²	127.5	69%	0.688	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-70.2	121.8	-178.1	28.1	-34.5	0	0	0	112.1	F592	P590-F592 PolarHBondContact O-N 3.04Å; P590-F592 VanDerWaalsContact O-N 3.1Å
591	V	38.7	Very low	47.1	Very low	132 Å²	132	127 Å²	127	80%	0.8	78%	0.781	S	S	*	*			trans	-70	106	177.8	-173.9	0	0	0	0	110.6	D589 V593	D589-V591 PolarHBondContact O-N 2.95Å; V591-V593 HydrophobicContact CG1-CG2 3.97Å; V591-V593 PolarHBondContact O-N 3.37Å
592	F	36.1	Very low	47.6	Very low	193 Å²	193	124.8 Å²	124.8	85%	0.846	78%	0.78	S	S	*	*			trans	-70.8	111.5	168.4	-96.8	-95.1	0	0	0	110.8	P590	P590-F592 PolarHBondContact O-N 3.04Å; P590-F592 VanDerWaalsContact O-N 3.1Å
593	V	37.4	Very low	48.4	Very low	125 Å²	125	120.7 Å²	120.7	76%	0.758	77%	0.774	S	S	*	*			trans	-113.8	109.3	165.7	-174.5	0	0	0	0	108.4	V591	V591-V593 HydrophobicContact CG1-CG2 3.97Å; V591-V593 PolarHBondContact O-N 3.37Å
594	A	36.2	Very low	49.2	Very low	99 Å²	99	118.4 Å²	118.4	82%	0.818	77%	0.769	S	S	*	*			trans	-100	91.7	-171.7	0	0	0	0	0	112.9
595	S	41.6	Very low	49.5	Very low	114 Å²	114	118.7 Å²	118.7	80%	0.797	77%	0.771	S	S	*	*			trans	-173.1	127.1	154.5	55.4	0	0	0	0	113
596	G	40.9	Very low	49.6	Very low	75 Å²	75	118.7 Å²	118.7	77%	0.773	77%	0.771	S	S	*	*			trans	123.1	77.8	153.8	0	0	0	0	0	119
597	A	48.2	Very low	49.4	Very low	97 Å²	97	119.4 Å²	119.4	80%	0.802	78%	0.775	S	S	*	*			trans	62.7	149.6	157.1	0	0	0	0	0	119.8
598	P	52.6	Low	49.1	Very low	118 Å²	118	119 Å²	119	77%	0.766	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-76.6	153.3	170.5	32.9	-35.1	0	0	0	111.9
599	P	51.2	Low	48.6	Very low	118 Å²	118	117.4 Å²	117.4	77%	0.766	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-69	151	176.2	29.8	-35.4	0	0	0	112.1
600	P	58.1	Low	48.1	Very low	117 Å²	117	117.4 Å²	117.4	76%	0.76	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-69	152.9	176.3	29.9	-35.4	0	0	0	112
601	P	63.7	Low	48.2	Very low	116 Å²	116	117.8 Å²	117.8	75%	0.753	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-66.3	155.1	176.4	28.9	-35.5	0	0	0	112.1
602	P	57.6	Low	48.1	Very low	117 Å²	117	116 Å²	116	76%	0.76	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-65	150.5	179.1	27.9	-35.4	0	0	0	112.2
603	P	62.1	Low	48.4	Very low	119 Å²	119	112.9 Å²	112.9	77%	0.773	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-68	149.4	-179.7	28.9	-35.4	0	0	0	112.2
604	P	61.9	Low	48.4	Very low	114 Å²	114	118.5 Å²	118.5	74%	0.74	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-68.6	155.2	178	29.6	-35.6	0	0	0	112.3
