A0A3Q0KG85_SCHMA Loading...

SH2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KG85, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 470 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.6	Very low	36.5	Very low	242 Å²	242	160.2 Å²	160.2	100%	1.192	83%	0.829	S	S	*	*				0	84.2	0	-65	170.6	177.3	0	0	105.5
2	R	29.2	Very low	36.4	Very low	240 Å²	240	161.2 Å²	161.2	91%	0.906	82%	0.823	S	S	*	*				51.4	120	60.6	-134.7	-176.6	-161.9	175	5.1	112.3
3	L	34.3	Very low	36.4	Very low	144 Å²	144	163 Å²	163	75%	0.754	82%	0.822	S	S	*	*			trans	133.7	120.6	157.4	-68.6	147.4	0	0	0	107.5
4	E	37.5	Very low	36.2	Very low	174 Å²	174	162.8 Å²	162.8	81%	0.813	83%	0.825	S	S	*	*			cis	-166.1	144.2	10.2	-125.4	170	-168.6	0	0	111.3
5	H	37.4	Very low	36.4	Very low	180 Å²	180	164.5 Å²	164.5	83%	0.833	83%	0.828	S	S	*	*			trans	-76	147.3	167	-83.5	-95	0	0	0	110.8
6	S	36.7	Very low	36.3	Very low	115 Å²	115	158.3 Å²	158.3	80%	0.804	82%	0.818	S	S	*	*			trans	176.6	146.5	138.2	-98.2	0	0	0	0	110.5
7	S	35.8	Very low	36.1	Very low	90 Å²	90	157 Å²	157	63%	0.629	82%	0.819	S	S	*	*	S	Bend	cis	-176.6	87.5	1	44.9	0	0	0	0	107.7
8	V	36.2	Very low	35.8	Very low	136 Å²	136	153.9 Å²	153.9	82%	0.824	81%	0.813	S	S	*	*	S	Bend	trans	-145.1	31.8	166.5	-157	0	0	0	0	111.7
9	Q	38.7	Very low	35.7	Very low	190 Å²	190	151.4 Å²	151.4	89%	0.888	81%	0.809	S	S	*	*	S	Bend	trans	-113.8	8.9	174.4	-88.8	-174.6	-12.7	0	0	113.9
10	S	35.5	Very low	35.7	Very low	103 Å²	103	150.9 Å²	150.9	72%	0.72	81%	0.805	S	S	*	*			trans	-104.8	20.2	-171.7	58.9	0	0	0	0	115.7
11	I	37.1	Very low	35.7	Very low	148 Å²	148	152 Å²	152	76%	0.759	81%	0.81	S	S	*	*	S	Bend	trans	-97.3	-5.9	177.4	-63.6	176.4	0	0	0	112.8
12	F	35.6	Very low	35.5	Very low	172 Å²	172	147.8 Å²	147.8	75%	0.754	79%	0.786	S	S	*	*	S	Bend	trans	-105.1	120.1	174.1	-71.4	-80.1	0	0	0	109.8
13	F	36.8	Very low	36	Very low	185 Å²	185	141.7 Å²	141.7	81%	0.811	77%	0.771	S	S	*	*			trans	81.6	56.8	164.2	-55.9	-78.2	0	0	0	118.2
14	N	33.8	Very low	36.6	Very low	160 Å²	160	142.1 Å²	142.1	86%	0.856	77%	0.772	S	S	*	*			trans	-88.8	92.8	133.9	-98.8	-25.7	0	0	0	107.4
15	H	38.8	Very low	37.1	Very low	188 Å²	188	137.4 Å²	137.4	87%	0.87	76%	0.757	S	S	*	*	S	Bend	trans	-169.2	128.3	143.3	-99.3	-67.2	0	0	0	108.4
16	G	34.5	Very low	37.6	Very low	65 Å²	65	132.8 Å²	132.8	67%	0.67	74%	0.738	S	S	*	*			trans	-63.5	142.4	-167.7	0	0	0	0	0	114.2
17	V	32.7	Very low	38	Very low	137 Å²	137	134 Å²	134	83%	0.83	74%	0.735	S	S	*	*				44.3	110	126.4	-157.5	0	0	0	0	115.3
18	S	31.6	Very low	38.7	Very low	102 Å²	102	132.6 Å²	132.6	71%	0.713	73%	0.728	S	S	*	*				-175	120.5	112.6	-80	0	0	0	0	110.5
19	S	32.5	Very low	39.5	Very low	105 Å²	105	132 Å²	132	73%	0.734	72%	0.716	S	S	*	*			trans	41	99.8	142.3	57.5	0	0	0	0	116.7
20	L	37.4	Very low	40.4	Very low	142 Å²	142	127 Å²	127	74%	0.743	70%	0.695	S	S	*	*			trans	-161.6	112.6	140.9	-97.4	151.3	0	0	0	107.1	F22	L20-F22 VanDerWaalsContact C-N 3.31Å; L20-F22 HydrophobicContact CB-CD2 3.75Å; L20-F22 HydrophobicContact CB-CE2 3.83Å; L20-F22 HydrophobicContact CD1-CE2 4.09Å; L20-F22 HydrophobicContact CD2-CD2 4.44Å; L20-F22 HydrophobicContact CD2-CE2 3.81Å; L20-F22 HydrophobicContact CD2-CZ 4.44Å; L20-F22 HydrophobicContact CG-CE2 4.09Å; L20-F22 PolarHBondContact O-N 3.42Å
21	L	35.2	Very low	41.9	Very low	174 Å²	174	125.8 Å²	125.8	91%	0.911	69%	0.686	S	S	*	*			trans	-55.6	98.1	162.5	-97.5	82.5	0	0	0	107
22	F	38.8	Very low	43.5	Very low	153 Å²	153	123.8 Å²	123.8	67%	0.671	68%	0.676	S	S	*	*			trans	-113.1	121.7	161.8	-86.1	-74.7	0	0	0	107.6	L20 I24	L20-F22 VanDerWaalsContact C-N 3.31Å; L20-F22 HydrophobicContact CB-CD2 3.75Å; L20-F22 HydrophobicContact CB-CE2 3.83Å; L20-F22 HydrophobicContact CD1-CE2 4.09Å; L20-F22 HydrophobicContact CD2-CD2 4.44Å; L20-F22 HydrophobicContact CD2-CE2 3.81Å; L20-F22 HydrophobicContact CD2-CZ 4.44Å; L20-F22 HydrophobicContact CG-CE2 4.09Å; L20-F22 PolarHBondContact O-N 3.42Å; F22-I24 PolarHBondContact O-N 3.02Å
23	D	39.4	Very low	45.2	Very low	112 Å²	112	119 Å²	119	60%	0.599	66%	0.661	S	S	*	*			trans	-50.9	123.1	-173.4	-61.3	-58.6	0	0	0	111.2	P25 I26	D23-P25 HydrophobicContact CB-CG 4.25Å; D23-P25 WeakPolarHBondContact O-CD 3.37Å; D23-I26 PolarHBondContact O-N 3.09Å; D23-I26 VanDerWaalsContact O-N 3.13Å
24	I	46.8	Very low	46.8	Very low	153 Å²	153	114.8 Å²	114.8	79%	0.785	65%	0.648	S	S	*	*	H	α-helix	trans	-49.2	-21.6	172.7	-62.4	169.7	0	0	0	114.9	F22 I26	F22-I24 PolarHBondContact O-N 3.02Å; I24-I26 PolarHBondContact O-N 3.49Å
25	P	47.7	Very low	48.6	Very low	76 Å²	76	112.5 Å²	112.5	49%	0.494	63%	0.634	S	S	.	*	H	α-helix	trans	-67	-29.1	174.3	-16.8	31.6	0	0	0	114.2	D23 Q29	D23-P25 HydrophobicContact CB-CG 4.25Å; D23-P25 WeakPolarHBondContact O-CD 3.37Å; P25-Q29 WeakPolarHBondContact O-CB 3.45Å; P25-Q29 VanDerWaalsContact O-CG 3.28Å; P25-Q29 WeakPolarHBondContact O-CG 3.16Å; P25-Q29 PolarHBondContact O-N 2.78Å
26	I	47.8	Very low	50.3	Low	83 Å²	83	107.2 Å²	107.2	43%	0.426	61%	0.612	S	S	.	*	H	α-helix	trans	-76.5	-39	-170.2	-57.3	175.6	0	0	0	110.9	D23 I24 Q29 I30	D23-I26 PolarHBondContact O-N 3.09Å; D23-I26 VanDerWaalsContact O-N 3.13Å; I24-I26 PolarHBondContact O-N 3.49Å; I26-Q29 PolarHBondContact O-N 3.08Å; I26-I30 HydrophobicContact CG2-CD1 4.05Å; I26-I30 WeakPolarHBondContact O-CD1 3.38Å; I26-I30 VanDerWaalsContact O-CG1 3.29Å; I26-I30 WeakPolarHBondContact O-CG1 3.36Å; I26-I30 PolarHBondContact O-N 2.85Å
27	L	44.2	Very low	52.2	Low	141 Å²	141	109.2 Å²	109.2	74%	0.738	61%	0.607	S	S	*	*	H	α-helix	trans	-69.4	-34.8	175.8	-132.9	77.8	0	0	0	111.9	S31	L27-S31 WeakPolarHBondContact O-CB 3.05Å; L27-S31 PolarHBondContact O-N 3.44Å; L27-S31 VanDerWaalsContact O-N 3.1Å
28	A	51.1	Low	54	Low	59 Å²	59	107.8 Å²	107.8	49%	0.488	59%	0.594	S	S	.	*	H	α-helix	trans	-68.6	-37.4	173	0	0	0	0	0	112	S31 L32	A28-S31 PolarHBondContact O-N 3.03Å; A28-L32 WeakPolarHBondContact O-CB 3.03Å; A28-L32 PolarHBondContact O-N 3.24Å
29	Q	53.6	Low	55.9	Low	123 Å²	123	109 Å²	109	58%	0.575	59%	0.587	S	S	*	*	H	α-helix	trans	-66.1	-41.2	174.7	-80.5	177.7	-1.2	0	0	112.3	P25 I26 S31 L32 T33	P25-Q29 WeakPolarHBondContact O-CB 3.45Å; P25-Q29 VanDerWaalsContact O-CG 3.28Å; P25-Q29 WeakPolarHBondContact O-CG 3.16Å; P25-Q29 PolarHBondContact O-N 2.78Å; I26-Q29 PolarHBondContact O-N 3.08Å; Q29-S31 VanDerWaalsContact C-N 3.33Å; Q29-S31 PolarHBondContact O-N 2.91Å; Q29-L32 PolarHBondContact O-N 3.04Å; Q29-T33 WeakPolarHBondContact O-CG2 3.44Å; Q29-T33 PolarHBondContact O-N 3.31Å; Q29-T33 PolarHBondContact O-OG1 2.8Å
30	I	58.3	Low	57.4	Low	86 Å²	86	110.6 Å²	110.6	44%	0.441	58%	0.581	S	S	.	*	H	α-helix	trans	-66.7	-36	176.8	-65.4	162.6	0	0	0	111.3	I26 T33 N34	I26-I30 HydrophobicContact CG2-CD1 4.05Å; I26-I30 WeakPolarHBondContact O-CD1 3.38Å; I26-I30 VanDerWaalsContact O-CG1 3.29Å; I26-I30 WeakPolarHBondContact O-CG1 3.36Å; I26-I30 PolarHBondContact O-N 2.85Å; I30-T33 WeakPolarHBondContact CA-OG1 3.44Å; I30-T33 PolarHBondContact O-OG1 2.79Å; I30-T33 VanDerWaalsContact O-OG1 3.13Å; I30-N34 WeakPolarHBondContact O-CB 3.36Å; I30-N34 VanDerWaalsContact O-CG 3.24Å; I30-N34 PolarHBondContact O-N 2.91Å; I30-N34 VanDerWaalsContact O-N 3.14Å; I30-N34 PolarHBondContact O-ND2 2.72Å
31	S	65.8	Low	58.5	Low	77 Å²	77	110.2 Å²	110.2	54%	0.538	58%	0.576	S	S	.	*	H	α-helix	trans	-64.1	-46.2	172.9	170.9	0	0	0	0	111.8	L27 A28 Q29 L35	L27-S31 WeakPolarHBondContact O-CB 3.05Å; L27-S31 PolarHBondContact O-N 3.44Å; L27-S31 VanDerWaalsContact O-N 3.1Å; A28-S31 PolarHBondContact O-N 3.03Å; Q29-S31 VanDerWaalsContact C-N 3.33Å; Q29-S31 PolarHBondContact O-N 2.91Å; S31-L35 WeakPolarHBondContact O-CB 3.42Å; S31-L35 PolarHBondContact O-N 3.44Å
32	L	70.2	Confident	59.8	Low	106 Å²	106	105.6 Å²	105.6	56%	0.555	55%	0.552	S	S	*	*	H	α-helix	trans	-67.2	-42.9	-179.9	-163.3	96.1	0	0	0	112	A28 Q29 L35 I36	A28-L32 WeakPolarHBondContact O-CB 3.03Å; A28-L32 PolarHBondContact O-N 3.24Å; Q29-L32 PolarHBondContact O-N 3.04Å; L32-L35 PolarHBondContact O-N 3Å; L32-I36 HydrophobicContact CD2-CD1 3.73Å; L32-I36 HydrophobicContact CG-CD1 3.88Å; L32-I36 HydrophobicContact CG-CG1 4.49Å; L32-I36 WeakPolarHBondContact O-CB 3.23Å; L32-I36 WeakPolarHBondContact O-CG1 3.16Å; L32-I36 PolarHBondContact O-N 3.17Å
33	T	72.5	Confident	60.7	Low	72 Å²	72	101.4 Å²	101.4	44%	0.442	54%	0.537	S	S	.	.	H	α-helix	trans	-65.6	-39.6	178.4	49.8	0	0	0	0	111.9	Q29 I30 L35 I36 L37	Q29-T33 WeakPolarHBondContact O-CG2 3.44Å; Q29-T33 PolarHBondContact O-N 3.31Å; Q29-T33 PolarHBondContact O-OG1 2.8Å; I30-T33 WeakPolarHBondContact CA-OG1 3.44Å; I30-T33 PolarHBondContact O-OG1 2.79Å; I30-T33 VanDerWaalsContact O-OG1 3.13Å; T33-L35 VanDerWaalsContact C-N 3.35Å; T33-I36 PolarHBondContact O-N 2.7Å; T33-L37 WeakPolarHBondContact O-CB 3.35Å; T33-L37 PolarHBondContact O-N 3.22Å
34	N	70.7	Confident	61.5	Low	97 Å²	97	99.6 Å²	99.6	52%	0.519	53%	0.533	S	S	.	.	H	α-helix	trans	-65.6	-38	174	-75.2	-33	0	0	0	112.1	I30 L38	I30-N34 WeakPolarHBondContact O-CB 3.36Å; I30-N34 VanDerWaalsContact O-CG 3.24Å; I30-N34 PolarHBondContact O-N 2.91Å; I30-N34 VanDerWaalsContact O-N 3.14Å; I30-N34 PolarHBondContact O-ND2 2.72Å; N34-L38 WeakPolarHBondContact O-CB 3.46Å; N34-L38 PolarHBondContact O-N 3.46Å
35	L	71.3	Confident	61.6	Low	111 Å²	111	93.8 Å²	93.8	58%	0.581	51%	0.505	S	S	*	.	H	α-helix	trans	-69.8	-38.9	176.4	-167	131.5	0	0	0	112.1	S31 L32 T33 L38 F39	S31-L35 WeakPolarHBondContact O-CB 3.42Å; S31-L35 PolarHBondContact O-N 3.44Å; L32-L35 PolarHBondContact O-N 3Å; T33-L35 VanDerWaalsContact C-N 3.35Å; L35-L38 PolarHBondContact O-N 3.2Å; L35-F39 WeakPolarHBondContact O-CB 3.37Å; L35-F39 PolarHBondContact O-N 3.16Å
36	I	74.5	Confident	61.6	Low	77 Å²	77	93.6 Å²	93.6	40%	0.395	50%	0.503	S	S	.	.	H	α-helix	trans	-65.7	-43.5	173.6	-69.4	164.4	0	0	0	110.6	L32 T33 L38 F39 F40	L32-I36 HydrophobicContact CD2-CD1 3.73Å; L32-I36 HydrophobicContact CG-CD1 3.88Å; L32-I36 HydrophobicContact CG-CG1 4.49Å; L32-I36 WeakPolarHBondContact O-CB 3.23Å; L32-I36 WeakPolarHBondContact O-CG1 3.16Å; L32-I36 PolarHBondContact O-N 3.17Å; T33-I36 PolarHBondContact O-N 2.7Å; I36-L38 VanDerWaalsContact C-N 3.34Å; I36-L38 PolarHBondContact O-N 3.17Å; I36-F39 PolarHBondContact O-N 2.88Å; I36-F40 HydrophobicContact CG2-CD2 3.7Å; I36-F40 HydrophobicContact CG2-CE2 3.92Å; I36-F40 WeakPolarHBondContact O-CB 3.42Å; I36-F40 WeakPolarHBondContact O-CD2 3.41Å; I36-F40 PolarHBondContact O-N 3.21Å
37	L	73.6	Confident	61.4	Low	107 Å²	107	95.5 Å²	95.5	56%	0.56	51%	0.514	S	S	*	.	H	α-helix	trans	-61.4	-42.1	174.6	-90.7	159.2	0	0	0	111.6	T33 F39 F40 M41	T33-L37 WeakPolarHBondContact O-CB 3.35Å; T33-L37 PolarHBondContact O-N 3.22Å; L37-F39 VanDerWaalsContact C-N 3.34Å; L37-F40 PolarHBondContact O-N 3.41Å; L37-M41 WeakPolarHBondContact O-CB 3.42Å; L37-M41 WeakPolarHBondContact O-CG 3.18Å; L37-M41 PolarHBondContact O-N 3.42Å
38	L	71.1	Confident	61.5	Low	108 Å²	108	89.5 Å²	89.5	57%	0.565	48%	0.484	S	S	*	.	H	α-helix	trans	-62.9	-42.2	174.5	-164	111.7	0	0	0	111.1	N34 L35 I36 M41 I42	N34-L38 WeakPolarHBondContact O-CB 3.46Å; N34-L38 PolarHBondContact O-N 3.46Å; L35-L38 PolarHBondContact O-N 3.2Å; I36-L38 VanDerWaalsContact C-N 3.34Å; I36-L38 PolarHBondContact O-N 3.17Å; L38-M41 PolarHBondContact O-N 3.26Å; L38-I42 HydrophobicContact CD2-CD1 3.72Å; L38-I42 HydrophobicContact CG-CD1 4.12Å; L38-I42 WeakPolarHBondContact O-CB 3.36Å; L38-I42 WeakPolarHBondContact O-CD1 3.43Å; L38-I42 WeakPolarHBondContact O-CG1 3.46Å; L38-I42 PolarHBondContact O-N 2.67Å
39	F	70.9	Confident	61.2	Low	127 Å²	127	91.6 Å²	91.6	56%	0.557	48%	0.483	S	S	*	.	H	α-helix	trans	-66.5	-40.1	177.4	-152.2	-98.8	0	0	0	112.1	L35 I36 L37 I42 N43	L35-F39 WeakPolarHBondContact O-CB 3.37Å; L35-F39 PolarHBondContact O-N 3.16Å; I36-F39 PolarHBondContact O-N 2.88Å; L37-F39 VanDerWaalsContact C-N 3.34Å; F39-I42 PolarHBondContact O-N 2.94Å; F39-N43 WeakPolarHBondContact CD1-ND2 3.38Å; F39-N43 WeakPolarHBondContact CE1-ND2 3.22Å; F39-N43 WeakPolarHBondContact O-CB 3.17Å; F39-N43 PolarHBondContact O-N 2.66Å; F39-N43 PolarHBondContact O-ND2 3.1Å
40	F	65.2	Low	60.8	Low	139 Å²	139	92.9 Å²	92.9	61%	0.61	49%	0.491	S	S	*	.	H	α-helix	trans	-65.3	-42.3	172.4	-96.4	-80.7	0	0	0	111.7	I36 L37 I42 N43 S44	I36-F40 HydrophobicContact CG2-CD2 3.7Å; I36-F40 HydrophobicContact CG2-CE2 3.92Å; I36-F40 WeakPolarHBondContact O-CB 3.42Å; I36-F40 WeakPolarHBondContact O-CD2 3.41Å; I36-F40 PolarHBondContact O-N 3.21Å; L37-F40 PolarHBondContact O-N 3.41Å; F40-I42 VanDerWaalsContact C-N 3.32Å; F40-I42 PolarHBondContact O-N 2.84Å; F40-N43 PolarHBondContact O-N 2.64Å; F40-S44 WeakPolarHBondContact O-CB 3.45Å; F40-S44 PolarHBondContact O-N 3.43Å; F40-S44 PolarHBondContact O-OG 2.83Å