605	P	55.4	Low	48.6	Very low	117 Å²	117	119.9 Å²	119.9	76%	0.76	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-65.5	151.4	177.2	28.3	-35.3	0	0	0	112.2
606	P	57.4	Low	48.2	Very low	118 Å²	118	119.2 Å²	119.2	77%	0.766	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-68.5	148.8	-177.4	28.6	-35.4	0	0	0	112.5
607	P	48.7	Very low	48	Very low	127 Å²	127	120 Å²	120	83%	0.825	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-69.5	146.5	-179.9	29.2	-35.3	0	0	0	112.3	A609	P607-A609 PolarHBondContact O-N 3.24Å
608	A	45.6	Very low	47.3	Very low	101 Å²	101	124.8 Å²	124.8	84%	0.835	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-68.2	127	178.3	0	0	0	0	0	111.8
609	A	40.6	Very low	46.5	Very low	96 Å²	96	127.6 Å²	127.6	79%	0.793	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-77.5	134.1	178.3	0	0	0	0	0	112.1	P607	P607-A609 PolarHBondContact O-N 3.24Å
610	V	39.5	Very low	45.8	Very low	146 Å²	146	131.2 Å²	131.2	89%	0.885	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-71.3	140.8	178.1	-177.7	0	0	0	0	110.6
611	S	38.9	Very low	44.7	Very low	114 Å²	114	135.6 Å²	135.6	80%	0.797	82%	0.815	S	S	*	*			trans	-128.5	130.8	180	58.6	0	0	0	0	113.2
612	A	36	Very low	43.5	Very low	94 Å²	94	138.6 Å²	138.6	78%	0.777	82%	0.822	S	S	*	*			trans	-168.6	159.3	172.3	0	0	0	0	0	109.8
613	P	43.6	Very low	42.7	Very low	128 Å²	128	138.3 Å²	138.3	83%	0.831	82%	0.82	S	S	*	*			cis	-125.9	175.7	-35.6	37.4	-23.9	0	0	0	111.9
614	R	36.8	Very low	41.8	Very low	244 Å²	244	138.7 Å²	138.7	92%	0.921	82%	0.822	S	S	*	*			trans	-137.7	148.8	166.1	-132.4	177	-171	-123.5	2.4	110.6
615	P	40	Very low	41	Very low	127 Å²	127	137.5 Å²	137.5	83%	0.825	82%	0.822	S	S	*	*			trans	-75.7	160.4	-166.7	-19.4	34.4	0	0	0	116.3
616	A	34	Very low	40.2	Very low	100 Å²	100	137.4 Å²	137.4	83%	0.826	82%	0.822	S	S	*	*			trans	-77.7	176.5	170.2	0	0	0	0	0	111.7
617	A	35.9	Very low	39.4	Very low	91 Å²	91	137.7 Å²	137.7	75%	0.752	82%	0.823	S	S	*	*			cis	-148	-175.5	16.2	0	0	0	0	0	109.7
618	Q	34.3	Very low	39	Very low	198 Å²	198	141.7 Å²	141.7	93%	0.925	83%	0.828	S	S	*	*			cis	-144.8	-169.4	32.9	-67.1	-176.5	-9.5	0	0	113.4
619	Q	35.8	Very low	38.2	Very low	178 Å²	178	148.3 Å²	148.3	83%	0.832	83%	0.831	S	S	*	*			trans	-104.6	154.6	-156.5	-52	164.2	-35.5	0	0	115.5
620	K	34.9	Very low	37.9	Very low	194 Å²	194	149.8 Å²	149.8	84%	0.843	83%	0.83	S	S	*	*				-179.1	139.6	115.9	-98.6	158.4	-172.3	171.4	0	115.6
621	K	35.7	Very low	37.4	Very low	208 Å²	208	149.4 Å²	149.4	90%	0.904	83%	0.828	S	S	*	*			trans	59.6	126.2	160.3	-65.9	-170.3	174.4	-174	0	120.1