41	M	60.8	Low	60.3	Low	133 Å²	133	95.3 Å²	95.3	66%	0.655	51%	0.505	S	S	*	.	H	α-helix	trans	-61.8	-41	175.5	-72.1	-91.1	-84.8	0	0	111.4	L37 L38 S45	L37-M41 WeakPolarHBondContact O-CB 3.42Å; L37-M41 WeakPolarHBondContact O-CG 3.18Å; L37-M41 PolarHBondContact O-N 3.42Å; L38-M41 PolarHBondContact O-N 3.26Å; M41-S45 WeakPolarHBondContact O-CB 3.11Å; M41-S45 PolarHBondContact O-N 3.47Å; M41-S45 VanDerWaalsContact O-N 3.1Å
42	I	61.4	Low	59.5	Low	77 Å²	77	93.4 Å²	93.4	40%	0.395	49%	0.489	S	S	.	.	H	α-helix	trans	-66.2	-52.1	175.9	-67.9	162.9	0	0	0	110.3	L38 F39 F40 S44 S45 V46	L38-I42 HydrophobicContact CD2-CD1 3.72Å; L38-I42 HydrophobicContact CG-CD1 4.12Å; L38-I42 WeakPolarHBondContact O-CB 3.36Å; L38-I42 WeakPolarHBondContact O-CD1 3.43Å; L38-I42 WeakPolarHBondContact O-CG1 3.46Å; L38-I42 PolarHBondContact O-N 2.67Å; F39-I42 PolarHBondContact O-N 2.94Å; F40-I42 VanDerWaalsContact C-N 3.32Å; F40-I42 PolarHBondContact O-N 2.84Å; I42-S44 PolarHBondContact O-N 2.87Å; I42-S45 WeakPolarHBondContact O-CA 3.49Å; I42-S45 WeakPolarHBondContact O-CB 3.36Å; I42-S45 PolarHBondContact O-N 3.42Å; I42-S45 PolarHBondContact O-OG 3.35Å; I42-V46 HydrophobicContact CG2-CG2 4.48Å; I42-V46 WeakPolarHBondContact O-CG2 3.4Å; I42-V46 PolarHBondContact O-N 2.84Å
43	N	57.6	Low	58.5	Low	66 Å²	66	94 Å²	94	35%	0.353	49%	0.487	S	S	.	.	H	α-helix	trans	-66.6	-36.6	-178.6	-71.8	-34.9	0	0	0	112.9	F39 F40 S45 V46 D47	F39-N43 WeakPolarHBondContact CD1-ND2 3.38Å; F39-N43 WeakPolarHBondContact CE1-ND2 3.22Å; F39-N43 WeakPolarHBondContact O-CB 3.17Å; F39-N43 PolarHBondContact O-N 2.66Å; F39-N43 PolarHBondContact O-ND2 3.1Å; F40-N43 PolarHBondContact O-N 2.64Å; N43-S45 PolarHBondContact O-N 3.02Å; N43-V46 PolarHBondContact O-N 2.61Å; N43-D47 PolarHBondContact O-N 2.8Å
44	S	56.6	Low	57.6	Low	74 Å²	74	93.4 Å²	93.4	52%	0.517	48%	0.481	S	S	.	.	H	α-helix	trans	-64.8	-26.7	172.8	-51.5	0	0	0	0	111.5	F40 I42 S48	F40-S44 WeakPolarHBondContact O-CB 3.45Å; F40-S44 PolarHBondContact O-N 3.43Å; F40-S44 PolarHBondContact O-OG 2.83Å; I42-S44 PolarHBondContact O-N 2.87Å; S44-S48 WeakPolarHBondContact O-CB 3.39Å
45	S	49.2	Very low	56.9	Low	30 Å²	30	97.1 Å²	97.1	21%	0.21	50%	0.501	C	S	.	.	H	α-helix	trans	-76.7	-31.7	171.3	86	0	0	0	0	112.4	M41 I42 N43 S48	M41-S45 WeakPolarHBondContact O-CB 3.11Å; M41-S45 PolarHBondContact O-N 3.47Å; M41-S45 VanDerWaalsContact O-N 3.1Å; I42-S45 WeakPolarHBondContact O-CA 3.49Å; I42-S45 WeakPolarHBondContact O-CB 3.36Å; I42-S45 PolarHBondContact O-N 3.42Å; I42-S45 PolarHBondContact O-OG 3.35Å; N43-S45 PolarHBondContact O-N 3.02Å; S45-S48 PolarHBondContact O-OG 2.9Å
46	V	48	Very low	56.1	Low	73 Å²	73	98.2 Å²	98.2	44%	0.442	51%	0.508	S	S	.	.	H	α-helix	trans	-76.9	-41.6	-179.7	176.3	0	0	0	0	111.8	I42 N43 S48 E49	I42-V46 HydrophobicContact CG2-CG2 4.48Å; I42-V46 WeakPolarHBondContact O-CG2 3.4Å; I42-V46 PolarHBondContact O-N 2.84Å; N43-V46 PolarHBondContact O-N 2.61Å; V46-S48 PolarHBondContact O-N 3.4Å; V46-E49 WeakPolarHBondContact O-CB 3.21Å; V46-E49 PolarHBondContact O-N 2.85Å
47	D	43.7	Very low	55.1	Low	122 Å²	122	96.7 Å²	96.7	65%	0.652	51%	0.511	S	S	*	.	H	α-helix	trans	-67.4	-22.1	175.2	-77.2	-29.9	0	0	0	112.2	N43 E49 M50	N43-D47 PolarHBondContact O-N 2.8Å; D47-E49 PolarHBondContact O-N 2.9Å; D47-M50 PolarHBondContact O-N 2.82Å
48	S	44.8	Very low	54.1	Low	16 Å²	16	96 Å²	96	11%	0.112	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-4.5	174.9	87.4	0	0	0	0	114.2	S44 S45 V46 M50 R157	S44-S48 WeakPolarHBondContact O-CB 3.39Å; S45-S48 PolarHBondContact O-OG 2.9Å; V46-S48 PolarHBondContact O-N 3.4Å; S48-M50 VanDerWaalsContact C-N 3.27Å; S48-R157 VanDerWaalsContact CB-NH1 3.32Å; S48-R157 PolarHBondContact O-NH2 3.49Å; S48-R157 VanDerWaalsContact O-NH2 3.16Å; S48-R157 PolarHBondContact OG-NE 2.72Å; S48-R157 PolarHBondContact OG-NH1 2.72Å; S48-R157 PolarHBondContact OG-NH2 2.9Å
49	E	45.3	Very low	53.1	Low	102 Å²	102	98.7 Å²	98.7	48%	0.477	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-8.1	172.6	-151.9	177.3	171.4	0	0	111.6	V46 D47 R59	V46-E49 WeakPolarHBondContact O-CB 3.21Å; V46-E49 PolarHBondContact O-N 2.85Å; D47-E49 PolarHBondContact O-N 2.9Å; E49-R59 IonicContact OE1-NH2 2.91Å; E49-R59 PolarHBondContact OE1-NH2 3.43Å
50	M	45.6	Very low	52.1	Low	151 Å²	151	96.7 Å²	96.7	74%	0.744	51%	0.505	S	S	*	.	S	Bend	trans	-88.6	-11.9	177.3	-106.7	-179.4	160.4	0	0	115	D47 S48	D47-M50 PolarHBondContact O-N 2.82Å; S48-M50 VanDerWaalsContact C-N 3.27Å
51	D	47.1	Very low	51.7	Low	136 Å²	136	93.1 Å²	93.1	73%	0.727	50%	0.495	S	S	*	.	S	Bend	trans	-95.9	7.5	177.6	-73.9	-29.8	0	0	0	113.3	F53	D51-F53 VanDerWaalsContact C-N 3.27Å; D51-F53 PolarHBondContact O-N 3.33Å
52	D	49.5	Very low	51.4	Low	37 Å²	37	91.1 Å²	91.1	20%	0.198	48%	0.48	C	S	.	.			trans	-90.4	42.6	-177	-99.1	-7.3	0	0	0	111.7	R59 L60	D52-R59 CarbonylContact O-C 3.47Å; D52-R59 VanDerWaalsContact O-CA 3.23Å; D52-R59 WeakPolarHBondContact O-CA 3.5Å; D52-L60 HydrophobicContact CB-CB 3.75Å; D52-L60 HydrophobicContact CB-CD1 4.32Å; D52-L60 HydrophobicContact CB-CG 4.45Å; D52-L60 PolarHBondContact O-N 3.1Å; D52-L60 WeakPolarHBondContact OD1-CB 3.29Å
53	F	49	Very low	51.4	Low	119 Å²	119	92.1 Å²	92.1	52%	0.522	48%	0.479	S	S	.	.	B	Isolated β-bridge	trans	-117.1	126.9	172.5	-68.7	-70.1	0	0	0	110.1	D51 G57 N58	D51-F53 VanDerWaalsContact C-N 3.27Å; D51-F53 PolarHBondContact O-N 3.33Å; F53-G57 VanDerWaalsContact CD1-C 3.41Å; F53-G57 WeakPolarHBondContact CD1-O 3.34Å; F53-G57 WeakPolarHBondContact CE1-O 3.49Å; F53-N58 WeakPolarHBondContact CA-O 3.34Å
54	D	53.3	Low	52	Low	59 Å²	59	91 Å²	91	32%	0.316	47%	0.471	S	S	.	.			trans	-62.6	168.8	163.3	67.7	5	0	0	0	110	N56 G57 N58	D54-N56 PolarHBondContact O-N 3.26Å; D54-N56 VanDerWaalsContact OD1-C 3.27Å; D54-N56 WeakPolarHBondContact OD1-CA 3.45Å; D54-N56 WeakPolarHBondContact OD1-CB 3.21Å; D54-N56 PolarHBondContact OD1-N 3.2Å; D54-N56 VanDerWaalsContact OD1-N 3.09Å; D54-G57 PolarHBondContact O-N 3.09Å; D54-G57 PolarHBondContact OD1-N 3.46Å; D54-G57 VanDerWaalsContact OD1-N 3.08Å; D54-N58 PolarHBondContact N-O 2.81Å; D54-N58 VanDerWaalsContact N-O 3.17Å; D54-N58 WeakPolarHBondContact OD1-CB 3.47Å; D54-N58 PolarHBondContact OD1-N 3.27Å; D54-N58 PolarHBondContact OD1-ND2 2.99Å; D54-N58 PolarHBondContact OD2-ND2 2.98Å
55	D	55.9	Low	53	Low	175 Å²	175	89.6 Å²	89.6	94%	0.936	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-11.5	176.9	-69.7	-38.4	0	0	0	113.4
56	N	56	Low	54.5	Low	134 Å²	134	89.1 Å²	89.1	72%	0.717	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	5	178.7	-58.1	-39.2	0	0	0	114	D54 N58	D54-N56 PolarHBondContact O-N 3.26Å; D54-N56 VanDerWaalsContact OD1-C 3.27Å; D54-N56 WeakPolarHBondContact OD1-CA 3.45Å; D54-N56 WeakPolarHBondContact OD1-CB 3.21Å; D54-N56 PolarHBondContact OD1-N 3.2Å; D54-N56 VanDerWaalsContact OD1-N 3.09Å; N56-N58 VanDerWaalsContact C-N 3.34Å; N56-N58 PolarHBondContact O-N 3.14Å
57	G	52.6	Low	56.1	Low	45 Å²	45	91 Å²	91	46%	0.464	46%	0.464	S	S	.	.			trans	74.6	19.2	179.2	0	0	0	0	0	114.6	F53 D54	F53-G57 VanDerWaalsContact CD1-C 3.41Å; F53-G57 WeakPolarHBondContact CD1-O 3.34Å; F53-G57 WeakPolarHBondContact CE1-O 3.49Å; D54-G57 PolarHBondContact O-N 3.09Å; D54-G57 PolarHBondContact OD1-N 3.46Å; D54-G57 VanDerWaalsContact OD1-N 3.08Å
58	N	52.5	Low	58	Low	94 Å²	94	89 Å²	89	50%	0.503	45%	0.447	S	S	.	.			trans	-87.1	130.3	173	-57.8	-52.8	0	0	0	110.5	F53 D54 N56 L60	F53-N58 WeakPolarHBondContact CA-O 3.34Å; D54-N58 PolarHBondContact N-O 2.81Å; D54-N58 VanDerWaalsContact N-O 3.17Å; D54-N58 WeakPolarHBondContact OD1-CB 3.47Å; D54-N58 PolarHBondContact OD1-N 3.27Å; D54-N58 PolarHBondContact OD1-ND2 2.99Å; D54-N58 PolarHBondContact OD2-ND2 2.98Å; N56-N58 VanDerWaalsContact C-N 3.34Å; N56-N58 PolarHBondContact O-N 3.14Å; N58-L60 PolarHBondContact O-N 3.5Å; N58-L60 VanDerWaalsContact O-N 3.17Å
59	R	49.1	Very low	59.9	Low	164 Å²	164	89.6 Å²	89.6	62%	0.619	45%	0.452	S	S	*	.	B	Isolated β-bridge	trans	-51.9	121.6	173.2	-164.6	177	-172.4	-173.6	4.6	109.3	E49 D52 V61	E49-R59 IonicContact OE1-NH2 2.91Å; E49-R59 PolarHBondContact OE1-NH2 3.43Å; D52-R59 CarbonylContact O-C 3.47Å; D52-R59 VanDerWaalsContact O-CA 3.23Å; D52-R59 WeakPolarHBondContact O-CA 3.5Å; R59-V61 HydrophobicContact CB-CG2 4.42Å; R59-V61 HydrophobicContact CG-CG2 4.45Å; R59-V61 PolarHBondContact O-N 3.32Å
60	L	51.6	Low	61.8	Low	84 Å²	84	89.8 Å²	89.8	44%	0.44	46%	0.464	S	S	.	.			trans	-66.1	71.7	170.8	-75.7	167.8	0	0	0	108.2	D52 N58 R62	D52-L60 HydrophobicContact CB-CB 3.75Å; D52-L60 HydrophobicContact CB-CD1 4.32Å; D52-L60 HydrophobicContact CB-CG 4.45Å; D52-L60 PolarHBondContact O-N 3.1Å; D52-L60 WeakPolarHBondContact OD1-CB 3.29Å; N58-L60 PolarHBondContact O-N 3.5Å; N58-L60 VanDerWaalsContact O-N 3.17Å; L60-R62 PolarHBondContact O-N 2.98Å
61	V	55.2	Low	63.7	Low	65 Å²	65	86.9 Å²	86.9	39%	0.394	45%	0.445	S	S	.	.			trans	-63.3	105.6	170.8	177.6	0	0	0	0	106.2	R59 R63 Q148	R59-V61 HydrophobicContact CB-CG2 4.42Å; R59-V61 HydrophobicContact CG-CG2 4.45Å; R59-V61 PolarHBondContact O-N 3.32Å; V61-R63 WeakPolarHBondContact O-CG 3.39Å; V61-R63 PolarHBondContact O-N 3.13Å; V61-Q148 HydrophobicContact CG1-CG 4.2Å
62	R	55.9	Low	65.4	Low	91 Å²	91	81.4 Å²	81.4	34%	0.343	42%	0.418	S	S	.	.			trans	-58.1	99.7	173.5	-67.5	-170.7	-176.6	-161.1	-2.9	109.3	L60	L60-R62 PolarHBondContact O-N 2.98Å
63	R	62.1	Low	67	Low	97 Å²	97	81.1 Å²	81.1	37%	0.366	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	144	175.7	-60.2	-166.9	-171.8	-168.4	-0.8	109.4	V61 D146	V61-R63 WeakPolarHBondContact O-CG 3.39Å; V61-R63 PolarHBondContact O-N 3.13Å; R63-D146 IonicContact CZ-OD1 3.8Å; R63-D146 IonicContact NH1-OD1 2.67Å; R63-D146 PolarHBondContact NH1-OD1 3.14Å
64	K	69.9	Low	68.7	Low	42 Å²	42	75.8 Å²	75.8	18%	0.183	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	159.4	174.4	-66.5	-169.4	-176.6	157.9	0	109.7	C66 C147 S149 N154 C164	K64-C66 PolarHBondContact O-N 3.32Å; K64-C147 PolarHBondContact N-O 2.95Å; K64-C147 PolarHBondContact O-N 3.23Å; K64-S149 WeakPolarHBondContact CD-OG 3.45Å; K64-S149 WeakPolarHBondContact CE-OG 2.97Å; K64-S149 PolarHBondContact NZ-OG 3.43Å; K64-N154 WeakPolarHBondContact CE-OD1 3.46Å; K64-N154 PolarHBondContact NZ-OD1 3.37Å; K64-C164 VanDerWaalsContact C-SG 3.53Å
65	W	77	Confident	69.9	Low	45 Å²	45	73 Å²	73	17%	0.17	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-54.7	127.3	167.2	-70.9	104.8	0	0	0	110.4	F83 R143 C145 C164 D168 V170	W65-F83 HydrophobicContact CH2-CD2 4.24Å; W65-F83 AromaticContact CH2-CE2 3.91Å; W65-F83 HydrophobicContact CH2-CE2 3.91Å; W65-F83 HydrophobicContact CZ2-CE2 4.23Å; W65-R143 HydrophobicContact CD2-CG 4.48Å; W65-R143 HydrophobicContact CE3-CB 4.48Å; W65-R143 HydrophobicContact CE3-CG 3.69Å; W65-R143 HydrophobicContact CZ3-CG 4.15Å; W65-C145 HydrophobicContact CD2-CB 4.42Å; W65-C145 HydrophobicContact CE3-CB 4.04Å; W65-C145 HydrophobicContact CH2-CB 4.29Å; W65-C145 HydrophobicContact CZ3-CB 3.98Å; W65-C164 HydrophobicContact CD2-CB 4.03Å; W65-C164 HydrophobicContact CG-CB 4.42Å; W65-C164 HydrophobicContact CH2-CB 4.21Å; W65-C164 HydrophobicContact CZ2-CB 3.49Å; W65-C164 VanDerWaalsContact CZ2-CB 3.49Å; W65-C164 PolarHBondContact N-SG 3Å; W65-C164 VanDerWaalsContact N-SG 3.38Å; W65-D168 HydrophobicContact CH2-CB 3.81Å; W65-D168 HydrophobicContact CZ3-CB 4.37Å; W65-V170 HydrophobicContact CE3-CG2 4.49Å; W65-V170 HydrophobicContact CH2-CB 4.32Å; W65-V170 HydrophobicContact CH2-CG2 3.27Å; W65-V170 HydrophobicContact CZ2-CG2 3.85Å; W65-V170 HydrophobicContact CZ3-CB 4.21Å; W65-V170 HydrophobicContact CZ3-CG2 3.63Å
66	C	80.1	Confident	70.8	Confident	21 Å²	21	65.5 Å²	65.5	14%	0.142	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-64.2	157.8	166	-68.8	0	0	0	0	110.7	K64 T144 C147	K64-C66 PolarHBondContact O-N 3.32Å; C66-T144 VanDerWaalsContact CB-O 3.29Å; C66-T144 WeakPolarHBondContact CB-O 3.09Å; C66-T144 PolarHBondContact N-O 3.43Å; C66-C147 WeakPolarHBondContact CA-SG 3.06Å; C66-C147 HydrophobicContact CB-CB 4.05Å; C66-C147 WeakPolarHBondContact CB-SG 2.93Å; C66-C147 WeakPolarHBondContact SG-CB 3.16Å; C66-C147 PolarHBondContact SG-N 2.95Å; C66-C147 CovalentContact SG-SG 2.04Å; C66-C147 PolarHBondContact SG-SG 2.92Å
67	P	81.8	Confident	71.6	Confident	111 Å²	111	60.4 Å²	60.4	72%	0.721	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-51.2	148.8	167.6	-24.2	34.1	0	0	0	110.8
68	W	83.6	Confident	72.6	Confident	80 Å²	80	65 Å²	65	30%	0.303	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-57.5	140.7	172	-69.1	106	0	0	0	110.9	R141 R143 V170 E172	W68-R141 HydrophobicContact CD2-CG 4.46Å; W68-R141 HydrophobicContact CE3-CG 3.84Å; W68-R141 HydrophobicContact CZ3-CG 4.26Å; W68-R143 HydrophobicContact CD2-CB 4.06Å; W68-R143 HydrophobicContact CD2-CG 4Å; W68-R143 HydrophobicContact CE3-CB 3.74Å; W68-R143 HydrophobicContact CE3-CG 3.67Å; W68-R143 HydrophobicContact CH2-CG 3.9Å; W68-R143 HydrophobicContact CZ2-CG 4.19Å; W68-R143 HydrophobicContact CZ3-CB 4.17Å; W68-R143 HydrophobicContact CZ3-CG 3.62Å; W68-V170 HydrophobicContact CH2-CB 4.3Å; W68-V170 HydrophobicContact CH2-CG1 3.64Å; W68-V170 HydrophobicContact CZ3-CG1 4.17Å; W68-E172 HydrophobicContact CH2-CB 3.99Å; W68-E172 WeakPolarHBondContact CH2-OE2 3.28Å; W68-E172 WeakPolarHBondContact CZ2-OE2 3.14Å; W68-E172 HydrophobicContact CZ3-CB 3.92Å
69	S	84.7	Confident	73.7	Confident	29 Å²	29	61.1 Å²	61.1	20%	0.203	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-59	160.5	166.4	76.8	0	0	0	0	110	F142	S69-F142 WeakPolarHBondContact CB-O 3.33Å; S69-F142 PolarHBondContact N-O 3.49Å; S69-F142 WeakPolarHBondContact OG-CD1 3.25Å; S69-F142 PolarHBondContact OG-N 3.39Å; S69-F142 PolarHBondContact OG-O 3.35Å
70	S	85.3	Confident	74.7	Confident	106 Å²	106	57 Å²	57	74%	0.741	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-56.5	150.8	163.5	50.7	0	0	0	0	110.2	S72	S70-S72 PolarHBondContact O-N 2.91Å
71	W	85.5	Confident	75.9	Confident	90 Å²	90	59.7 Å²	59.7	34%	0.341	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-61.2	136	170.3	-73	106.2	0	0	0	109.9	K139 R141 E172 S174	W71-K139 HydrophobicContact CB-CD 4.33Å; W71-K139 HydrophobicContact CD2-CD 4.18Å; W71-K139 HydrophobicContact CD2-CG 4.35Å; W71-K139 HydrophobicContact CE3-CB 4.3Å; W71-K139 HydrophobicContact CE3-CD 4.04Å; W71-K139 HydrophobicContact CE3-CG 3.7Å; W71-K139 HydrophobicContact CG-CD 4.34Å; W71-K139 HydrophobicContact CZ3-CG 4.13Å; W71-R141 HydrophobicContact CD2-CB 4.12Å; W71-R141 HydrophobicContact CD2-CG 4.18Å; W71-R141 HydrophobicContact CE3-CB 3.86Å; W71-R141 HydrophobicContact CE3-CG 3.91Å; W71-R141 HydrophobicContact CH2-CG 3.82Å; W71-R141 HydrophobicContact CZ2-CG 4.1Å; W71-R141 VanDerWaalsContact CZ2-CZ 3.46Å; W71-R141 HydrophobicContact CZ3-CB 4.14Å; W71-R141 HydrophobicContact CZ3-CG 3.72Å; W71-E172 HydrophobicContact CH2-CG 4.15Å; W71-S174 WeakPolarHBondContact CH2-OG 3.49Å; W71-S174 WeakPolarHBondContact CZ3-OG 3.35Å
72	S	83.6	Confident	76.7	Confident	22 Å²	22	57.9 Å²	57.9	15%	0.154	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-65.7	161.3	171	77.8	0	0	0	0	110.7	S70 K139 Q140 R186	S70-S72 PolarHBondContact O-N 2.91Å; S72-K139 WeakPolarHBondContact O-CB 3.01Å; S72-Q140 WeakPolarHBondContact CB-O 3.42Å; S72-Q140 PolarHBondContact N-O 2.88Å; S72-Q140 PolarHBondContact OG-N 3.44Å; S72-Q140 PolarHBondContact OG-O 3.13Å; S72-R186 WeakPolarHBondContact OG-CD 3.48Å; S72-R186 PolarHBondContact OG-NE 3.26Å
73	P	83.5	Confident	77.3	Confident	31 Å²	31	58.7 Å²	58.7	20%	0.201	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-55.3	148.4	166.9	-20.9	32.8	0	0	0	110.9	Y183 R186	P73-Y183 HydrophobicContact CB-CD2 3.55Å; P73-Y183 HydrophobicContact CB-CE2 3.99Å; P73-Y183 HydrophobicContact CB-CG 4.18Å; P73-R186 WeakPolarHBondContact CD-O 3.34Å
74	C	84.2	Confident	77.5	Confident	6 Å²	6	55.5 Å²	55.5	4%	0.041	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-68.9	130.8	174.4	-94.3	0	0	0	0	110.4	C176 E180 K181 I182 Y183	C74-C176 WeakPolarHBondContact CA-SG 3.24Å; C74-C176 HydrophobicContact CB-CB 3.98Å; C74-C176 WeakPolarHBondContact CB-SG 3.25Å; C74-C176 VanDerWaalsContact SG-CA 3.58Å; C74-C176 WeakPolarHBondContact SG-CB 3.34Å; C74-C176 CovalentContact SG-SG 2.02Å; C74-C176 PolarHBondContact SG-SG 3.36Å; C74-E180 HydrophobicContact CB-CB 4.46Å; C74-E180 PolarHBondContact SG-OE2 2.93Å; C74-K181 VanDerWaalsContact CB-O 3.28Å; C74-K181 WeakPolarHBondContact CB-O 3.22Å; C74-I182 HydrophobicContact CB-CG1 4.41Å; C74-I182 CarbonylContact O-C 3.47Å; C74-I182 WeakPolarHBondContact O-CA 3.44Å; C74-Y183 PolarHBondContact O-N 2.96Å
75	S	79	Confident	77.1	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-147.1	149.4	-171.1	55.7	0	0	0	0	111.1	T77 P137 E138 Y183 R186	S75-T77 WeakPolarHBondContact CB-OG1 3.16Å; S75-T77 PolarHBondContact O-N 3.49Å; S75-T77 PolarHBondContact OG-OG1 3.48Å; S75-P137 CarbonylContact O-C 3.49Å; S75-P137 VanDerWaalsContact O-CA 3.28Å; S75-P137 WeakPolarHBondContact O-CA 3.48Å; S75-E138 PolarHBondContact N-O 3.49Å; S75-E138 VanDerWaalsContact N-O 3.11Å; S75-E138 PolarHBondContact O-N 3.03Å; S75-E138 PolarHBondContact OG-O 3.36Å; S75-Y183 WeakPolarHBondContact CA-O 3.47Å; S75-R186 PolarHBondContact OG-NE 3.46Å; S75-R186 PolarHBondContact OG-NH2 3.44Å
76	P	74.4	Confident	76	Confident	18 Å²	18	62 Å²	62	12%	0.117	32%	0.322	C	S	.	.	S	Bend	trans	-76	-4.7	172.7	34.3	-35.6	0	0	0	112.3	Y123 Y183 I196	P76-Y123 HydrophobicContact CB-CD1 3.72Å; P76-Y123 HydrophobicContact CB-CD2 3.81Å; P76-Y123 HydrophobicContact CB-CE1 3.93Å; P76-Y123 HydrophobicContact CB-CE2 4.05Å; P76-Y123 HydrophobicContact CB-CG 3.6Å; P76-Y123 HydrophobicContact CG-CD2 4.06Å; P76-Y123 HydrophobicContact CG-CE1 4.38Å; P76-Y123 HydrophobicContact CG-CE2 3.91Å; P76-Y123 HydrophobicContact CG-CG 4.35Å; P76-Y183 WeakPolarHBondContact CD-O 3.34Å; P76-I196 HydrophobicContact CG-CD1 3.87Å
77	T	73.1	Confident	74.7	Confident	27 Å²	27	64.7 Å²	64.7	17%	0.166	34%	0.335	C	S	.	.	S	Bend	trans	-65.4	135.9	172.5	54.2	0	0	0	0	109.5	S75 R186	S75-T77 WeakPolarHBondContact CB-OG1 3.16Å; S75-T77 PolarHBondContact O-N 3.49Å; S75-T77 PolarHBondContact OG-OG1 3.48Å; T77-R186 PolarHBondContact O-NH2 2.78Å; T77-R186 PolarHBondContact OG1-NH2 3.31Å
78	K	72.7	Confident	73.3	Confident	143 Å²	143	63.1 Å²	63.1	62%	0.622	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-52.7	145	176.3	-165.2	173.4	-178.2	-179.1	0	109.9	R186	K78-R186 PolarHBondContact O-NH1 2.91Å; K78-R186 PolarHBondContact O-NH2 3.35Å; K78-R186 VanDerWaalsContact O-NH2 3.13Å
79	C	75.2	Confident	71.7	Confident	12 Å²	12	62.5 Å²	62.5	8%	0.081	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-99.8	137.8	173.3	-173.8	0	0	0	0	111	K81 E138 Q140 C173	C79-K81 PolarHBondContact O-N 2.92Å; C79-E138 HydrophobicContact CB-CB 3.85Å; C79-E138 WeakPolarHBondContact CB-OE2 3.45Å; C79-E138 PolarHBondContact N-OE2 3.34Å; C79-Q140 WeakPolarHBondContact SG-CB 3.39Å; C79-C173 VanDerWaalsContact C-SG 3.53Å; C79-C173 HydrophobicContact CB-CB 3.64Å; C79-C173 WeakPolarHBondContact CB-SG 3.34Å; C79-C173 WeakPolarHBondContact SG-CA 3.31Å; C79-C173 WeakPolarHBondContact SG-CB 3.01Å; C79-C173 CovalentContact SG-SG 2.01Å; C79-C173 PolarHBondContact SG-SG 3.01Å
80	F	70.3	Confident	70.1	Confident	76 Å²	76	68.3 Å²	68.3	33%	0.333	35%	0.352	S	S	.	.			trans	-86	108.8	172.1	-167.9	-90.2	0	0	0	110.4	V84 E95 F171 C173	F80-V84 HydrophobicContact CD1-CG2 4.31Å; F80-V84 HydrophobicContact CE1-CG2 3.48Å; F80-V84 VanDerWaalsContact CE1-CG2 3.48Å; F80-V84 HydrophobicContact CZ-CG2 4.06Å; F80-E95 PolarHBondContact N-OE1 2.87Å; F80-F171 HydrophobicContact CD1-CB 4.37Å; F80-F171 HydrophobicContact CD1-CD2 4.05Å; F80-F171 HydrophobicContact CD1-CG 4.27Å; F80-F171 HydrophobicContact CE1-CD2 4.46Å; F80-F171 WeakPolarHBondContact O-CB 3.28Å; F80-C173 PolarHBondContact O-SG 3.02Å
81	K	76.4	Confident	68.4	Low	141 Å²	141	71.5 Å²	71.5	61%	0.613	35%	0.348	S	S	*	.			trans	-97.1	127	170.4	-172.7	-179.9	178.5	-176.8	0	109.1	C79 C173	C79-K81 PolarHBondContact O-N 2.92Å; K81-C173 HydrophobicContact CB-CB 4.37Å; K81-C173 PolarHBondContact N-SG 3.31Å; K81-C173 VanDerWaalsContact N-SG 3.43Å
82	G	72.5	Confident	66.7	Low	28 Å²	28	70.5 Å²	70.5	29%	0.289	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	153.4	-170.1	173.2	0	0	0	0	0	114.6	F171	G82-F171 PolarHBondContact N-O 3.3Å; G82-F171 PolarHBondContact O-N 3.43Å
83	F	67.8	Low	64.7	Low	107 Å²	107	76 Å²	76	47%	0.469	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	125.6	179.2	174.6	-87.3	0	0	0	108.6	W65 N85 D168 T169 V170	W65-F83 HydrophobicContact CH2-CD2 4.24Å; W65-F83 AromaticContact CH2-CE2 3.91Å; W65-F83 HydrophobicContact CH2-CE2 3.91Å; W65-F83 HydrophobicContact CZ2-CE2 4.23Å; F83-N85 HydrophobicContact CE1-CB 4.06Å; F83-D168 HydrophobicContact CE2-CB 3.6Å; F83-D168 WeakPolarHBondContact CE2-OD2 3.07Å; F83-D168 HydrophobicContact CZ-CB 3.71Å; F83-D168 WeakPolarHBondContact CZ-OD1 3.5Å; F83-D168 WeakPolarHBondContact CZ-OD2 3.2Å; F83-T169 WeakPolarHBondContact CA-O 2.93Å; F83-V170 HydrophobicContact CD2-CG2 3.72Å; F83-V170 HydrophobicContact CE2-CG2 4.5Å
84	V	67.1	Low	63	Low	30 Å²	30	83.1 Å²	83.1	18%	0.182	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	120.6	177.3	-176.9	0	0	0	0	108.4	F80 T169 F171	F80-V84 HydrophobicContact CD1-CG2 4.31Å; F80-V84 HydrophobicContact CE1-CG2 3.48Å; F80-V84 VanDerWaalsContact CE1-CG2 3.48Å; F80-V84 HydrophobicContact CZ-CG2 4.06Å; V84-T169 PolarHBondContact N-O 3.23Å; V84-T169 PolarHBondContact O-N 3.02Å; V84-T169 PolarHBondContact O-OG1 3.46Å; V84-T169 VanDerWaalsContact O-OG1 3.07Å; V84-F171 HydrophobicContact CB-CE2 4.14Å; V84-F171 HydrophobicContact CG2-CD2 4.07Å; V84-F171 HydrophobicContact CG2-CE2 3.77Å
85	N	61	Low	61	Low	82 Å²	82	85.4 Å²	85.4	44%	0.439	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	126.9	177.3	-164.7	-42.6	0	0	0	109.6	F83 N87 D168	F83-N85 HydrophobicContact CE1-CB 4.06Å; N85-N87 PolarHBondContact O-N 3.35Å; N85-D168 PolarHBondContact ND2-OD1 3.37Å
86	K	55	Low	59.1	Low	141 Å²	141	93 Å²	93	61%	0.613	45%	0.451	S	S	*	.	S	Bend	trans	64	14.2	159.6	-79.8	169.4	-166.5	-176.7	0	120.2	G167	K86-G167 PolarHBondContact N-O 3.4Å
87	N	52.6	Low	57.6	Low	78 Å²	78	96 Å²	96	42%	0.417	47%	0.465	S	S	.	.			trans	-157.7	111.3	160.9	-117.3	-26.9	0	0	0	113.3	N85 S89 Y90	N85-N87 PolarHBondContact O-N 3.35Å; N87-S89 PolarHBondContact O-N 2.98Å; N87-Y90 HydrophobicContact CB-CD2 3.88Å; N87-Y90 HydrophobicContact CB-CE2 4.3Å
88	P	51.6	Low	55.9	Low	79 Å²	79	101.3 Å²	101.3	51%	0.513	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-55.9	-39.7	167.3	20.2	-27.6	0	0	0	109.5	Y90 W91	P88-Y90 PolarHBondContact O-N 3.3Å; P88-W91 VanDerWaalsContact O-CB 3.28Å; P88-W91 WeakPolarHBondContact O-CB 3.15Å; P88-W91 PolarHBondContact O-N 2.89Å; P88-W91 PolarHBondContact O-NE1 3.45Å
89	S	50.5	Low	54.6	Low	67 Å²	67	97.1 Å²	97.1	47%	0.469	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-48.1	-12.3	-177.8	-54.6	0	0	0	0	118.5	N87 W91	N87-S89 PolarHBondContact O-N 2.98Å; S89-W91 VanDerWaalsContact C-N 3.3Å
90	Y	50.5	Low	53	Low	150 Å²	150	101.7 Å²	101.7	59%	0.588	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-76.1	-14.9	169	-85.3	-80.9	0	0	0	114.3	N87 P88	N87-Y90 HydrophobicContact CB-CD2 3.88Å; N87-Y90 HydrophobicContact CB-CE2 4.3Å; P88-Y90 PolarHBondContact O-N 3.3Å
91	W	50.5	Low	51.7	Low	173 Å²	173	105.6 Å²	105.6	66%	0.655	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-57.5	-49.3	176.9	62	-38.1	0	0	0	115.2	P88 S89 N93	P88-W91 VanDerWaalsContact O-CB 3.28Å; P88-W91 WeakPolarHBondContact O-CB 3.15Å; P88-W91 PolarHBondContact O-N 2.89Å; P88-W91 PolarHBondContact O-NE1 3.45Å; S89-W91 VanDerWaalsContact C-N 3.3Å; W91-N93 PolarHBondContact O-N 3.17Å; W91-N93 VanDerWaalsContact O-N 3.12Å
92	S	48.8	Very low	50.1	Low	69 Å²	69	105.8 Å²	105.8	48%	0.483	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-67.2	-20.4	-169	58.3	0	0	0	0	113.6
93	N	43.1	Very low	49	Very low	137 Å²	137	107.7 Å²	107.7	73%	0.733	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-105.4	-1.6	-166.5	-61.4	-3.6	0	0	0	113.7	W91	W91-N93 PolarHBondContact O-N 3.17Å; W91-N93 VanDerWaalsContact O-N 3.12Å
94	R	46.6	Very low	48.3	Very low	181 Å²	181	109.2 Å²	109.2	68%	0.683	55%	0.548	S	S	*	.	S	Bend	trans	-110.1	-9.6	-170.4	-86.6	-166.8	-172.2	-134.5	3	116.7
95	E	42.6	Very low	47.8	Very low	54 Å²	54	109.1 Å²	109.1	25%	0.252	55%	0.547	S	S	.	.			trans	-143.6	62	-175	-69.5	179.6	155.1	0	0	112.4	F80 R186	F80-E95 PolarHBondContact N-OE1 2.87Å; E95-R186 IonicContact OE2-NH1 3.62Å
96	E	39.6	Very low	47.8	Very low	161 Å²	161	106.8 Å²	106.8	75%	0.752	54%	0.535	S	S	*	.			trans	-99.6	111	146.7	-74.1	-179.8	174.7	0	0	105.8	L98	E96-L98 PolarHBondContact O-N 2.04Å
97	L	41.4	Very low	48.4	Very low	80 Å²	80	101.7 Å²	101.7	42%	0.419	51%	0.514	S	S	.	.			trans	-58.5	99.6	149	-175.1	82.2	0	0	0	102.9	V99	L97-V99 HydrophobicContact CD2-CG2 4.14Å; L97-V99 PolarHBondContact O-N 2.89Å
98	L	38.6	Very low	49.2	Very low	139 Å²	139	98 Å²	98	73%	0.728	49%	0.494	S	S	*	.			trans	-59.3	94.1	169.8	-134.9	101.6	0	0	0	104.1	E96 D100	E96-L98 PolarHBondContact O-N 2.04Å; L98-D100 PolarHBondContact O-N 3.44Å
99	V	45.4	Very low	50.1	Low	54 Å²	54	94.3 Å²	94.3	33%	0.327	47%	0.47	S	S	.	.			trans	-68.7	99	165.2	179.5	0	0	0	0	101.4	L97 D101 I105	L97-V99 HydrophobicContact CD2-CG2 4.14Å; L97-V99 PolarHBondContact O-N 2.89Å; V99-D101 PolarHBondContact O-N 2.91Å; V99-I105 HydrophobicContact CG1-CD1 3.65Å
100	D	40.8	Very low	50.8	Low	109 Å²	109	93.7 Å²	93.7	58%	0.583	46%	0.461	S	S	*	.			trans	-52.1	111.5	175.2	-159.5	12.3	0	0	0	106.6	L98 D102	L98-D100 PolarHBondContact O-N 3.44Å; D100-D102 PolarHBondContact O-N 3.36Å