622	M	38.1	Very low	36.9	Very low	180 Å²	180	149 Å²	149	89%	0.887	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-92.8	152.5	166.1	-70.1	160.6	53.5	0	0	112
623	P	41.7	Very low	36.8	Very low	110 Å²	110	151.6 Å²	151.6	71%	0.714	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-81.3	163.4	157.7	35.3	-33.4	0	0	0	111.9
624	P	43.2	Very low	36.2	Very low	127 Å²	127	153.4 Å²	153.4	83%	0.825	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-78.5	161.7	-179.7	33	-36.1	0	0	0	113.7
625	A	45.3	Very low	35.7	Very low	90 Å²	90	150.6 Å²	150.6	74%	0.744	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-74.4	150.2	177.1	0	0	0	0	0	112.6
626	P	38.8	Very low	35.4	Very low	115 Å²	115	148.5 Å²	148.5	75%	0.747	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-70.4	143.8	-179.7	28.9	-35.2	0	0	0	112.3
627	P	39.1	Very low	35	Very low	123 Å²	123	147.3 Å²	147.3	80%	0.799	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-72.9	139.4	179.4	29.8	-34.5	0	0	0	112	R629	P627-R629 PolarHBondContact O-N 3.07Å
628	K	40.8	Very low	34.6	Very low	212 Å²	212	146.8 Å²	146.8	92%	0.922	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-66.4	120	169	-64.2	-179.1	179.6	-178.4	0	109
629	R	29.2	Very low	34.5	Very low	240 Å²	240	141.6 Å²	141.6	91%	0.906	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-86.9	117.7	174.3	-162.2	174.3	-166.1	172.7	4.7	109.9	P627	P627-R629 PolarHBondContact O-N 3.07Å
630	T	33.9	Very low	34.3	Very low	127 Å²	127	136.2 Å²	136.2	78%	0.779	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-67.8	143.5	168.8	32.7	0	0	0	0	110.8	P632	T630-P632 WeakPolarHBondContact O-CD 3.48Å
631	T	29.7	Very low	34.5	Very low	137 Å²	137	130.9 Å²	130.9	84%	0.84	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-82.3	122.6	175.8	-25.7	0	0	0	0	110.5
632	P	29	Very low	34.8	Very low	106 Å²	106	122.8 Å²	122.8	69%	0.688	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-84.1	130.4	155.5	2.2	17.8	0	0	0	108.4	T630 L634	T630-P632 WeakPolarHBondContact O-CD 3.48Å; P632-L634 PolarHBondContact O-N 3.11Å
633	T	33.3	Very low	35.5	Very low	149 Å²	149	117.5 Å²	117.5	91%	0.914	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-65.2	121.4	165.1	41.9	0	0	0	0	109.4
634	L	30	Very low	36.3	Very low	165 Å²	165	114.8 Å²	114.8	86%	0.864	75%	0.751	S	S	*	*			trans	-114	138.2	170.9	-118.2	161	0	0	0	108	P632	P632-L634 PolarHBondContact O-N 3.11Å
635	Q	27.7	Very low	36.8	Very low	186 Å²	186	111.8 Å²	111.8	87%	0.869	73%	0.727	S	S	*	*			trans	-63.9	145.2	-173.6	-71.7	161.9	-83.6	0	0	111.6	G637	Q635-G637 PolarHBondContact O-N 3.48Å
636	G	33	Very low	37.4	Very low	83 Å²	83	110.6 Å²	110.6	86%	0.856	71%	0.713	S	S	*	*			trans	-67.7	112.3	172	0	0	0	0	0	111