101	D	43.9	Very low	51.4	Low	157 Å²	157	91.9 Å²	91.9	84%	0.84	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	1.6	-166.2	-114	-19.6	0	0	0	112.8	V99	V99-D101 PolarHBondContact O-N 2.91Å
102	D	43.4	Very low	51.8	Low	146 Å²	146	85.3 Å²	85.3	78%	0.781	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	11.8	-166.3	-83	-19.3	0	0	0	115.3	D100	D100-D102 PolarHBondContact O-N 3.36Å
103	T	49.1	Very low	52	Low	68 Å²	68	89.5 Å²	89.5	42%	0.417	45%	0.45	S	S	.	.	S	Bend	trans	-133.1	136.6	170.5	58.7	0	0	0	0	111.3	I105	T103-I105 WeakPolarHBondContact O-CG1 3.3Å; T103-I105 PolarHBondContact O-N 2.84Å; T103-I105 WeakPolarHBondContact OG1-CD1 3.41Å; T103-I105 WeakPolarHBondContact OG1-CG1 3.28Å
104	Q	51.4	Low	52.4	Low	138 Å²	138	91.3 Å²	91.3	65%	0.645	46%	0.46	S	S	*	.			trans	-62.7	86.9	173.1	-63.7	175.1	0.1	0	0	108.8	I128	Q104-I128 HydrophobicContact CB-CD1 3.77Å; Q104-I128 HydrophobicContact CB-CG1 3.87Å; Q104-I128 HydrophobicContact CG-CD1 4.16Å; Q104-I128 WeakPolarHBondContact O-CG1 3.46Å
105	I	58.5	Low	52.2	Low	28 Å²	28	87 Å²	87	14%	0.144	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-90.3	121.3	178.4	-62.4	158.2	0	0	0	106.6	V99 T103 H107 Q125 Q126	V99-I105 HydrophobicContact CG1-CD1 3.65Å; T103-I105 WeakPolarHBondContact O-CG1 3.3Å; T103-I105 PolarHBondContact O-N 2.84Å; T103-I105 WeakPolarHBondContact OG1-CD1 3.41Å; T103-I105 WeakPolarHBondContact OG1-CG1 3.28Å; I105-H107 VanDerWaalsContact CG2-CD2 3.45Å; I105-H107 WeakPolarHBondContact CG2-CD2 3.35Å; I105-H107 VanDerWaalsContact CG2-NE2 3.35Å; I105-H107 WeakPolarHBondContact CG2-NE2 2.98Å; I105-H107 PolarHBondContact O-CD2 3.38Å; I105-H107 VanDerWaalsContact O-CD2 3.27Å; I105-Q125 HydrophobicContact CG2-CB 4.43Å; I105-Q125 HydrophobicContact CG2-CG 3.18Å; I105-Q126 WeakPolarHBondContact CA-O 3.29Å
106	T	61	Low	52.4	Low	33 Å²	33	87.8 Å²	87.8	20%	0.202	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	122.1	172	18	0	0	0	0	109.2	Q126	T106-Q126 PolarHBondContact N-O 3.31Å; T106-Q126 PolarHBondContact O-N 3.2Å; T106-Q126 PolarHBondContact OG1-OE1 3.31Å
107	H	65.8	Low	52.8	Low	34 Å²	34	90.5 Å²	90.5	16%	0.157	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	117.5	-177.7	-64.3	-152.6	0	0	0	107.3	I105 Y123 L184 I196	I105-H107 VanDerWaalsContact CG2-CD2 3.45Å; I105-H107 WeakPolarHBondContact CG2-CD2 3.35Å; I105-H107 VanDerWaalsContact CG2-NE2 3.35Å; I105-H107 WeakPolarHBondContact CG2-NE2 2.98Å; I105-H107 PolarHBondContact O-CD2 3.38Å; I105-H107 VanDerWaalsContact O-CD2 3.27Å; H107-Y123 HydrophobicContact CB-CE2 3.94Å; H107-Y123 PolarHBondContact CE1-OH 2.91Å; H107-Y123 AromaticContact ND1-CZ 3.85Å; H107-Y123 PolarHBondContact ND1-OH 3.43Å; H107-L184 WeakPolarHBondContact ND1-CD1 3.34Å; H107-I196 HydrophobicContact CB-CG2 4.13Å
108	C	70.2	Confident	52.9	Low	1 Å²	1	94.1 Å²	94.1	1%	0.007	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	150.9	176.8	76.5	0	0	0	0	113.2	V124 P197 C199	C108-V124 PolarHBondContact N-O 3.31Å; C108-V124 VanDerWaalsContact N-O 3.11Å; C108-V124 PolarHBondContact O-N 2.82Å; C108-P197 WeakPolarHBondContact CA-O 3.43Å; C108-C199 HydrophobicContact CB-CB 3.82Å; C108-C199 WeakPolarHBondContact CB-SG 2.94Å; C108-C199 WeakPolarHBondContact SG-CB 3.12Å; C108-C199 CovalentContact SG-SG 2.03Å; C108-C199 PolarHBondContact SG-SG 3.07Å
109	V	70	Confident	53.3	Low	1 Å²	1	91.6 Å²	91.6	1%	0.006	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	124.4	178.6	176.8	0	0	0	0	110.1	R121 I182 I196 P197 Y198 C199	V109-R121 HydrophobicContact CG1-CB 4.01Å; V109-R121 HydrophobicContact CG1-CG 4.12Å; V109-I182 HydrophobicContact CB-CD1 4.25Å; V109-I182 HydrophobicContact CG1-CD1 3.55Å; V109-I182 HydrophobicContact CG2-CB 4.1Å; V109-I182 HydrophobicContact CG2-CD1 3.59Å; V109-I182 HydrophobicContact CG2-CG1 4.44Å; V109-I182 HydrophobicContact CG2-CG2 4.48Å; V109-I196 HydrophobicContact CG2-CB 4.03Å; V109-I196 HydrophobicContact CG2-CG2 3.78Å; V109-P197 PolarHBondContact N-O 3.27Å; V109-Y198 HydrophobicContact CB-CD1 4.01Å; V109-Y198 HydrophobicContact CB-CE1 4.43Å; V109-Y198 HydrophobicContact CG1-CD1 3.97Å; V109-Y198 HydrophobicContact CG1-CE1 4.03Å; V109-Y198 WeakPolarHBondContact O-CA 3.41Å; V109-C199 VanDerWaalsContact C-SG 3.52Å; V109-C199 PolarHBondContact O-N 3.07Å
110	L	66.6	Low	53.6	Low	54 Å²	54	91.4 Å²	91.4	28%	0.283	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	126.8	169	-69.2	172	0	0	0	110.3	A122 V124 C199	L110-A122 HydrophobicContact CB-CB 4.24Å; L110-A122 HydrophobicContact CD1-CB 3.95Å; L110-A122 PolarHBondContact N-O 2.9Å; L110-V124 HydrophobicContact CD1-CG2 3.38Å; L110-V124 HydrophobicContact CD2-CG2 4.47Å; L110-V124 HydrophobicContact CG-CG2 3.61Å; L110-C199 HydrophobicContact CD2-CB 4.06Å
111	I	63.1	Low	54.3	Low	112 Å²	112	87.2 Å²	87.2	57%	0.574	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-72.1	132.7	173.5	-58.4	173	0	0	0	108.3	K113 Y198	I111-K113 PolarHBondContact O-N 2.77Å; I111-K113 VanDerWaalsContact O-N 3.09Å; I111-Y198 HydrophobicContact CD1-CD1 4.05Å; I111-Y198 HydrophobicContact CD1-CG 4.2Å; I111-Y198 HydrophobicContact CG1-CD1 3.45Å; I111-Y198 VanDerWaalsContact CG1-CD1 3.45Å; I111-Y198 HydrophobicContact CG1-CE1 3.96Å; I111-Y198 HydrophobicContact CG1-CG 4.08Å
112	P	57.2	Low	55	Low	35 Å²	35	80.5 Å²	80.5	23%	0.227	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-58.8	119.1	175.1	23.7	-32.7	0	0	0	109.2
113	K	54.8	Low	55.7	Low	157 Å²	157	73.8 Å²	73.8	68%	0.683	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-78.2	127.5	173.9	-162.9	173.7	-178.8	175.6	0	107.4	I111 S115 T116	I111-K113 PolarHBondContact O-N 2.77Å; I111-K113 VanDerWaalsContact O-N 3.09Å; K113-S115 WeakPolarHBondContact CG-OG 3.49Å; K113-S115 PolarHBondContact O-N 2Å; K113-T116 PolarHBondContact O-N 3.41Å; K113-T116 PolarHBondContact O-OG1 2.68Å; K113-T116 VanDerWaalsContact O-OG1 3.13Å
114	N	51.6	Low	56.2	Low	176 Å²	176	70.9 Å²	70.9	94%	0.941	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-12.1	178.4	-81.5	-8.8	0	0	0	114.7
115	S	42.1	Very low	56.5	Low	89 Å²	89	65.5 Å²	65.5	62%	0.622	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-6.7	-179.6	65.5	0	0	0	0	115.3	K113	K113-S115 WeakPolarHBondContact CG-OG 3.49Å; K113-S115 PolarHBondContact O-N 2Å
116	T	46.7	Very low	56.4	Low	71 Å²	71	64.9 Å²	64.9	44%	0.436	34%	0.336	S	S	.	.	S	Bend	trans	-105.8	126.1	-179.8	51.9	0	0	0	0	110.7	K113 K118	K113-T116 PolarHBondContact O-N 3.41Å; K113-T116 PolarHBondContact O-OG1 2.68Å; K113-T116 VanDerWaalsContact O-OG1 3.13Å; T116-K118 PolarHBondContact O-N 2.75Å
117	K	46.4	Very low	56	Low	219 Å²	219	64.8 Å²	64.8	95%	0.952	34%	0.335	S	S	*	.	S	Bend	trans	-59.7	6.9	173.9	-79.6	-173.3	175.4	-176.6	0	114.9
118	K	45.4	Very low	55.3	Low	155 Å²	155	68.1 Å²	68.1	67%	0.674	35%	0.353	S	S	*	.			trans	-113.4	120	175.9	-70.6	-171.6	176.5	-176.3	0	108.7	T116 N120	T116-K118 PolarHBondContact O-N 2.75Å; K118-N120 VanDerWaalsContact C-N 3.3Å; K118-N120 PolarHBondContact O-N 3.4Å
119	P	46.2	Very low	54.2	Low	87 Å²	87	76 Å²	76	57%	0.565	39%	0.39	S	S	*	.			trans	-83.8	3.8	-172.5	29.4	-28.9	0	0	0	114.7
120	N	51.1	Low	53.2	Low	50 Å²	50	77.9 Å²	77.9	27%	0.267	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-97.7	125.4	-161.2	-63.5	-7.2	0	0	0	112.2	K118 A122 E175	K118-N120 VanDerWaalsContact C-N 3.3Å; K118-N120 PolarHBondContact O-N 3.4Å; N120-A122 PolarHBondContact O-N 2.85Å; N120-E175 VanDerWaalsContact ND2-CD 3.27Å; N120-E175 PolarHBondContact ND2-OE2 3.5Å
121	R	55.6	Low	52.2	Low	21 Å²	21	81.3 Å²	81.3	8%	0.079	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-53	124.8	165.6	-74.6	174.1	179.4	-141.5	-10.4	107.9	V109 P137 S178 E180 I182 Y198	V109-R121 HydrophobicContact CG1-CB 4.01Å; V109-R121 HydrophobicContact CG1-CG 4.12Å; R121-P137 HydrophobicContact CB-CG 4.44Å; R121-P137 WeakPolarHBondContact O-CD 3.5Å; R121-S178 PolarHBondContact NE-O 3.37Å; R121-S178 PolarHBondContact NH2-O 3.39Å; R121-E180 PolarHBondContact NH1-O 3.29Å; R121-I182 HydrophobicContact CB-CD1 3.94Å; R121-I182 HydrophobicContact CG-CD1 4.48Å; R121-Y198 VanDerWaalsContact CZ-OH 3.28Å; R121-Y198 PolarHBondContact NH1-OH 3.29Å; R121-Y198 PolarHBondContact NH2-OH 2.89Å
122	A	58.7	Low	52	Low	16 Å²	16	80.9 Å²	80.9	13%	0.132	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	121.7	174.3	0	0	0	0	0	107.9	L110 N120 I134	L110-A122 HydrophobicContact CB-CB 4.24Å; L110-A122 HydrophobicContact CD1-CB 3.95Å; L110-A122 PolarHBondContact N-O 2.9Å; N120-A122 PolarHBondContact O-N 2.85Å; A122-I134 HydrophobicContact CB-CG2 3.5Å
123	Y	59.3	Low	52.2	Low	4 Å²	4	84.1 Å²	84.1	2%	0.016	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	121.1	164.9	172	-94	0	0	0	108	P76 H107 Q125 K133 I134 L135 I196	P76-Y123 HydrophobicContact CB-CD1 3.72Å; P76-Y123 HydrophobicContact CB-CD2 3.81Å; P76-Y123 HydrophobicContact CB-CE1 3.93Å; P76-Y123 HydrophobicContact CB-CE2 4.05Å; P76-Y123 HydrophobicContact CB-CG 3.6Å; P76-Y123 HydrophobicContact CG-CD2 4.06Å; P76-Y123 HydrophobicContact CG-CE1 4.38Å; P76-Y123 HydrophobicContact CG-CE2 3.91Å; P76-Y123 HydrophobicContact CG-CG 4.35Å; H107-Y123 HydrophobicContact CB-CE2 3.94Å; H107-Y123 PolarHBondContact CE1-OH 2.91Å; H107-Y123 AromaticContact ND1-CZ 3.85Å; H107-Y123 PolarHBondContact ND1-OH 3.43Å; Y123-Q125 HydrophobicContact CE1-CB 3.9Å; Y123-K133 VanDerWaalsContact O-O 3.14Å; Y123-I134 CarbonylContact O-C 3.59Å; Y123-I134 WeakPolarHBondContact O-CA 3.33Å; Y123-L135 WeakPolarHBondContact CB-O 3.48Å; Y123-L135 HydrophobicContact CD1-CB 3.94Å; Y123-L135 HydrophobicContact CD1-CD1 3.72Å; Y123-L135 HydrophobicContact CD1-CG 4.33Å; Y123-L135 HydrophobicContact CE1-CD1 3.88Å; Y123-L135 PolarHBondContact N-O 3.37Å; Y123-L135 PolarHBondContact O-N 2.77Å; Y123-I196 HydrophobicContact CD2-CD1 3.73Å; Y123-I196 HydrophobicContact CD2-CG2 4.27Å; Y123-I196 HydrophobicContact CE2-CD1 3.43Å; Y123-I196 VanDerWaalsContact CE2-CD1 3.43Å; Y123-I196 HydrophobicContact CE2-CG1 4.35Å; Y123-I196 HydrophobicContact CE2-CG2 4.11Å
124	V	58.9	Low	52.7	Low	8 Å²	8	80.3 Å²	80.3	5%	0.048	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	118.1	176.9	-179.4	0	0	0	0	108.2	C108 L110 H132 K133 I134	C108-V124 PolarHBondContact N-O 3.31Å; C108-V124 VanDerWaalsContact N-O 3.11Å; C108-V124 PolarHBondContact O-N 2.82Å; L110-V124 HydrophobicContact CD1-CG2 3.38Å; L110-V124 HydrophobicContact CD2-CG2 4.47Å; L110-V124 HydrophobicContact CG-CG2 3.61Å; V124-H132 HydrophobicContact CG1-CB 4.02Å; V124-K133 WeakPolarHBondContact CA-O 3.39Å; V124-I134 HydrophobicContact CG2-CG1 4.32Å
125	Q	58.1	Low	53.5	Low	24 Å²	24	73.8 Å²	73.8	11%	0.112	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	110.4	165.7	-166.6	178	-7.2	0	0	107.7	I105 Y123 H132 K133	I105-Q125 HydrophobicContact CG2-CB 4.43Å; I105-Q125 HydrophobicContact CG2-CG 3.18Å; Y123-Q125 HydrophobicContact CE1-CB 3.9Å; Q125-H132 WeakPolarHBondContact O-CA 3.34Å; Q125-K133 HydrophobicContact CB-CB 4.1Å; Q125-K133 PolarHBondContact N-O 3.42Å; Q125-K133 PolarHBondContact O-N 3.32Å
126	Q	55.1	Low	54.9	Low	16 Å²	16	73.4 Å²	73.4	8%	0.075	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	120.4	176.6	-164.8	-169.8	21.3	0	0	110.1	I105 T106 Q131 H369 F371	I105-Q126 WeakPolarHBondContact CA-O 3.29Å; T106-Q126 PolarHBondContact N-O 3.31Å; T106-Q126 PolarHBondContact O-N 3.2Å; T106-Q126 PolarHBondContact OG1-OE1 3.31Å; Q126-Q131 WeakPolarHBondContact CA-O 3.18Å; Q126-H369 PolarHBondContact NE2-O 3.12Å; Q126-F371 HydrophobicContact CB-CD2 4.44Å; Q126-F371 HydrophobicContact CG-CD2 4.42Å
127	T	53.8	Low	56.4	Low	30 Å²	30	70.1 Å²	70.1	18%	0.184	35%	0.351	C	S	.	.			trans	-81.8	159.1	168.2	68.5	0	0	0	0	110.4	Q129 G130 Q131	T127-Q129 PolarHBondContact O-N 3.06Å; T127-G130 PolarHBondContact O-N 2.88Å; T127-Q131 HydrophobicContact CG2-CB 4.41Å; T127-Q131 PolarHBondContact N-O 2.92Å; T127-Q131 WeakPolarHBondContact OG1-CB 3.45Å; T127-Q131 PolarHBondContact OG1-N 3.23Å
128	I	50.9	Low	58.1	Low	105 Å²	105	62.2 Å²	62.2	54%	0.538	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-26.1	174.4	-53.2	172.9	0	0	0	111.8	Q104 G130	Q104-I128 HydrophobicContact CB-CD1 3.77Å; Q104-I128 HydrophobicContact CB-CG1 3.87Å; Q104-I128 HydrophobicContact CG-CD1 4.16Å; Q104-I128 WeakPolarHBondContact O-CG1 3.46Å; I128-G130 VanDerWaalsContact C-N 3.25Å; I128-G130 PolarHBondContact O-N 2.86Å
129	Q	46.4	Very low	60	Low	167 Å²	167	56.1 Å²	56.1	78%	0.78	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	3.9	179.1	-62.9	-178.3	4	0	0	113.9	T127 Q131	T127-Q129 PolarHBondContact O-N 3.06Å; Q129-Q131 VanDerWaalsContact C-N 3.28Å; Q129-Q131 PolarHBondContact O-N 3.23Å