637	G	25.8	Very low	38.8	Very low	75 Å²	75	107.5 Å²	107.5	77%	0.773	69%	0.689	S	S	*	*			trans	-91.2	122	154.7	0	0	0	0	0	108.2	Q635 G639	Q635-G637 PolarHBondContact O-N 3.48Å; G637-G639 PolarHBondContact O-N 3.35Å
638	G	26.5	Very low	40.1	Very low	80 Å²	80	101.7 Å²	101.7	83%	0.825	65%	0.651	S	S	*	*			trans	-64.7	132.5	-177.9	0	0	0	0	0	111.9	G640	G638-G640 PolarHBondContact O-N 2.86Å
639	G	32.5	Very low	41.3	Very low	88 Å²	88	96.1 Å²	96.1	91%	0.907	63%	0.629	S	S	*	*			trans	-73.8	68	170.7	0	0	0	0	0	111.4	G637	G637-G639 PolarHBondContact O-N 3.35Å
640	G	33.1	Very low	43	Very low	66 Å²	66	86.9 Å²	86.9	68%	0.68	60%	0.601	S	S	*	*			trans	-68	131.7	170.4	0	0	0	0	0	110	G638 G642	G638-G640 PolarHBondContact O-N 2.86Å; G640-G642 PolarHBondContact O-N 2.73Å
641	G	39	Very low	44.5	Very low	82 Å²	82	80.9 Å²	80.9	85%	0.845	56%	0.564	S	S	*	*			trans	-63.3	108.3	166.4	0	0	0	0	0	108.7	D643	G641-D643 PolarHBondContact O-N 3.07Å
642	G	41.2	Very low	46.2	Very low	37 Å²	37	76.7 Å²	76.7	38%	0.381	54%	0.536	S	S	.	.			trans	-60.4	128.2	-179.8	0	0	0	0	0	110.2	G640	G640-G642 PolarHBondContact O-N 2.73Å
643	D	53.4	Low	47.8	Very low	69 Å²	69	79 Å²	79	37%	0.369	53%	0.531	S	S	.	.			trans	-68.1	143.7	168.6	-174.6	56.7	0	0	0	109.3	R36 G641 M645 S646 E647	R36-D643 IonicContact CZ-OD1 3.84Å; R36-D643 IonicContact NH1-OD1 2.98Å; R36-D643 IonicContact NH2-OD1 3.25Å; R36-D643 PolarHBondContact NH2-OD1 3.44Å; G641-D643 PolarHBondContact O-N 3.07Å; D643-M645 PolarHBondContact O-N 3.07Å; D643-M645 VanDerWaalsContact O-N 3.11Å; D643-M645 WeakPolarHBondContact OD2-CB 3.46Å; D643-M645 WeakPolarHBondContact OD2-CG 3.38Å; D643-S646 PolarHBondContact N-OG 3.07Å; D643-S646 WeakPolarHBondContact O-CA 3.35Å; D643-S646 WeakPolarHBondContact O-CB 3.28Å; D643-S646 PolarHBondContact O-N 3.23Å; D643-S646 PolarHBondContact O-OG 3.11Å; D643-E647 PolarHBondContact O-N 2.9Å
644	F	58.6	Low	49.1	Very low	53 Å²	53	77.5 Å²	77.5	23%	0.232	51%	0.512	C	S	.	.	H	α-helix	trans	-53.4	-39.1	-172.3	178.2	-100.5	0	0	0	112.4	L52 L63 S646 E647 L648	L52-F644 HydrophobicContact CD1-CE2 4.41Å; L52-F644 HydrophobicContact CD2-CE2 4.45Å; L63-F644 HydrophobicContact CD1-CE1 4.44Å; L63-F644 HydrophobicContact CD1-CZ 4.31Å; L63-F644 HydrophobicContact CD2-CZ 4.12Å; F644-S646 VanDerWaalsContact C-N 3.28Å; F644-S646 PolarHBondContact O-N 3.46Å; F644-E647 PolarHBondContact O-N 3.19Å; F644-L648 HydrophobicContact CE1-CD2 4.28Å; F644-L648 WeakPolarHBondContact O-CB 3.29Å; F644-L648 PolarHBondContact O-N 3.34Å; F644-L648 VanDerWaalsContact O-N 3.08Å
645	M	53.5	Low	50.5	Low	65 Å²	65	72.3 Å²	72.3	32%	0.32	48%	0.481	S	S	.	.	H	α-helix	trans	-55.3	-41.7	173.4	-65.1	-59.7	-67	0	0	113	L67 L71 D643 M649	L67-M645 HydrophobicContact CD1-CE 4.11Å; L67-M645 HydrophobicContact CD1-SD 3.56Å; L67-M645 VanDerWaalsContact CD1-SD 3.56Å; L67-M645 HydrophobicContact CD2-CE 3.83Å; L67-M645 HydrophobicContact CD2-SD 3.65Å; L67-M645 HydrophobicContact CG-CE 4.19Å; L67-M645 HydrophobicContact CG-SD 4.09Å; L71-M645 HydrophobicContact CD1-CE 4.03Å; D643-M645 PolarHBondContact O-N 3.07Å; D643-M645 VanDerWaalsContact O-N 3.11Å; D643-M645 WeakPolarHBondContact OD2-CB 3.46Å; D643-M645 WeakPolarHBondContact OD2-CG 3.38Å; M645-M649 WeakPolarHBondContact O-CB 3.36Å; M645-M649 WeakPolarHBondContact O-CG 3.41Å; M645-M649 PolarHBondContact O-N 3.44Å
646	S	57.6	Low	51.6	Low	65 Å²	65	68.7 Å²	68.7	46%	0.455	47%	0.471	S	S	.	.	H	α-helix	trans	-74.8	-35.4	-174.9	72.7	0	0	0	0	112.8	D643 F644 S650	D643-S646 PolarHBondContact N-OG 3.07Å; D643-S646 WeakPolarHBondContact O-CA 3.35Å; D643-S646 WeakPolarHBondContact O-CB 3.28Å; D643-S646 PolarHBondContact O-N 3.23Å; D643-S646 PolarHBondContact O-OG 3.11Å; F644-S646 VanDerWaalsContact C-N 3.28Å; F644-S646 PolarHBondContact O-N 3.46Å; S646-S650 WeakPolarHBondContact O-CB 3.49Å; S646-S650 PolarHBondContact O-N 3.45Å; S646-S650 VanDerWaalsContact O-N 3.15Å
647	E	67.8	Low	52.2	Low	50 Å²	50	71.6 Å²	71.6	23%	0.234	47%	0.467	C	S	.	.	H	α-helix	trans	-71.8	-44.2	175.1	-63	-159.6	163.7	0	0	111.2	L48 N49 L52 D643 F644 M649 S650 A651	L48-E647 WeakPolarHBondContact CB-OE2 3.34Å; N49-E647 WeakPolarHBondContact CA-OE2 3.18Å; N49-E647 HydrophobicContact CB-CB 4.23Å; N49-E647 HydrophobicContact CB-CG 4.33Å; N49-E647 WeakPolarHBondContact CB-OE2 3.42Å; N49-E647 PolarHBondContact N-OE2 2.93Å; L52-E647 HydrophobicContact CD1-CB 4.45Å; D643-E647 PolarHBondContact O-N 2.9Å; F644-E647 PolarHBondContact O-N 3.19Å; E647-M649 PolarHBondContact O-N 3.35Å; E647-S650 WeakPolarHBondContact O-CA 3.33Å; E647-S650 WeakPolarHBondContact O-CB 3.3Å; E647-S650 PolarHBondContact O-N 2.86Å; E647-A651 PolarHBondContact O-N 3.39Å
648	L	67.5	Low	52.8	Low	1 Å²	1	78 Å²	78	1%	0.005	48%	0.477	C	S	.	.	