130	G	48.9	Very low	61.8	Low	40 Å²	40	53.8 Å²	53.8	41%	0.412	27%	0.273	S	S	.	.			trans	77.3	9.7	-180	0	0	0	0	0	114.4	T127 I128 H132	T127-G130 PolarHBondContact O-N 2.88Å; I128-G130 VanDerWaalsContact C-N 3.25Å; I128-G130 PolarHBondContact O-N 2.86Å; G130-H132 PolarHBondContact O-N 3.02Å
131	Q	46.7	Very low	63.4	Low	125 Å²	125	53.4 Å²	53.4	58%	0.584	27%	0.268	S	S	*	.			trans	-72.1	126	170.2	-62.1	-176.1	-23	0	0	108.6	Q126 T127 Q129	Q126-Q131 WeakPolarHBondContact CA-O 3.18Å; T127-Q131 HydrophobicContact CG2-CB 4.41Å; T127-Q131 PolarHBondContact N-O 2.92Å; T127-Q131 WeakPolarHBondContact OG1-CB 3.45Å; T127-Q131 PolarHBondContact OG1-N 3.23Å; Q129-Q131 VanDerWaalsContact C-N 3.28Å; Q129-Q131 PolarHBondContact O-N 3.23Å
132	H	59.3	Low	64.8	Low	104 Å²	104	56.8 Å²	56.8	48%	0.481	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	120.3	176.1	49.9	-86.3	0	0	0	108.6	V124 Q125 G130	V124-H132 HydrophobicContact CG1-CB 4.02Å; Q125-H132 WeakPolarHBondContact O-CA 3.34Å; G130-H132 PolarHBondContact O-N 3.02Å
133	K	61	Low	65.9	Low	103 Å²	103	58.9 Å²	58.9	45%	0.448	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	117	167.9	-166.7	-179.2	-177.5	-177.4	0	108.2	Y123 V124 Q125 L135	Y123-K133 VanDerWaalsContact O-O 3.14Å; V124-K133 WeakPolarHBondContact CA-O 3.39Å; Q125-K133 HydrophobicContact CB-CB 4.1Å; Q125-K133 PolarHBondContact N-O 3.42Å; Q125-K133 PolarHBondContact O-N 3.32Å; K133-L135 HydrophobicContact CD-CD1 4.26Å; K133-L135 HydrophobicContact CD-CG 4.39Å; K133-L135 HydrophobicContact CG-CG 4.3Å
134	I	64.7	Low	66.9	Low	77 Å²	77	60.6 Å²	60.6	40%	0.395	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	117.4	173.8	-66.5	169.2	0	0	0	108.1	A122 Y123 V124	A122-I134 HydrophobicContact CB-CG2 3.5Å; Y123-I134 CarbonylContact O-C 3.59Å; Y123-I134 WeakPolarHBondContact O-CA 3.33Å; V124-I134 HydrophobicContact CG2-CG1 4.32Å
135	L	68.2	Low	67.8	Low	39 Å²	39	60.2 Å²	60.2	20%	0.204	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	141.7	173.3	-67.9	156.1	0	0	0	109.2	Y123 K133	Y123-L135 WeakPolarHBondContact CB-O 3.48Å; Y123-L135 HydrophobicContact CD1-CB 3.94Å; Y123-L135 HydrophobicContact CD1-CD1 3.72Å; Y123-L135 HydrophobicContact CD1-CG 4.33Å; Y123-L135 HydrophobicContact CE1-CD1 3.88Å; Y123-L135 PolarHBondContact N-O 3.37Å; Y123-L135 PolarHBondContact O-N 2.77Å; K133-L135 HydrophobicContact CD-CD1 4.26Å; K133-L135 HydrophobicContact CD-CG 4.39Å; K133-L135 HydrophobicContact CG-CG 4.3Å
136	I	72.6	Confident	68.5	Low	81 Å²	81	62.4 Å²	62.4	42%	0.415	31%	0.308	S	S	.	.			trans	-87.3	120.1	170.8	-60.9	173.9	0	0	0	106.3	E175	I136-E175 HydrophobicContact CG2-CB 4.48Å; I136-E175 HydrophobicContact CG2-CG 4.15Å
137	P	77.2	Confident	69.3	Low	1 Å²	1	63.6 Å²	63.6	1%	0.006	32%	0.318	C	S	.	.			trans	-69.3	137.8	176.5	28.2	-31.1	0	0	0	110	S75 R121 C176 I182	S75-P137 CarbonylContact O-C 3.49Å; S75-P137 VanDerWaalsContact O-CA 3.28Å; S75-P137 WeakPolarHBondContact O-CA 3.48Å; R121-P137 HydrophobicContact CB-CG 4.44Å; R121-P137 WeakPolarHBondContact O-CD 3.5Å; P137-C176 HydrophobicContact CB-CB 4.27Å; P137-C176 HydrophobicContact CG-CB 4.04Å; P137-C176 WeakPolarHBondContact O-CB 3.49Å; P137-C176 PolarHBondContact O-N 2.93Å; P137-C176 VanDerWaalsContact O-N 3.07Å; P137-C176 PolarHBondContact O-SG 3.1Å; P137-I182 HydrophobicContact CB-CD1 4.06Å; P137-I182 HydrophobicContact CB-CG1 4.04Å; P137-I182 HydrophobicContact CB-CG2 4.01Å; P137-I182 HydrophobicContact CG-CD1 3.59Å; P137-I182 HydrophobicContact CG-CG1 4.04Å
138	E	81.7	Confident	69.7	Low	54 Å²	54	69.3 Å²	69.3	25%	0.252	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	152.7	-175.6	-66.2	177.2	158.9	0	0	110.7	S75 C79 S174	S75-E138 PolarHBondContact N-O 3.49Å; S75-E138 VanDerWaalsContact N-O 3.11Å; S75-E138 PolarHBondContact O-N 3.03Å; S75-E138 PolarHBondContact OG-O 3.36Å; C79-E138 HydrophobicContact CB-CB 3.85Å; C79-E138 WeakPolarHBondContact CB-OE2 3.45Å; C79-E138 PolarHBondContact N-OE2 3.34Å; E138-S174 WeakPolarHBondContact CA-O 3.06Å
139	K	85.1	Confident	69.8	Low	27 Å²	27	66 Å²	66	12%	0.117	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	148.7	171.6	61.3	-175.6	176.7	-161.2	0	109.9	W71 S72 C173 S174 E180	W71-K139 HydrophobicContact CB-CD 4.33Å; W71-K139 HydrophobicContact CD2-CD 4.18Å; W71-K139 HydrophobicContact CD2-CG 4.35Å; W71-K139 HydrophobicContact CE3-CB 4.3Å; W71-K139 HydrophobicContact CE3-CD 4.04Å; W71-K139 HydrophobicContact CE3-CG 3.7Å; W71-K139 HydrophobicContact CG-CD 4.34Å; W71-K139 HydrophobicContact CZ3-CG 4.13Å; S72-K139 WeakPolarHBondContact O-CB 3.01Å; K139-C173 WeakPolarHBondContact O-CA 3.47Å; K139-S174 WeakPolarHBondContact CE-OG 3.42Å; K139-S174 WeakPolarHBondContact CG-OG 3.49Å; K139-S174 PolarHBondContact N-O 2.84Å; K139-S174 PolarHBondContact O-N 3.48Å; K139-E180 IonicContact NZ-OE1 2.69Å; K139-E180 PolarHBondContact NZ-OE1 3.12Å; K139-E180 IonicContact NZ-OE2 2.89Å; K139-E180 PolarHBondContact NZ-OE2 3.49Å
140	Q	84.4	Confident	70	Confident	38 Å²	38	65.6 Å²	65.6	18%	0.178	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	150.3	-177.5	85	-174.1	-0.4	0	0	111.5	S72 C79 E172 R186	S72-Q140 WeakPolarHBondContact CB-O 3.42Å; S72-Q140 PolarHBondContact N-O 2.88Å; S72-Q140 PolarHBondContact OG-N 3.44Å; S72-Q140 PolarHBondContact OG-O 3.13Å; C79-Q140 WeakPolarHBondContact SG-CB 3.39Å; Q140-E172 CarbonylContact C-O 3.4Å; Q140-E172 VanDerWaalsContact CA-O 3.25Å; Q140-E172 WeakPolarHBondContact CA-O 3.38Å; Q140-R186 VanDerWaalsContact CD-CD 3.47Å; Q140-R186 VanDerWaalsContact NE2-CD 3.29Å; Q140-R186 VanDerWaalsContact OE1-NH1 3.15Å
141	R	85.6	Confident	69.8	Low	42 Å²	42	65.5 Å²	65.5	16%	0.158	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	156.7	162.3	65.9	178.3	-177.8	-162.5	-8.1	109	W68 W71 F171 E172	W68-R141 HydrophobicContact CD2-CG 4.46Å; W68-R141 HydrophobicContact CE3-CG 3.84Å; W68-R141 HydrophobicContact CZ3-CG 4.26Å; W71-R141 HydrophobicContact CD2-CB 4.12Å; W71-R141 HydrophobicContact CD2-CG 4.18Å; W71-R141 HydrophobicContact CE3-CB 3.86Å; W71-R141 HydrophobicContact CE3-CG 3.91Å; W71-R141 HydrophobicContact CH2-CG 3.82Å; W71-R141 HydrophobicContact CZ2-CG 4.1Å; W71-R141 VanDerWaalsContact CZ2-CZ 3.46Å; W71-R141 HydrophobicContact CZ3-CB 4.14Å; W71-R141 HydrophobicContact CZ3-CG 3.72Å; R141-F171 WeakPolarHBondContact O-CA 3.45Å; R141-E172 HydrophobicContact CG-CB 3.91Å; R141-E172 IonicContact CZ-OE1 3.69Å; R141-E172 IonicContact CZ-OE2 3.12Å; R141-E172 PolarHBondContact N-O 2.84Å; R141-E172 IonicContact NE-OE1 3.81Å; R141-E172 IonicContact NE-OE2 2.72Å; R141-E172 PolarHBondContact NE-OE2 3.21Å; R141-E172 IonicContact NH2-OE1 2.9Å; R141-E172 PolarHBondContact NH2-OE1 3.21Å; R141-E172 IonicContact NH2-OE2 2.72Å; R141-E172 PolarHBondContact NH2-OE2 3.48Å; R141-E172 PolarHBondContact O-N 3.46Å
142	F	84.4	Confident	70	Confident	92 Å²	92	66.4 Å²	66.4	40%	0.404	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	158.3	179.1	65.7	-87.9	0	0	0	111.2	S69 T144 V170 F171	S69-F142 WeakPolarHBondContact CB-O 3.33Å; S69-F142 PolarHBondContact N-O 3.49Å; S69-F142 WeakPolarHBondContact OG-CD1 3.25Å; S69-F142 PolarHBondContact OG-N 3.39Å; S69-F142 PolarHBondContact OG-O 3.35Å; F142-T144 HydrophobicContact CD2-CG2 4.2Å; F142-T144 HydrophobicContact CE2-CG2 4.46Å; F142-V170 CarbonylContact C-O 3.57Å; F142-V170 WeakPolarHBondContact CA-O 3.35Å; F142-F171 HydrophobicContact CB-CD1 3.74Å; F142-F171 HydrophobicContact CB-CE1 3.82Å; F142-F171 HydrophobicContact CB-CG 4.43Å; F142-F171 HydrophobicContact CG-CE1 4.46Å
143	R	80.9	Confident	69.5	Low	60 Å²	60	66.4 Å²	66.4	23%	0.226	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	145.8	165.9	62.3	177.8	-177	-174.1	0.3	109.3	W65 W68 T169 V170	W65-R143 HydrophobicContact CD2-CG 4.48Å; W65-R143 HydrophobicContact CE3-CB 4.48Å; W65-R143 HydrophobicContact CE3-CG 3.69Å; W65-R143 HydrophobicContact CZ3-CG 4.15Å; W68-R143 HydrophobicContact CD2-CB 4.06Å; W68-R143 HydrophobicContact CD2-CG 4Å; W68-R143 HydrophobicContact CE3-CB 3.74Å; W68-R143 HydrophobicContact CE3-CG 3.67Å; W68-R143 HydrophobicContact CH2-CG 3.9Å; W68-R143 HydrophobicContact CZ2-CG 4.19Å; W68-R143 HydrophobicContact CZ3-CB 4.17Å; W68-R143 HydrophobicContact CZ3-CG 3.62Å; R143-T169 CarbonylContact O-C 3.55Å; R143-T169 WeakPolarHBondContact O-CA 3.37Å; R143-V170 HydrophobicContact CG-CB 4.02Å; R143-V170 PolarHBondContact N-O 3.43Å; R143-V170 PolarHBondContact O-N 2.98Å
144	T	81.4	Confident	68.7	Low	39 Å²	39	63.6 Å²	63.6	24%	0.239	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	149.9	179.5	64.2	0	0	0	0	110.5	C66 F142 D146 D168 T169	C66-T144 VanDerWaalsContact CB-O 3.29Å; C66-T144 WeakPolarHBondContact CB-O 3.09Å; C66-T144 PolarHBondContact N-O 3.43Å; F142-T144 HydrophobicContact CD2-CG2 4.2Å; F142-T144 HydrophobicContact CE2-CG2 4.46Å; T144-D146 PolarHBondContact O-N 3.31Å; T144-D168 CarbonylContact C-O 3.59Å; T144-D168 VanDerWaalsContact CA-O 3.3Å; T144-D168 WeakPolarHBondContact CA-O 3.44Å; T144-T169 HydrophobicContact CG2-CG2 3.53Å
145	C	77.1	Confident	67.8	Low	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.335	C	S	.	.	S	Bend	trans	-93.3	78.4	174.5	-178.8	0	0	0	0	110.2	W65 C164 F165 P166 G167 D168	W65-C145 HydrophobicContact CD2-CB 4.42Å; W65-C145 HydrophobicContact CE3-CB 4.04Å; W65-C145 HydrophobicContact CH2-CB 4.29Å; W65-C145 HydrophobicContact CZ3-CB 3.98Å; C145-C164 HydrophobicContact CB-CB 3.53Å; C145-C164 WeakPolarHBondContact CB-SG 3.28Å; C145-C164 WeakPolarHBondContact SG-CB 3.23Å; C145-C164 PolarHBondContact SG-O 2.98Å; C145-C164 CovalentContact SG-SG 2Å; C145-C164 PolarHBondContact SG-SG 2.01Å; C145-F165 VanDerWaalsContact CB-O 3.24Å; C145-F165 WeakPolarHBondContact CB-O 3.46Å; C145-F165 PolarHBondContact SG-O 3.06Å; C145-F165 VanDerWaalsContact SG-O 3.35Å; C145-P166 WeakPolarHBondContact O-CA 2.87Å; C145-G167 PolarHBondContact O-N 2.96Å; C145-D168 HydrophobicContact CB-CB 4.02Å; C145-D168 PolarHBondContact N-O 2.65Å
146	D	73.6	Confident	67	Low	70 Å²	70	68.4 Å²	68.4	37%	0.374	36%	0.355	S	S	.	.			trans	-143	7.2	175.5	-79.6	-41.8	0	0	0	113.6	R63 T144 Q148 G167	R63-D146 IonicContact CZ-OD1 3.8Å; R63-D146 IonicContact NH1-OD1 2.67Å; R63-D146 PolarHBondContact NH1-OD1 3.14Å; T144-D146 PolarHBondContact O-N 3.31Å; D146-Q148 PolarHBondContact O-N 3.37Å; D146-G167 PolarHBondContact OD1-N 3.02Å
147	C	71.9	Confident	65.8	Low	42 Å²	42	70 Å²	70	28%	0.284	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	124.5	-178.6	-80.4	0	0	0	0	110.9	K64 C66	K64-C147 PolarHBondContact N-O 2.95Å; K64-C147 PolarHBondContact O-N 3.23Å; C66-C147 WeakPolarHBondContact CA-SG 3.06Å; C66-C147 HydrophobicContact CB-CB 4.05Å; C66-C147 WeakPolarHBondContact CB-SG 2.93Å; C66-C147 WeakPolarHBondContact SG-CB 3.16Å; C66-C147 PolarHBondContact SG-N 2.95Å; C66-C147 CovalentContact SG-SG 2.04Å; C66-C147 PolarHBondContact SG-SG 2.92Å
148	Q	61.8	Low	64.4	Low	149 Å²	149	75.8 Å²	75.8	70%	0.696	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	121	169.9	-63.4	-178.4	3.1	0	0	108.4	V61 D146	V61-Q148 HydrophobicContact CG1-CG 4.2Å; D146-Q148 PolarHBondContact O-N 3.37Å
149	S	53.3	Low	62.7	Low	37 Å²	37	78.7 Å²	78.7	26%	0.259	41%	0.407	S	S	.	.			trans	-110.5	120	168.8	81.8	0	0	0	0	109.5	K64 S151 N154	K64-S149 WeakPolarHBondContact CD-OG 3.45Å; K64-S149 WeakPolarHBondContact CE-OG 2.97Å; K64-S149 PolarHBondContact NZ-OG 3.43Å; S149-S151 PolarHBondContact O-N 3.48Å; S149-N154 PolarHBondContact O-ND2 2.93Å
150	V	49.9	Very low	60.9	Low	158 Å²	158	79.3 Å²	79.3	96%	0.958	42%	0.415	S	S	*	.			trans	-85.4	87.7	163.9	-160.9	0	0	0	0	106.2
151	S	46	Very low	59.4	Low	38 Å²	38	88.4 Å²	88.4	27%	0.266	45%	0.447	S	S	.	.			trans	-108.7	131	178.9	-169.7	0	0	0	0	109.7	S149 L153 N154	S149-S151 PolarHBondContact O-N 3.48Å; S151-L153 PolarHBondContact O-N 2.93Å; S151-L153 VanDerWaalsContact O-N 3.09Å; S151-L153 PolarHBondContact OG-N 2.78Å; S151-N154 WeakPolarHBondContact O-CA 3.14Å; S151-N154 WeakPolarHBondContact O-CB 3.33Å; S151-N154 PolarHBondContact O-N 3.4Å
152	L	49.4	Very low	58	Low	144 Å²	144	91.4 Å²	91.4	75%	0.754	46%	0.463	S	S	*	.	H	α-helix	trans	-56.4	-22.9	170.2	-77.4	165.5	0	0	0	112	N154 V155 F156	L152-N154 VanDerWaalsContact C-N 3.31Å; L152-V155 HydrophobicContact CD2-CG2 4.46Å; L152-V155 WeakPolarHBondContact O-CB 3.33Å; L152-V155 PolarHBondContact O-N 2.81Å; L152-V155 VanDerWaalsContact O-N 3.14Å; L152-F156 WeakPolarHBondContact O-CD2 3.39Å
153	L	49.2	Very low	56.7	Low	103 Å²	103	93.4 Å²	93.4	54%	0.539	47%	0.473	S	S	.	.	H	α-helix	trans	-72.2	-21	172	-73.6	148.9	0	0	0	113.4	S151 V155 F156 R157 L158	S151-L153 PolarHBondContact O-N 2.93Å; S151-L153 VanDerWaalsContact O-N 3.09Å; S151-L153 PolarHBondContact OG-N 2.78Å; L153-V155 PolarHBondContact O-N 3.32Å; L153-F156 PolarHBondContact O-N 3.46Å; L153-R157 PolarHBondContact O-N 3.13Å; L153-L158 HydrophobicContact CD2-CD1 3.85Å