H	α-helix	trans	-59.1	-47.4	175.3	-177.6	60.4	0	0	0	112.1	L52 L60 L63 M64 L67 F644 S650 A651 M652	L52-L648 HydrophobicContact CD1-CB 4.05Å; L52-L648 HydrophobicContact CD1-CD1 4.22Å; L52-L648 HydrophobicContact CD2-CD1 4.27Å; L60-L648 HydrophobicContact CD1-CD1 3.55Å; L63-L648 HydrophobicContact CD2-CD1 3.87Å; L63-L648 HydrophobicContact CD2-CD2 4.16Å; L63-L648 HydrophobicContact CG-CD2 4.2Å; M64-L648 HydrophobicContact SD-CD1 4.22Å; M64-L648 HydrophobicContact SD-CD2 3.7Å; M64-L648 HydrophobicContact SD-CG 3.79Å; L67-L648 HydrophobicContact CD2-CD2 3.49Å; L67-L648 VanDerWaalsContact CD2-CD2 3.49Å; F644-L648 HydrophobicContact CE1-CD2 4.28Å; F644-L648 WeakPolarHBondContact O-CB 3.29Å; F644-L648 PolarHBondContact O-N 3.34Å; F644-L648 VanDerWaalsContact O-N 3.08Å; L648-S650 PolarHBondContact O-N 2.97Å; L648-A651 PolarHBondContact O-N 2.74Å; L648-M652 WeakPolarHBondContact O-CG 3.36Å; L648-M652 PolarHBondContact O-N 3.44Å; L648-M652 VanDerWaalsContact O-N 3.07Å
649	M	64.8	Low	54.1	Low	94 Å²	94	77.9 Å²	77.9	46%	0.463	46%	0.459	S	S	.	.	H	α-helix	trans	-67.3	-11.1	173.8	-73.8	-92.7	-84	0	0	114	M645 E647 R653	M645-M649 WeakPolarHBondContact O-CB 3.36Å; M645-M649 WeakPolarHBondContact O-CG 3.41Å; M645-M649 PolarHBondContact O-N 3.44Å; E647-M649 PolarHBondContact O-N 3.35Å; M649-R653 PolarHBondContact O-NE 3.08Å; M649-R653 PolarHBondContact O-NH2 2.99Å; M649-R653 VanDerWaalsContact O-NH2 3.13Å
650	S	65.9	Low	55.2	Low	46 Å²	46	77.3 Å²	77.3	32%	0.322	44%	0.436	S	S	.	.	H	α-helix	trans	-92.3	-41.4	172.7	-163	0	0	0	0	111.5	S646 E647 L648 R653 K654	S646-S650 WeakPolarHBondContact O-CB 3.49Å; S646-S650 PolarHBondContact O-N 3.45Å; S646-S650 VanDerWaalsContact O-N 3.15Å; E647-S650 WeakPolarHBondContact O-CA 3.33Å; E647-S650 WeakPolarHBondContact O-CB 3.3Å; E647-S650 PolarHBondContact O-N 2.86Å; L648-S650 PolarHBondContact O-N 2.97Å; S650-R653 PolarHBondContact O-N 2.98Å; S650-K654 PolarHBondContact O-N 3.28Å
651	A	64.1	Low	56.5	Low	1 Å²	1	77.9 Å²	77.9	1%	0.008	42%	0.422	C	S	.	.	H	α-helix	trans	-60.1	-47	175.1	0	0	0	0	0	111.6	L52 E647 L648 R653 K654 R655	L52-A651 HydrophobicContact CB-CB 4.32Å; E647-A651 PolarHBondContact O-N 3.39Å; L648-A651 PolarHBondContact O-N 2.74Å; A651-R653 PolarHBondContact O-N 3.32Å; A651-K654 PolarHBondContact O-N 2.96Å; A651-R655 PolarHBondContact O-N 2.97Å
652	M	65.5	Low	57.5	Low	49 Å²	49	77.7 Å²	77.7	24%	0.241	40%	0.397	C	S	.	.	H	α-helix	trans	-54.7	-53.9	176	-76.1	-115.4	73.2	0	0	112.5	L60 M64 L648 K654 R655 T656	L60-M652 HydrophobicContact CD2-CE 4.21Å; M64-M652 HydrophobicContact CE-SD 4.03Å; M64-M652 HydrophobicContact CG-SD 3.77Å; M64-M652 HydrophobicContact SD-CG 4.34Å; M64-M652 HydrophobicContact SD-SD 4.02Å; L648-M652 WeakPolarHBondContact O-CG 3.36Å; L648-M652 PolarHBondContact O-N 3.44Å; L648-M652 VanDerWaalsContact O-N 3.07Å; M652-K654 VanDerWaalsContact C-N 3.29Å; M652-K654 PolarHBondContact O-N 3.39Å; M652-R655 PolarHBondContact O-N 3.37Å; M652-T656 PolarHBondContact O-N 2.87Å; M652-T656 VanDerWaalsContact O-N 3.14Å; M652-T656 PolarHBondContact O-OG1 3.2Å; M652-T656 VanDerWaalsContact O-OG1 3.09Å