154	N	44.2	Very low	56.1	Low	45 Å²	45	91.5 Å²	91.5	24%	0.241	47%	0.469	C	S	.	.	H	α-helix	trans	-66.5	-29	167.7	-78	2.2	0	0	0	111	K64 S149 S151 L152 F156 R157	K64-N154 WeakPolarHBondContact CE-OD1 3.46Å; K64-N154 PolarHBondContact NZ-OD1 3.37Å; S149-N154 PolarHBondContact O-ND2 2.93Å; S151-N154 WeakPolarHBondContact O-CA 3.14Å; S151-N154 WeakPolarHBondContact O-CB 3.33Å; S151-N154 PolarHBondContact O-N 3.4Å; L152-N154 VanDerWaalsContact C-N 3.31Å; N154-F156 VanDerWaalsContact C-N 3.29Å; N154-F156 PolarHBondContact O-N 3.18Å; N154-R157 PolarHBondContact O-N 3.05Å
155	V	47.1	Very low	55.4	Low	77 Å²	77	96.7 Å²	96.7	47%	0.467	49%	0.489	S	S	.	.	H	α-helix	trans	-65	-36.8	175.2	-174.4	0	0	0	0	110.4	L152 L153 R157	L152-V155 HydrophobicContact CD2-CG2 4.46Å; L152-V155 WeakPolarHBondContact O-CB 3.33Å; L152-V155 PolarHBondContact O-N 2.81Å; L152-V155 VanDerWaalsContact O-N 3.14Å; L153-V155 PolarHBondContact O-N 3.32Å; V155-R157 VanDerWaalsContact C-N 3.33Å; V155-R157 PolarHBondContact O-N 3.11Å
156	F	50.9	Low	54.9	Low	140 Å²	140	99.6 Å²	99.6	61%	0.614	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	6.5	-179.4	-68.9	-71.6	0	0	0	114.8	L152 L153 N154 L158	L152-F156 WeakPolarHBondContact O-CD2 3.39Å; L153-F156 PolarHBondContact O-N 3.46Å; N154-F156 VanDerWaalsContact C-N 3.29Å; N154-F156 PolarHBondContact O-N 3.18Å; F156-L158 PolarHBondContact O-N 3.25Å
157	R	48.1	Very low	54.6	Low	114 Å²	114	97.2 Å²	97.2	43%	0.43	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.4	30.1	177.2	-70.9	-179.7	160.1	-160.6	-15.7	114.5	S48 L153 N154 V155 V159	S48-R157 VanDerWaalsContact CB-NH1 3.32Å; S48-R157 PolarHBondContact O-NH2 3.49Å; S48-R157 VanDerWaalsContact O-NH2 3.16Å; S48-R157 PolarHBondContact OG-NE 2.72Å; S48-R157 PolarHBondContact OG-NH1 2.72Å; S48-R157 PolarHBondContact OG-NH2 2.9Å; L153-R157 PolarHBondContact O-N 3.13Å; N154-R157 PolarHBondContact O-N 3.05Å; V155-R157 VanDerWaalsContact C-N 3.33Å; V155-R157 PolarHBondContact O-N 3.11Å; R157-V159 PolarHBondContact O-N 2.91Å
158	L	47.3	Very low	54.7	Low	122 Å²	122	95.3 Å²	95.3	64%	0.639	49%	0.487	S	S	*	.			trans	-68.5	108.7	171	-73.5	168.1	0	0	0	106.3	L153 F156 S160	L153-L158 HydrophobicContact CD2-CD1 3.85Å; F156-L158 PolarHBondContact O-N 3.25Å; L158-S160 VanDerWaalsContact C-N 3.3Å; L158-S160 PolarHBondContact O-N 2.93Å
159	V	44.8	Very low	55.5	Low	115 Å²	115	88.6 Å²	88.6	70%	0.697	46%	0.456	S	S	*	.			trans	-50.8	94.4	178	179	0	0	0	0	108.2	R157 R161	R157-V159 PolarHBondContact O-N 2.91Å; V159-R161 PolarHBondContact O-N 2.87Å
160	S	48.5	Very low	56.8	Low	41 Å²	41	88.1 Å²	88.1	29%	0.287	45%	0.452	S	S	.	.			trans	-71.5	126.1	167.9	63	0	0	0	0	105.6	L158 H162	L158-S160 VanDerWaalsContact C-N 3.3Å; L158-S160 PolarHBondContact O-N 2.93Å; S160-H162 PolarHBondContact O-N 2.99Å
161	R	51.9	Low	58.4	Low	228 Å²	228	82.2 Å²	82.2	86%	0.86	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	26.8	173.8	-70.3	-175.1	179.9	-177.6	1.1	113.7	V159	V159-R161 PolarHBondContact O-N 2.87Å
162	H	55.6	Low	60.3	Low	106 Å²	106	81.9 Å²	81.9	49%	0.491	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.5	17.5	-168.7	-58.4	-31.8	0	0	0	111.5	S160 C164	S160-H162 PolarHBondContact O-N 2.99Å; H162-C164 PolarHBondContact O-N 2.7Å
163	E	58.9	Low	62	Low	133 Å²	133	76.4 Å²	76.4	62%	0.621	38%	0.381	S	S	*	.	B	Isolated β-bridge	trans	-60.1	129.2	164.2	-69.6	178.2	-177.5	0	0	108.5
164	C	67.7	Low	63.7	Low	21 Å²	21	73.1 Å²	73.1	14%	0.142	37%	0.366	C	S	.	.			trans	-143.3	155	-178.5	54.9	0	0	0	0	108.9	K64 W65 C145 H162	K64-C164 VanDerWaalsContact C-SG 3.53Å; W65-C164 HydrophobicContact CD2-CB 4.03Å; W65-C164 HydrophobicContact CG-CB 4.42Å; W65-C164 HydrophobicContact CH2-CB 4.21Å; W65-C164 HydrophobicContact CZ2-CB 3.49Å; W65-C164 VanDerWaalsContact CZ2-CB 3.49Å; W65-C164 PolarHBondContact N-SG 3Å; W65-C164 VanDerWaalsContact N-SG 3.38Å; C145-C164 HydrophobicContact CB-CB 3.53Å; C145-C164 WeakPolarHBondContact CB-SG 3.28Å; C145-C164 WeakPolarHBondContact SG-CB 3.23Å; C145-C164 PolarHBondContact SG-O 2.98Å; C145-C164 CovalentContact SG-SG 2Å; C145-C164 PolarHBondContact SG-SG 2.01Å; H162-C164 PolarHBondContact O-N 2.7Å
165	F	65.7	Low	65.6	Low	147 Å²	147	75.7 Å²	75.7	65%	0.645	38%	0.377	S	S	*	.			trans	-85.1	143	179.6	-59	-86.3	0	0	0	110.5	C145 G167 D168	C145-F165 VanDerWaalsContact CB-O 3.24Å; C145-F165 WeakPolarHBondContact CB-O 3.46Å; C145-F165 PolarHBondContact SG-O 3.06Å; C145-F165 VanDerWaalsContact SG-O 3.35Å; F165-G167 PolarHBondContact O-N 3.16Å; F165-D168 WeakPolarHBondContact CA-OD2 3.03Å; F165-D168 WeakPolarHBondContact CB-OD2 3.43Å; F165-D168 WeakPolarHBondContact CD2-OD2 2.94Å; F165-D168 PolarHBondContact N-OD2 3.45Å; F165-D168 VanDerWaalsContact O-CB 3.25Å; F165-D168 WeakPolarHBondContact O-CB 3.28Å; F165-D168 PolarHBondContact O-N 3.1Å
166	P	66.4	Low	67.2	Low	61 Å²	61	72.3 Å²	72.3	40%	0.396	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	129.8	177.1	21.2	-33.3	0	0	0	111.4	C145 D168	C145-P166 WeakPolarHBondContact O-CA 2.87Å; P166-D168 VanDerWaalsContact C-N 3.31Å
167	G	68.7	Low	68.2	Low	20 Å²	20	67.1 Å²	67.1	21%	0.206	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	4.7	-179.1	0	0	0	0	0	115.4	K86 C145 D146 F165	K86-G167 PolarHBondContact N-O 3.4Å; C145-G167 PolarHBondContact O-N 2.96Å; D146-G167 PolarHBondContact OD1-N 3.02Å; F165-G167 PolarHBondContact O-N 3.16Å
168	D	73.1	Confident	69.1	Low	2 Å²	2	64.3 Å²	64.3	1%	0.011	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	138.6	170.2	-72.6	-19.7	0	0	0	110.8	W65 F83 N85 T144 C145 F165 P166	W65-D168 HydrophobicContact CH2-CB 3.81Å; W65-D168 HydrophobicContact CZ3-CB 4.37Å; F83-D168 HydrophobicContact CE2-CB 3.6Å; F83-D168 WeakPolarHBondContact CE2-OD2 3.07Å; F83-D168 HydrophobicContact CZ-CB 3.71Å; F83-D168 WeakPolarHBondContact CZ-OD1 3.5Å; F83-D168 WeakPolarHBondContact CZ-OD2 3.2Å; N85-D168 PolarHBondContact ND2-OD1 3.37Å; T144-D168 CarbonylContact C-O 3.59Å; T144-D168 VanDerWaalsContact CA-O 3.3Å; T144-D168 WeakPolarHBondContact CA-O 3.44Å; C145-D168 HydrophobicContact CB-CB 4.02Å; C145-D168 PolarHBondContact N-O 2.65Å; F165-D168 WeakPolarHBondContact CA-OD2 3.03Å; F165-D168 WeakPolarHBondContact CB-OD2 3.43Å; F165-D168 WeakPolarHBondContact CD2-OD2 2.94Å; F165-D168 PolarHBondContact N-OD2 3.45Å; F165-D168 VanDerWaalsContact O-CB 3.25Å; F165-D168 WeakPolarHBondContact O-CB 3.28Å; F165-D168 PolarHBondContact O-N 3.1Å; P166-D168 VanDerWaalsContact C-N 3.31Å
169	T	79.1	Confident	70.1	Confident	9 Å²	9	65.5 Å²	65.5	6%	0.055	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	133.3	177.3	62.7	0	0	0	0	110.2	F83 V84 R143 T144 F171	F83-T169 WeakPolarHBondContact CA-O 2.93Å; V84-T169 PolarHBondContact N-O 3.23Å; V84-T169 PolarHBondContact O-N 3.02Å; V84-T169 PolarHBondContact O-OG1 3.46Å; V84-T169 VanDerWaalsContact O-OG1 3.07Å; R143-T169 CarbonylContact O-C 3.55Å; R143-T169 WeakPolarHBondContact O-CA 3.37Å; T144-T169 HydrophobicContact CG2-CG2 3.53Å; T169-F171 WeakPolarHBondContact OG1-CE2 3.18Å
170	V	81.5	Confident	71.5	Confident	27 Å²	27	63.2 Å²	63.2	16%	0.164	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	128.9	175.4	174.6	0	0	0	0	108.2	W65 W68 F83 F142 R143	W65-V170 HydrophobicContact CE3-CG2 4.49Å; W65-V170 HydrophobicContact CH2-CB 4.32Å; W65-V170 HydrophobicContact CH2-CG2 3.27Å; W65-V170 HydrophobicContact CZ2-CG2 3.85Å; W65-V170 HydrophobicContact CZ3-CB 4.21Å; W65-V170 HydrophobicContact CZ3-CG2 3.63Å; W68-V170 HydrophobicContact CH2-CB 4.3Å; W68-V170 HydrophobicContact CH2-CG1 3.64Å; W68-V170 HydrophobicContact CZ3-CG1 4.17Å; F83-V170 HydrophobicContact CD2-CG2 3.72Å; F83-V170 HydrophobicContact CE2-CG2 4.5Å; F142-V170 CarbonylContact C-O 3.57Å; F142-V170 WeakPolarHBondContact CA-O 3.35Å; R143-V170 HydrophobicContact CG-CB 4.02Å; R143-V170 PolarHBondContact N-O 3.43Å; R143-V170 PolarHBondContact O-N 2.98Å
171	F	82.5	Confident	72.9	Confident	33 Å²	33	66.2 Å²	66.2	15%	0.145	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	138.1	174.6	-62.3	-93.1	0	0	0	110.4	F80 G82 V84 R141 F142 T169	F80-F171 HydrophobicContact CD1-CB 4.37Å; F80-F171 HydrophobicContact CD1-CD2 4.05Å; F80-F171 HydrophobicContact CD1-CG 4.27Å; F80-F171 HydrophobicContact CE1-CD2 4.46Å; F80-F171 WeakPolarHBondContact O-CB 3.28Å; G82-F171 PolarHBondContact N-O 3.3Å; G82-F171 PolarHBondContact O-N 3.43Å; V84-F171 HydrophobicContact CB-CE2 4.14Å; V84-F171 HydrophobicContact CG2-CD2 4.07Å; V84-F171 HydrophobicContact CG2-CE2 3.77Å; R141-F171 WeakPolarHBondContact O-CA 3.45Å; F142-F171 HydrophobicContact CB-CD1 3.74Å; F142-F171 HydrophobicContact CB-CE1 3.82Å; F142-F171 HydrophobicContact CB-CG 4.43Å; F142-F171 HydrophobicContact CG-CE1 4.46Å; T169-F171 WeakPolarHBondContact OG1-CE2 3.18Å
172	E	85.2	Confident	74.1	Confident	32 Å²	32	55.5 Å²	55.5	15%	0.15	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	132.4	176.7	-174.2	179.2	169.7	0	0	109.9	W68 W71 Q140 R141	W68-E172 HydrophobicContact CH2-CB 3.99Å; W68-E172 WeakPolarHBondContact CH2-OE2 3.28Å; W68-E172 WeakPolarHBondContact CZ2-OE2 3.14Å; W68-E172 HydrophobicContact CZ3-CB 3.92Å; W71-E172 HydrophobicContact CH2-CG 4.15Å; Q140-E172 CarbonylContact C-O 3.4Å; Q140-E172 VanDerWaalsContact CA-O 3.25Å; Q140-E172 WeakPolarHBondContact CA-O 3.38Å; R141-E172 HydrophobicContact CG-CB 3.91Å; R141-E172 IonicContact CZ-OE1 3.69Å; R141-E172 IonicContact CZ-OE2 3.12Å; R141-E172 PolarHBondContact N-O 2.84Å; R141-E172 IonicContact NE-OE1 3.81Å; R141-E172 IonicContact NE-OE2 2.72Å; R141-E172 PolarHBondContact NE-OE2 3.21Å; R141-E172 IonicContact NH2-OE1 2.9Å; R141-E172 PolarHBondContact NH2-OE1 3.21Å; R141-E172 IonicContact NH2-OE2 2.72Å; R141-E172 PolarHBondContact NH2-OE2 3.48Å; R141-E172 PolarHBondContact O-N 3.46Å
173	C	86.6	Confident	75.2	Confident	29 Å²	29	52.2 Å²	52.2	20%	0.196	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	139.7	-179.5	-60.5	0	0	0	0	109.9	C79 F80 K81 K139	C79-C173 VanDerWaalsContact C-SG 3.53Å; C79-C173 HydrophobicContact CB-CB 3.64Å; C79-C173 WeakPolarHBondContact CB-SG 3.34Å; C79-C173 WeakPolarHBondContact SG-CA 3.31Å; C79-C173 WeakPolarHBondContact SG-CB 3.01Å; C79-C173 CovalentContact SG-SG 2.01Å; C79-C173 PolarHBondContact SG-SG 3.01Å; F80-C173 PolarHBondContact O-SG 3.02Å; K81-C173 HydrophobicContact CB-CB 4.37Å; K81-C173 PolarHBondContact N-SG 3.31Å; K81-C173 VanDerWaalsContact N-SG 3.43Å; K139-C173 WeakPolarHBondContact O-CA 3.47Å
174	S	84	Confident	75.8	Confident	33 Å²	33	49.7 Å²	49.7	23%	0.231	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	151.3	168.9	59.2	0	0	0	0	111.2	W71 E138 K139	W71-S174 WeakPolarHBondContact CH2-OG 3.49Å; W71-S174 WeakPolarHBondContact CZ3-OG 3.35Å; E138-S174 WeakPolarHBondContact CA-O 3.06Å; K139-S174 WeakPolarHBondContact CE-OG 3.42Å; K139-S174 WeakPolarHBondContact CG-OG 3.49Å; K139-S174 PolarHBondContact N-O 2.84Å; K139-S174 PolarHBondContact O-N 3.48Å
175	E	83.1	Confident	75.9	Confident	99 Å²	99	50.6 Å²	50.6	46%	0.463	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	146.4	172.3	-61.5	177.1	167	0	0	109.7	N120 I136	N120-E175 VanDerWaalsContact ND2-CD 3.27Å; N120-E175 PolarHBondContact ND2-OE2 3.5Å; I136-E175 HydrophobicContact CG2-CB 4.48Å; I136-E175 HydrophobicContact CG2-CG 4.15Å
176	C	82	Confident	76.3	Confident	7 Å²	7	44.7 Å²	44.7	5%	0.047	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-69.4	137.7	176.8	-69.3	0	0	0	0	112.1	C74 P137 E180	C74-C176 WeakPolarHBondContact CA-SG 3.24Å; C74-C176 HydrophobicContact CB-CB 3.98Å; C74-C176 WeakPolarHBondContact CB-SG 3.25Å; C74-C176 VanDerWaalsContact SG-CA 3.58Å; C74-C176 WeakPolarHBondContact SG-CB 3.34Å; C74-C176 CovalentContact SG-SG 2.02Å; C74-C176 PolarHBondContact SG-SG 3.36Å; P137-C176 HydrophobicContact CB-CB 4.27Å; P137-C176 HydrophobicContact CG-CB 4.04Å; P137-C176 WeakPolarHBondContact O-CB 3.49Å; P137-C176 PolarHBondContact O-N 2.93Å; P137-C176 VanDerWaalsContact O-N 3.07Å; P137-C176 PolarHBondContact O-SG 3.1Å; C176-E180 WeakPolarHBondContact CA-OE2 3.14Å
177	G	71.7	Confident	76.3	Confident	30 Å²	30	47.8 Å²	47.8	31%	0.309	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-65.5	158.1	174.8	0	0	0	0	0	112.1	N179 E180	G177-N179 PolarHBondContact O-N 3.47Å; G177-E180 PolarHBondContact N-OE2 3.36Å; G177-E180 PolarHBondContact O-N 2.97Å; G177-E180 VanDerWaalsContact O-N 3.13Å
178	S	66.2	Low	75.9	Confident	56 Å²	56	51.4 Å²	51.4	39%	0.392	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-19	179.1	54.9	0	0	0	0	114.3	R121	R121-S178 PolarHBondContact NE-O 3.37Å; R121-S178 PolarHBondContact NH2-O 3.39Å