653	R	64.1	Low	58.5	Low	155 Å²	155	80.3 Å²	80.3	59%	0.585	40%	0.398	S	S	*	.	H	α-helix	trans	-60	-37.7	-176.9	-82.1	179.8	-83.9	-159.7	-4.4	112.6	M649 S650 A651 R655 T656 D657	M649-R653 PolarHBondContact O-NE 3.08Å; M649-R653 PolarHBondContact O-NH2 2.99Å; M649-R653 VanDerWaalsContact O-NH2 3.13Å; S650-R653 PolarHBondContact O-N 2.98Å; A651-R653 PolarHBondContact O-N 3.32Å; R653-R655 VanDerWaalsContact C-N 3.27Å; R653-R655 PolarHBondContact O-N 3.41Å; R653-T656 PolarHBondContact O-N 3.47Å; R653-D657 PolarHBondContact O-N 3.3Å
654	K	60.5	Low	58.8	Low	117 Å²	117	81 Å²	81	51%	0.509	40%	0.4	S	S	.	.	H	α-helix	trans	-69.3	-17.1	175.4	-74.9	-179.7	177.3	173.3	0	115	S650 A651 M652 Q658	S650-K654 PolarHBondContact O-N 3.28Å; A651-K654 PolarHBondContact O-N 2.96Å; M652-K654 VanDerWaalsContact C-N 3.29Å; M652-K654 PolarHBondContact O-N 3.39Å; K654-Q658 PolarHBondContact O-NE2 3.13Å
655	R	58.2	Low	58.9	Low	57 Å²	57	83 Å²	83	22%	0.215	41%	0.412	C	S	.	.	H	α-helix	trans	-90.1	-24.7	170.6	-71.3	-169.1	-178.8	177	3.8	112.8	H53 L55 D57 A651 M652 R653 D657	H53-R655 PolarHBondContact O-NH2 3.28Å; L55-R655 PolarHBondContact O-NH1 3.43Å; L55-R655 PolarHBondContact O-NH2 3.09Å; D57-R655 IonicContact OD1-CZ 2.6Å; D57-R655 IonicContact OD1-NE 3.68Å; D57-R655 IonicContact OD1-NH1 2.74Å; D57-R655 PolarHBondContact OD1-NH1 3.43Å; A651-R655 PolarHBondContact O-N 2.97Å; M652-R655 PolarHBondContact O-N 3.37Å; R653-R655 VanDerWaalsContact C-N 3.27Å; R653-R655 PolarHBondContact O-N 3.41Å; R655-D657 VanDerWaalsContact C-N 3.31Å
656	T	52.1	Low	59.3	Low	109 Å²	109	84.4 Å²	84.4	67%	0.669	42%	0.419	S	S	*	.	H	α-helix	trans	-74.4	-21.3	175.5	-34.5	0	0	0	0	113.2	M652 R653	M652-T656 PolarHBondContact O-N 2.87Å; M652-T656 VanDerWaalsContact O-N 3.14Å; M652-T656 PolarHBondContact O-OG1 3.2Å; M652-T656 VanDerWaalsContact O-OG1 3.09Å; R653-T656 PolarHBondContact O-N 3.47Å
657	D	44	Very low	59.4	Low	144 Å²	144	86 Å²	86	77%	0.77	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	19.2	179.2	-66	-30.4	0	0	0	113.7	R653 R655	R653-D657 PolarHBondContact O-N 3.3Å; R655-D657 VanDerWaalsContact C-N 3.31Å
658	Q	38.6	Very low	58.7	Low	209 Å²	209	89.3 Å²	89.3	98%	0.977	43%	0.433	S	S	*	.			trans	-127.7	0	178.9	-81.6	178.3	86.9	0	0	112.5	K654	K654-Q658 PolarHBondContact O-NE2 3.13Å

Retrieved 658 of 658 residues in 1329.4 ms (Link to these results)

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