179	N	68.6	Low	75.4	Confident	147 Å²	147	53.6 Å²	53.6	79%	0.786	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	0.3	-177.5	-62	-15.3	0	0	0	113.3	G177	G177-N179 PolarHBondContact O-N 3.47Å
180	E	74.7	Confident	74.5	Confident	66 Å²	66	60.8 Å²	60.8	31%	0.308	33%	0.332	S	S	.	.			trans	-84.1	135.6	-176.5	-66.6	-177.8	150.6	0	0	111.4	C74 R121 K139 C176 G177	C74-E180 HydrophobicContact CB-CB 4.46Å; C74-E180 PolarHBondContact SG-OE2 2.93Å; R121-E180 PolarHBondContact NH1-O 3.29Å; K139-E180 IonicContact NZ-OE1 2.69Å; K139-E180 PolarHBondContact NZ-OE1 3.12Å; K139-E180 IonicContact NZ-OE2 2.89Å; K139-E180 PolarHBondContact NZ-OE2 3.49Å; C176-E180 WeakPolarHBondContact CA-OE2 3.14Å; G177-E180 PolarHBondContact N-OE2 3.36Å; G177-E180 PolarHBondContact O-N 2.97Å; G177-E180 VanDerWaalsContact O-N 3.13Å
181	K	77.5	Confident	73.5	Confident	105 Å²	105	61.8 Å²	61.8	46%	0.457	34%	0.34	S	S	.	.			trans	-69.3	134.1	173.2	-77.1	-174.3	179.4	-171.7	0	109.4	C74 Y183 L195	C74-K181 VanDerWaalsContact CB-O 3.28Å; C74-K181 WeakPolarHBondContact CB-O 3.22Å; K181-Y183 HydrophobicContact CB-CE2 3.94Å; K181-L195 HydrophobicContact CB-CD1 3.54Å; K181-L195 HydrophobicContact CD-CD1 3.93Å; K181-L195 HydrophobicContact CD-CD2 4.38Å; K181-L195 HydrophobicContact CG-CD1 3.86Å
182	I	77.6	Confident	72.6	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.01	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-104.6	121.1	-178.9	-59.9	158.8	0	0	0	108.6	C74 V109 R121 P137 I196	C74-I182 HydrophobicContact CB-CG1 4.41Å; C74-I182 CarbonylContact O-C 3.47Å; C74-I182 WeakPolarHBondContact O-CA 3.44Å; V109-I182 HydrophobicContact CB-CD1 4.25Å; V109-I182 HydrophobicContact CG1-CD1 3.55Å; V109-I182 HydrophobicContact CG2-CB 4.1Å; V109-I182 HydrophobicContact CG2-CD1 3.59Å; V109-I182 HydrophobicContact CG2-CG1 4.44Å; V109-I182 HydrophobicContact CG2-CG2 4.48Å; R121-I182 HydrophobicContact CB-CD1 3.94Å; R121-I182 HydrophobicContact CG-CD1 4.48Å; P137-I182 HydrophobicContact CB-CD1 4.06Å; P137-I182 HydrophobicContact CB-CG1 4.04Å; P137-I182 HydrophobicContact CB-CG2 4.01Å; P137-I182 HydrophobicContact CG-CD1 3.59Å; P137-I182 HydrophobicContact CG-CG1 4.04Å; I182-I196 HydrophobicContact CG2-CD1 3.86Å; I182-I196 PolarHBondContact O-N 3.13Å
183	Y	78.7	Confident	71.4	Confident	38 Å²	38	68.5 Å²	68.5	15%	0.149	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-98.9	149.4	-179.7	-60.8	-94.4	0	0	0	110.3	P73 C74 S75 P76 K181 S185 S189 N194	P73-Y183 HydrophobicContact CB-CD2 3.55Å; P73-Y183 HydrophobicContact CB-CE2 3.99Å; P73-Y183 HydrophobicContact CB-CG 4.18Å; C74-Y183 PolarHBondContact O-N 2.96Å; S75-Y183 WeakPolarHBondContact CA-O 3.47Å; P76-Y183 WeakPolarHBondContact CD-O 3.34Å; K181-Y183 HydrophobicContact CB-CE2 3.94Å; Y183-S185 VanDerWaalsContact C-N 3.29Å; Y183-S185 PolarHBondContact O-N 3.04Å; Y183-S189 WeakPolarHBondContact CE1-O 3.34Å; Y183-N194 CarbonylContact C-O 3.46Å; Y183-N194 VanDerWaalsContact CA-O 3.28Å; Y183-N194 WeakPolarHBondContact CA-O 3.47Å; Y183-N194 HydrophobicContact CD1-CB 4.38Å
184	L	72.3	Confident	70.5	Confident	80 Å²	80	68.5 Å²	68.5	42%	0.419	39%	0.389	S	S	.	.	S	Bend	trans	-62.4	-38.2	179.4	-168.9	71.4	0	0	0	111.9	H107 N194 I196	H107-L184 WeakPolarHBondContact ND1-CD1 3.34Å; L184-N194 HydrophobicContact CB-CB 4.47Å; L184-N194 PolarHBondContact N-O 2.8Å; L184-I196 HydrophobicContact CB-CG1 4.3Å; L184-I196 HydrophobicContact CD1-CD1 4.23Å; L184-I196 HydrophobicContact CD1-CG1 4.18Å
185	S	69.8	Low	70	Confident	39 Å²	39	68.7 Å²	68.7	27%	0.273	39%	0.388	S	S	.	.			trans	-131.6	150.1	176.9	177	0	0	0	0	110.5	Y183 D187	Y183-S185 VanDerWaalsContact C-N 3.29Å; Y183-S185 PolarHBondContact O-N 3.04Å; S185-D187 VanDerWaalsContact C-N 3.29Å; S185-D187 PolarHBondContact OG-N 3.22Å
186	R	72.5	Confident	69.5	Low	24 Å²	24	64.5 Å²	64.5	9%	0.091	37%	0.368	C	S	.	.	S	Bend	trans	-70.6	-25.8	177.9	-168.3	173.5	-71.3	135.6	1.6	112.8	S72 P73 S75 T77 K78 E95 Q140	S72-R186 WeakPolarHBondContact OG-CD 3.48Å; S72-R186 PolarHBondContact OG-NE 3.26Å; P73-R186 WeakPolarHBondContact CD-O 3.34Å; S75-R186 PolarHBondContact OG-NE 3.46Å; S75-R186 PolarHBondContact OG-NH2 3.44Å; T77-R186 PolarHBondContact O-NH2 2.78Å; T77-R186 PolarHBondContact OG1-NH2 3.31Å; K78-R186 PolarHBondContact O-NH1 2.91Å; K78-R186 PolarHBondContact O-NH2 3.35Å; K78-R186 VanDerWaalsContact O-NH2 3.13Å; E95-R186 IonicContact OE2-NH1 3.62Å; Q140-R186 VanDerWaalsContact CD-CD 3.47Å; Q140-R186 VanDerWaalsContact NE2-CD 3.29Å; Q140-R186 VanDerWaalsContact OE1-NH1 3.15Å
187	D	67.6	Low	69	Low	126 Å²	126	65.4 Å²	65.4	67%	0.674	37%	0.374	S	S	*	.	S	Bend	trans	-87.4	-16.8	-171.5	-62.6	-31.3	0	0	0	113.7	S185	S185-D187 VanDerWaalsContact C-N 3.29Å; S185-D187 PolarHBondContact OG-N 3.22Å
188	N	60.4	Low	69	Low	95 Å²	95	67.2 Å²	67.2	51%	0.508	37%	0.372	S	S	.	.			trans	-122.1	75.8	-175.7	-66.6	-24.3	0	0	0	111.9	D190 N194	N188-D190 VanDerWaalsContact C-N 3.32Å; N188-N194 WeakPolarHBondContact CB-ND2 3.46Å; N188-N194 PolarHBondContact O-ND2 3.15Å
189	S	62.3	Low	69	Low	49 Å²	49	65.1 Å²	65.1	34%	0.343	36%	0.357	S	S	.	.			trans	-72.8	-22.4	171.8	47.4	0	0	0	0	114.4	Y183 S191	Y183-S189 WeakPolarHBondContact CE1-O 3.34Å; S189-S191 VanDerWaalsContact C-N 3.34Å; S189-S191 PolarHBondContact O-N 2.78Å
190	D	60	Low	68.4	Low	159 Å²	159	59.2 Å²	59.2	85%	0.85	33%	0.327	S	S	*	.	S	Bend	trans	-84.7	-9	-157.1	-70.6	-0.4	0	0	0	114.2	N188	N188-D190 VanDerWaalsContact C-N 3.32Å
191	S	61	Low	67.3	Low	49 Å²	49	65 Å²	65	34%	0.343	35%	0.348	S	S	.	.			trans	-118.6	124.2	177.2	59.6	0	0	0	0	111	S189 A193 N194	S189-S191 VanDerWaalsContact C-N 3.34Å; S189-S191 PolarHBondContact O-N 2.78Å; S191-A193 PolarHBondContact O-N 2.02Å; S191-N194 PolarHBondContact O-N 3.21Å; S191-N194 PolarHBondContact OG-ND2 2.92Å
192	D	63.6	Low	65.5	Low	113 Å²	113	67 Å²	67	60%	0.604	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-53.4	-19	167.5	-72	-44.4	0	0	0	112.2	N194 L195	D192-N194 PolarHBondContact O-N 2.89Å; D192-L195 VanDerWaalsContact O-CB 3.23Å; D192-L195 WeakPolarHBondContact O-CB 3.45Å; D192-L195 PolarHBondContact O-N 2.72Å
193	A	60.1	Low	63.5	Low	92 Å²	92	73.6 Å²	73.6	76%	0.76	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-57.5	-25.3	170.8	0	0	0	0	0	114.3	S191	S191-A193 PolarHBondContact O-N 2.02Å
194	N	67.3	Low	61.3	Low	30 Å²	30	75.3 Å²	75.3	16%	0.16	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-93.9	-1	177.9	-60.7	-34.4	0	0	0	112.7	Y183 L184 N188 S191 D192 I196	Y183-N194 CarbonylContact C-O 3.46Å; Y183-N194 VanDerWaalsContact CA-O 3.28Å; Y183-N194 WeakPolarHBondContact CA-O 3.47Å; Y183-N194 HydrophobicContact CD1-CB 4.38Å; L184-N194 HydrophobicContact CB-CB 4.47Å; L184-N194 PolarHBondContact N-O 2.8Å; N188-N194 WeakPolarHBondContact CB-ND2 3.46Å; N188-N194 PolarHBondContact O-ND2 3.15Å; S191-N194 PolarHBondContact O-N 3.21Å; S191-N194 PolarHBondContact OG-ND2 2.92Å; D192-N194 PolarHBondContact O-N 2.89Å; N194-I196 PolarHBondContact O-N 2.69Å
195	L	73.3	Confident	59.5	Low	37 Å²	37	76.9 Å²	76.9	19%	0.194	42%	0.416	C	S	.	.	B	Isolated β-bridge	trans	-71.7	122.3	178.5	-171	68.7	0	0	0	109.2	K181 D192 P197	K181-L195 HydrophobicContact CB-CD1 3.54Å; K181-L195 HydrophobicContact CD-CD1 3.93Å; K181-L195 HydrophobicContact CD-CD2 4.38Å; K181-L195 HydrophobicContact CG-CD1 3.86Å; D192-L195 VanDerWaalsContact O-CB 3.23Å; D192-L195 WeakPolarHBondContact O-CB 3.45Å; D192-L195 PolarHBondContact O-N 2.72Å; L195-P197 WeakPolarHBondContact O-CD 3Å
196	I	73.4	Confident	58.1	Low	10 Å²	10	80.8 Å²	80.8	5%	0.051	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-73.9	124.1	177.3	-61.9	163.6	0	0	0	107.9	P76 H107 V109 Y123 I182 L184 N194	P76-I196 HydrophobicContact CG-CD1 3.87Å; H107-I196 HydrophobicContact CB-CG2 4.13Å; V109-I196 HydrophobicContact CG2-CB 4.03Å; V109-I196 HydrophobicContact CG2-CG2 3.78Å; Y123-I196 HydrophobicContact CD2-CD1 3.73Å; Y123-I196 HydrophobicContact CD2-CG2 4.27Å; Y123-I196 HydrophobicContact CE2-CD1 3.43Å; Y123-I196 VanDerWaalsContact CE2-CD1 3.43Å; Y123-I196 HydrophobicContact CE2-CG1 4.35Å; Y123-I196 HydrophobicContact CE2-CG2 4.11Å; I182-I196 HydrophobicContact CG2-CD1 3.86Å; I182-I196 PolarHBondContact O-N 3.13Å; L184-I196 HydrophobicContact CB-CG1 4.3Å; L184-I196 HydrophobicContact CD1-CD1 4.23Å; L184-I196 HydrophobicContact CD1-CG1 4.18Å; N194-I196 PolarHBondContact O-N 2.69Å
197	P	71.8	Confident	56.8	Low	26 Å²	26	84.6 Å²	84.6	17%	0.169	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-67.2	154	-178.6	26.9	-33.1	0	0	0	111	C108 V109 L195 C373	C108-P197 WeakPolarHBondContact CA-O 3.43Å; V109-P197 PolarHBondContact N-O 3.27Å; L195-P197 WeakPolarHBondContact O-CD 3Å; P197-C373 HydrophobicContact CB-CB 4.03Å; P197-C373 HydrophobicContact CG-CB 3.52Å; P197-C373 VanDerWaalsContact CG-SG 3.6Å
198	Y	70.8	Confident	56	Low	69 Å²	69	83.1 Å²	83.1	27%	0.271	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	145.2	171.2	-65.3	-76.3	0	0	0	110	V109 I111 R121 S200	V109-Y198 HydrophobicContact CB-CD1 4.01Å; V109-Y198 HydrophobicContact CB-CE1 4.43Å; V109-Y198 HydrophobicContact CG1-CD1 3.97Å; V109-Y198 HydrophobicContact CG1-CE1 4.03Å; V109-Y198 WeakPolarHBondContact O-CA 3.41Å; I111-Y198 HydrophobicContact CD1-CD1 4.05Å; I111-Y198 HydrophobicContact CD1-CG 4.2Å; I111-Y198 HydrophobicContact CG1-CD1 3.45Å; I111-Y198 VanDerWaalsContact CG1-CD1 3.45Å; I111-Y198 HydrophobicContact CG1-CE1 3.96Å; I111-Y198 HydrophobicContact CG1-CG 4.08Å; R121-Y198 VanDerWaalsContact CZ-OH 3.28Å; R121-Y198 PolarHBondContact NH1-OH 3.29Å; R121-Y198 PolarHBondContact NH2-OH 2.89Å; Y198-S200 PolarHBondContact O-N 2.91Å
199	C	67	Low	55.6	Low	12 Å²	12	86.9 Å²	86.9	8%	0.081	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	112.6	169.6	-51.6	0	0	0	0	107.2	C108 V109 L110 Y201 F371	C108-C199 HydrophobicContact CB-CB 3.82Å; C108-C199 WeakPolarHBondContact CB-SG 2.94Å; C108-C199 WeakPolarHBondContact SG-CB 3.12Å; C108-C199 CovalentContact SG-SG 2.03Å; C108-C199 PolarHBondContact SG-SG 3.07Å; V109-C199 VanDerWaalsContact C-SG 3.52Å; V109-C199 PolarHBondContact O-N 3.07Å; L110-C199 HydrophobicContact CD2-CB 4.06Å; C199-Y201 PolarHBondContact O-N 2.96Å; C199-F371 HydrophobicContact CB-CD1 4.48Å
200	S	55.4	Low	55.4	Low	23 Å²	23	89.5 Å²	89.5	16%	0.161	45%	0.452	C	S	.	.			trans	-67.8	112.9	166.9	72.1	0	0	0	0	106.4	Y198 E202 N372	Y198-S200 PolarHBondContact O-N 2.91Å; S200-E202 PolarHBondContact O-N 3.34Å; S200-N372 WeakPolarHBondContact CB-O 3.44Å; S200-N372 PolarHBondContact OG-O 2.94Å
201	Y	50.4	Low	55.5	Low	188 Å²	188	86.7 Å²	86.7	74%	0.737	44%	0.436	S	S	*	.			trans	-68.7	84.4	155.2	-115.3	-88.8	0	0	0	104.3	C199 Q203	C199-Y201 PolarHBondContact O-N 2.96Å; Y201-Q203 PolarHBondContact O-N 3.22Å
202	E	39.8	Very low	55.7	Low	146 Å²	146	88.6 Å²	88.6	68%	0.682	44%	0.442	S	S	*	.			trans	-57.6	102.1	144.2	-91	-164.9	173.4	0	0	103.1	S200 S204	S200-E202 PolarHBondContact O-N 3.34Å; E202-S204 PolarHBondContact O-N 3.49Å
203	Q	35.9	Very low	56.1	Low	140 Å²	140	85 Å²	85	65%	0.654	43%	0.432	S	S	*	.			trans	-57.5	88.6	159.8	-168.4	169.3	-2.6	0	0	103.2	Y201 N205	Y201-Q203 PolarHBondContact O-N 3.22Å; Q203-N205 HydrophobicContact CG-CB 4.43Å; Q203-N205 WeakPolarHBondContact CG-OD1 3.34Å; Q203-N205 PolarHBondContact NE2-OD1 3.42Å; Q203-N205 PolarHBondContact O-N 2.72Å
204	S	33.9	Very low	57	Low	74 Å²	74	82.8 Å²	82.8	52%	0.517	42%	0.417	S	S	.	.			trans	-61.1	72.1	146.7	66.9	0	0	0	0	103.6	E202 F206	E202-S204 PolarHBondContact O-N 3.49Å; S204-F206 PolarHBondContact O-N 3.19Å
205	N	34.3	Very low	57.7	Low	114 Å²	114	86 Å²	86	61%	0.61	43%	0.433	S	S	*	.			trans	-49.3	90.5	134.5	-83	-18.2	0	0	0	101.4	Q203 Q207	Q203-N205 HydrophobicContact CG-CB 4.43Å; Q203-N205 WeakPolarHBondContact CG-OD1 3.34Å; Q203-N205 PolarHBondContact NE2-OD1 3.42Å; Q203-N205 PolarHBondContact O-N 2.72Å; N205-Q207 PolarHBondContact O-N 3.36Å
206	F	40.5	Very low	58.1	Low	121 Å²	121	89.6 Å²	89.6	53%	0.531	45%	0.452	S	S	.	.			trans	-39.1	126.9	179.4	-114.5	-97.1	0	0	0	103.6	S204 L208	S204-F206 PolarHBondContact O-N 3.19Å; F206-L208 HydrophobicContact CB-CB 3.94Å; F206-L208 HydrophobicContact CB-CD1 3.63Å; F206-L208 HydrophobicContact CB-CG 3.72Å; F206-L208 HydrophobicContact CD1-CD1 4.14Å; F206-L208 HydrophobicContact CD1-CG 3.85Å; F206-L208 HydrophobicContact CG-CD1 3.98Å; F206-L208 HydrophobicContact CG-CG 4.09Å; F206-L208 PolarHBondContact O-N 3Å
207	Q	44.1	Very low	58.6	Low	103 Å²	103	90.8 Å²	90.8	48%	0.481	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	35.3	162.2	-67.2	-171.8	23.3	0	0	109.4	N205 Y209 K210 I211	N205-Q207 PolarHBondContact O-N 3.36Å; Q207-Y209 PolarHBondContact O-N 3Å; Q207-K210 HydrophobicContact CB-CB 3.9Å; Q207-K210 HydrophobicContact CB-CG 3.94Å; Q207-K210 VanDerWaalsContact CD-CE 3.43Å; Q207-K210 HydrophobicContact CG-CD 4.41Å; Q207-K210 HydrophobicContact CG-CG 4.1Å; Q207-K210 CarbonylContact O-C 3.55Å; Q207-K210 WeakPolarHBondContact O-CA 3.18Å; Q207-K210 PolarHBondContact O-N 3.37Å; Q207-K210 VanDerWaalsContact OE1-CG 3.31Å; Q207-I211 WeakPolarHBondContact O-CG1 3.39Å; Q207-I211 PolarHBondContact O-N 3.36Å
208	L	50.4	Low	59.2	Low	95 Å²	95	91.9 Å²	91.9	50%	0.497	48%	0.478	S	S	.	.	H	α-helix	trans	-42.2	-42.2	156	-91.7	160.5	0	0	0	108.1	F206 K210 I211 L212	F206-L208 HydrophobicContact CB-CB 3.94Å; F206-L208 HydrophobicContact CB-CD1 3.63Å; F206-L208 HydrophobicContact CB-CG 3.72Å; F206-L208 HydrophobicContact CD1-CD1 4.14Å; F206-L208 HydrophobicContact CD1-CG 3.85Å; F206-L208 HydrophobicContact CG-CD1 3.98Å; F206-L208 HydrophobicContact CG-CG 4.09Å; F206-L208 PolarHBondContact O-N 3Å; L208-K210 PolarHBondContact O-N 3.24Å; L208-I211 PolarHBondContact O-N 3.46Å; L208-L212 HydrophobicContact CB-CD1 3.89Å; L208-L212 HydrophobicContact CD2-CD1 3.52Å; L208-L212 HydrophobicContact CG-CD1 4.33Å; L208-L212 WeakPolarHBondContact O-CA 3.46Å; L208-L212 WeakPolarHBondContact O-CB 3.32Å; L208-L212 WeakPolarHBondContact O-CD1 3.47Å; L208-L212 PolarHBondContact O-N 2.98Å
209	Y	53.6	Low	60.1	Low	174 Å²	174	93.1 Å²	93.1	68%	0.682	49%	0.488	S	S	*	.	H	α-helix	trans	-61.9	-36.3	173.2	125.6	-97.9	0	0	0	114	Q207 G213	Q207-Y209 PolarHBondContact O-N 3Å; Y209-G213 VanDerWaalsContact O-CA 3.25Å; Y209-G213 WeakPolarHBondContact O-CA 3.11Å; Y209-G213 PolarHBondContact O-N 3.24Å
210	K	57.7	Low	61	Low	105 Å²	105	94.5 Å²	94.5	46%	0.457	50%	0.504	S	S	.	.	H	α-helix	trans	-81.1	-29.4	175.7	-53.6	-153.8	-156.9	143.5	0	113.3	Q207 L208 G214	Q207-K210 HydrophobicContact CB-CB 3.9Å; Q207-K210 HydrophobicContact CB-CG 3.94Å; Q207-K210 VanDerWaalsContact CD-CE 3.43Å; Q207-K210 HydrophobicContact CG-CD 4.41Å; Q207-K210 HydrophobicContact CG-CG 4.1Å; Q207-K210 CarbonylContact O-C 3.55Å; Q207-K210 WeakPolarHBondContact O-CA 3.18Å; Q207-K210 PolarHBondContact O-N 3.37Å; Q207-K210 VanDerWaalsContact OE1-CG 3.31Å; L208-K210 PolarHBondContact O-N 3.24Å; K210-G214 PolarHBondContact O-N 3.13Å
211	I	61.9	Low	62.6	Low	99 Å²	99	98.6 Å²	98.6	51%	0.508	52%	0.523	S	S	.	.	H	α-helix	trans	-73.8	-49.7	174.4	-63	167.3	0	0	0	109.3	Q207 L208 G214 I215	Q207-I211 WeakPolarHBondContact O-CG1 3.39Å; Q207-I211 PolarHBondContact O-N 3.36Å; L208-I211 PolarHBondContact O-N 3.46Å; I211-G214 PolarHBondContact O-N 3.13Å; I211-I215 HydrophobicContact CG2-CD1 3.93Å; I211-I215 VanDerWaalsContact O-CG1 3.23Å; I211-I215 WeakPolarHBondContact O-CG1 3.49Å; I211-I215 PolarHBondContact O-N 3.46Å
212	L	65.9	Low	64.5	Low	90 Å²	90	94.7 Å²	94.7	47%	0.471	51%	0.514	S	S	.	.	H	α-helix	trans	-61.4	-42.8	170.3	-83.4	110.2	0	0	0	111.1	L208 G214 I215 I216	L208-L212 HydrophobicContact CB-CD1 3.89Å; L208-L212 HydrophobicContact CD2-CD1 3.52Å; L208-L212 HydrophobicContact CG-CD1 4.33Å; L208-L212 WeakPolarHBondContact O-CA 3.46Å; L208-L212 WeakPolarHBondContact O-CB 3.32Å; L208-L212 WeakPolarHBondContact O-CD1 3.47Å; L208-L212 PolarHBondContact O-N 2.98Å; L212-G214 VanDerWaalsContact C-N 3.31Å; L212-G214 PolarHBondContact O-N 3.05Å; L212-I215 PolarHBondContact O-N 3.11Å; L212-I216 HydrophobicContact CB-CD1 4.38Å; L212-I216 VanDerWaalsContact O-CB 3.26Å; L212-I216 WeakPolarHBondContact O-CB 3.47Å; L212-I216 WeakPolarHBondContact O-CD1 3.33Å; L212-I216 WeakPolarHBondContact O-CG1 3.4Å; L212-I216 PolarHBondContact O-N 2.85Å
213	G	71.8	Confident	66.9	Low	38 Å²	38	91.3 Å²	91.3	39%	0.392	51%	0.505	S	S	.	.	H	α-helix	trans	-62.2	-38.3	176.1	0	0	0	0	0	112.5	Y209 G217	Y209-G213 VanDerWaalsContact O-CA 3.25Å; Y209-G213 WeakPolarHBondContact O-CA 3.11Å; Y209-G213 PolarHBondContact O-N 3.24Å; G213-G217 PolarHBondContact O-N 2.81Å
214	G	77.6	Confident	69.4	Low	44 Å²	44	89.6 Å²	89.6	45%	0.454	50%	0.5	S	S	.	.	H	α-helix	trans	-68.4	-43.7	174.3	0	0	0	0	0	112.8	K210 I211 L212 G217 A218	K210-G214 PolarHBondContact O-N 3.13Å; I211-G214 PolarHBondContact O-N 3.13Å; L212-G214 VanDerWaalsContact C-N 3.31Å; L212-G214 PolarHBondContact O-N 3.05Å; G214-G217 PolarHBondContact O-N 3.46Å; G214-A218 VanDerWaalsContact O-CB 3.29Å; G214-A218 WeakPolarHBondContact O-CB 3Å; G214-A218 PolarHBondContact O-N 3.03Å
215	I	81.6	Confident	72.1	Confident	98 Å²	98	90.5 Å²	90.5	50%	0.503	50%	0.499	S	S	.	.	H	α-helix	trans	-65.9	-46.9	177.2	-67	163.6	0	0	0	110.5	I211 L212 G217 A218 I219	I211-I215 HydrophobicContact CG2-CD1 3.93Å; I211-I215 VanDerWaalsContact O-CG1 3.23Å; I211-I215 WeakPolarHBondContact O-CG1 3.49Å; I211-I215 PolarHBondContact O-N 3.46Å; L212-I215 PolarHBondContact O-N 3.11Å; I215-G217 VanDerWaalsContact C-N 3.32Å; I215-G217 PolarHBondContact O-N 3.27Å; I215-A218 PolarHBondContact O-N 2.95Å; I215-I219 HydrophobicContact CG2-CD1 3.85Å; I215-I219 VanDerWaalsContact O-CG1 3.24Å; I215-I219 WeakPolarHBondContact O-CG1 3.4Å; I215-I219 PolarHBondContact O-N 3Å
216	I	83.3	Confident	74.8	Confident	112 Å²	112	88.5 Å²	88.5	57%	0.574	49%	0.49	S	S	*	.	H	α-helix	trans	-63.3	-40.4	177.2	-68.2	163.1	0	0	0	110.4	L212 G220	L212-I216 HydrophobicContact CB-CD1 4.38Å; L212-I216 VanDerWaalsContact O-CB 3.26Å; L212-I216 WeakPolarHBondContact O-CB 3.47Å; L212-I216 WeakPolarHBondContact O-CD1 3.33Å; L212-I216 WeakPolarHBondContact O-CG1 3.4Å; L212-I216 PolarHBondContact O-N 2.85Å; I216-G220 PolarHBondContact O-N 2.84Å
217	G	82.4	Confident	77	Confident	36 Å²	36	86.8 Å²	86.8	37%	0.371	49%	0.493	S	S	.	.	H	α-helix	trans	-63.7	-44.5	174.5	0	0	0	0	0	113.1	G213 G214 I215 G220 I221	G213-G217 PolarHBondContact O-N 2.81Å; G214-G217 PolarHBondContact O-N 3.46Å; I215-G217 VanDerWaalsContact C-N 3.32Å; I215-G217 PolarHBondContact O-N 3.27Å; G217-G220 PolarHBondContact O-N 2.86Å; G217-I221 WeakPolarHBondContact O-CG1 3.42Å; G217-I221 PolarHBondContact O-N 2.99Å
218	A	86	Confident	79.2	Confident	48 Å²	48	85.7 Å²	85.7	40%	0.397	49%	0.489	S	S	.	.	H	α-helix	trans	-63.4	-43.3	177.2	0	0	0	0	0	111.8	G214 I215 G220 I221 I222	G214-A218 VanDerWaalsContact O-CB 3.29Å; G214-A218 WeakPolarHBondContact O-CB 3Å; G214-A218 PolarHBondContact O-N 3.03Å; I215-A218 PolarHBondContact O-N 2.95Å; A218-G220 VanDerWaalsContact C-N 3.3Å; A218-G220 PolarHBondContact O-N 2.82Å; A218-I221 PolarHBondContact O-N 2.72Å; A218-I222 VanDerWaalsContact O-CG1 3.27Å; A218-I222 WeakPolarHBondContact O-CG1 3.07Å; A218-I222 PolarHBondContact O-N 2.88Å
219	I	87.8	Confident	80.9	Confident	96 Å²	96	85.8 Å²	85.8	49%	0.492	49%	0.489	S	S	.	.	H	α-helix	trans	-59.9	-42.7	173.8	-67.4	165.5	0	0	0	110.3	I215 I221 I222 C223	I215-I219 HydrophobicContact CG2-CD1 3.85Å; I215-I219 VanDerWaalsContact O-CG1 3.24Å; I215-I219 WeakPolarHBondContact O-CG1 3.4Å; I215-I219 PolarHBondContact O-N 3Å; I219-I221 PolarHBondContact O-N 3Å; I219-I222 PolarHBondContact O-N 3.4Å; I219-C223 WeakPolarHBondContact O-CB 3.4Å; I219-C223 PolarHBondContact O-N 3.45Å; I219-C223 PolarHBondContact O-SG 2.96Å
220	G	87.9	Confident	82.3	Confident	40 Å²	40	86.4 Å²	86.4	41%	0.412	49%	0.49	S	S	.	.	H	α-helix	trans	-59.2	-44.9	175.5	0	0	0	0	0	113.3	I216 G217 A218 C223 L224	I216-G220 PolarHBondContact O-N 2.84Å; G217-G220 PolarHBondContact O-N 2.86Å; A218-G220 VanDerWaalsContact C-N 3.3Å; A218-G220 PolarHBondContact O-N 2.82Å; G220-C223 PolarHBondContact O-N 2.66Å; G220-L224 WeakPolarHBondContact O-CB 3.12Å; G220-L224 PolarHBondContact O-N 2.95Å
221	I	88.6	Confident	83.6	Confident	110 Å²	110	87.3 Å²	87.3	56%	0.564	49%	0.494	S	S	*	.	H	α-helix	trans	-66.1	-42.2	177.9	-66.8	168.2	0	0	0	111.2	G217 A218 I219 L224 L225	G217-I221 WeakPolarHBondContact O-CG1 3.42Å; G217-I221 PolarHBondContact O-N 2.99Å; A218-I221 PolarHBondContact O-N 2.72Å; I219-I221 PolarHBondContact O-N 3Å; I221-L224 PolarHBondContact O-N 3.29Å; I221-L225 HydrophobicContact CG2-CD1 4.29Å; I221-L225 PolarHBondContact O-N 3.43Å
222	I	90.4	Very high	84.5	Confident	105 Å²	105	86.4 Å²	86.4	54%	0.538	49%	0.49	S	S	.	.	H	α-helix	trans	-62.1	-45.2	176.8	-67.9	165	0	0	0	110.3	A218 I219 L224 L225 V226	A218-I222 VanDerWaalsContact O-CG1 3.27Å; A218-I222 WeakPolarHBondContact O-CG1 3.07Å; A218-I222 PolarHBondContact O-N 2.88Å; I219-I222 PolarHBondContact O-N 3.4Å; I222-L224 VanDerWaalsContact C-N 3.31Å; I222-L224 PolarHBondContact O-N 3.14Å; I222-L225 PolarHBondContact O-N 3.49Å; I222-V226 WeakPolarHBondContact O-CG2 3.39Å; I222-V226 PolarHBondContact O-N 3.27Å
223	C	89	Confident	85.1	Confident	75 Å²	75	85.9 Å²	85.9	51%	0.507	49%	0.491	S	S	.	.	H	α-helix	trans	-60.3	-40.7	175	-76.4	0	0	0	0	112.2	I219 G220 V226 C227	I219-C223 WeakPolarHBondContact O-CB 3.4Å; I219-C223 PolarHBondContact O-N 3.45Å; I219-C223 PolarHBondContact O-SG 2.96Å; G220-C223 PolarHBondContact O-N 2.66Å; C223-V226 PolarHBondContact O-N 2.85Å; C223-C227 PolarHBondContact O-N 2.79Å; C223-C227 PolarHBondContact O-SG 3.02Å
224	L	89.3	Confident	85.1	Confident	104 Å²	104	92.1 Å²	92.1	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-64.7	-44.8	177.1	-161.7	164.4	0	0	0	111.1	G220 I221 I222 V226 C227 I228	G220-L224 WeakPolarHBondContact O-CB 3.12Å; G220-L224 PolarHBondContact O-N 2.95Å; I221-L224 PolarHBondContact O-N 3.29Å; I222-L224 VanDerWaalsContact C-N 3.31Å; I222-L224 PolarHBondContact O-N 3.14Å; L224-V226 PolarHBondContact O-N 2.94Å; L224-C227 WeakPolarHBondContact O-CB 3.42Å; L224-C227 PolarHBondContact O-N 2.03Å; L224-C227 VanDerWaalsContact O-N 3.16Å; L224-I228 HydrophobicContact CD2-CD1 3.28Å; L224-I228 HydrophobicContact CD2-CG1 3.84Å; L224-I228 WeakPolarHBondContact O-CG1 3.25Å; L224-I228 PolarHBondContact O-N 3.28Å
225	L	90.8	Very high	84.6	Confident	93 Å²	93	96 Å²	96	49%	0.487	51%	0.514	S	S	.	.	H	α-helix	trans	-58.7	-45.6	174.6	-88.6	167.2	0	0	0	112.1	I221 I222 C227 I228 I229	I221-L225 HydrophobicContact CG2-CD1 4.29Å; I221-L225 PolarHBondContact O-N 3.43Å; I222-L225 PolarHBondContact O-N 3.49Å; L225-C227 VanDerWaalsContact C-N 3.29Å; L225-C227 PolarHBondContact O-N 2.89Å; L225-I228 PolarHBondContact O-N 2.82Å; L225-I229 VanDerWaalsContact O-CG1 3.25Å; L225-I229 WeakPolarHBondContact O-CG1 3.24Å; L225-I229 PolarHBondContact O-N 2.81Å
226	V	89.4	Confident	83.6	Confident	72 Å²	72	98.1 Å²	98.1	44%	0.436	52%	0.524	S	S	.	.	H	α-helix	trans	-61.4	-38.7	176.1	172.9	0	0	0	0	111.3	I222 C223 L224 R230	I222-V226 WeakPolarHBondContact O-CG2 3.39Å; I222-V226 PolarHBondContact O-N 3.27Å; C223-V226 PolarHBondContact O-N 2.85Å; L224-V226 PolarHBondContact O-N 2.94Å; V226-R230 WeakPolarHBondContact O-CB 3.23Å; V226-R230 PolarHBondContact O-N 2.83Å
227	C	88.2	Confident	82	Confident	85 Å²	85	97 Å²	97	57%	0.574	53%	0.526	S	S	*	.	H	α-helix	trans	-65.6	-43.1	174.9	-74.1	0	0	0	0	112.5	C223 L224 L225 R230 F231	C223-C227 PolarHBondContact O-N 2.79Å; C223-C227 PolarHBondContact O-SG 3.02Å; L224-C227 WeakPolarHBondContact O-CB 3.42Å; L224-C227 PolarHBondContact O-N 2.03Å; L224-C227 VanDerWaalsContact O-N 3.16Å; L225-C227 VanDerWaalsContact C-N 3.29Å; L225-C227 PolarHBondContact O-N 2.89Å; C227-R230 PolarHBondContact O-N 2.9Å; C227-F231 WeakPolarHBondContact O-CB 3.26Å; C227-F231 PolarHBondContact O-N 2.88Å
228	I	88.9	Confident	80.1	Confident	81 Å²	81	97.1 Å²	97.1	42%	0.415	53%	0.526	S	S	.	.	H	α-helix	trans	-63.9	-45.4	175.2	-70.1	174.5	0	0	0	110.4	L224 L225 R230 F231 L232	L224-I228 HydrophobicContact CD2-CD1 3.28Å; L224-I228 HydrophobicContact CD2-CG1 3.84Å; L224-I228 WeakPolarHBondContact O-CG1 3.25Å; L224-I228 PolarHBondContact O-N 3.28Å; L225-I228 PolarHBondContact O-N 2.82Å; I228-R230 VanDerWaalsContact C-N 3.31Å; I228-R230 PolarHBondContact O-N 3.28Å; I228-F231 CarbonylContact O-C 3.57Å; I228-F231 WeakPolarHBondContact O-CB 3.29Å; I228-F231 PolarHBondContact O-N 3.39Å; I228-F231 VanDerWaalsContact O-N 3.08Å; I228-L232 HydrophobicContact CG2-CD1 3.77Å; I228-L232 HydrophobicContact CG2-CG 4.08Å; I228-L232 WeakPolarHBondContact O-CB 3.36Å; I228-L232 WeakPolarHBondContact O-CG 3.41Å; I228-L232 PolarHBondContact O-N 3.44Å
229	I	87.4	Confident	78.2	Confident	96 Å²	96	102.6 Å²	102.6	49%	0.492	55%	0.549	S	S	.	.	H	α-helix	trans	-59.6	-44.2	177	-67.4	164	0	0	0	109.9	L225 F231 L232 V233	L225-I229 VanDerWaalsContact O-CG1 3.25Å; L225-I229 WeakPolarHBondContact O-CG1 3.24Å; L225-I229 PolarHBondContact O-N 2.81Å; I229-F231 VanDerWaalsContact C-N 3.31Å; I229-F231 PolarHBondContact O-N 3.03Å; I229-L232 PolarHBondContact O-N 3.25Å; I229-V233 HydrophobicContact CG2-CG2 4.27Å; I229-V233 WeakPolarHBondContact O-CB 3.27Å; I229-V233 WeakPolarHBondContact O-CG2 3.49Å; I229-V233 PolarHBondContact O-N 2.89Å
230	R	83.5	Confident	76.1	Confident	188 Å²	188	106.3 Å²	106.3	71%	0.709	56%	0.564	S	S	*	*	H	α-helix	trans	-62.2	-37.3	174.3	-88.1	-171.3	164.5	155.6	-0.7	113.1	V226 C227 I228 K234	V226-R230 WeakPolarHBondContact O-CB 3.23Å; V226-R230 PolarHBondContact O-N 2.83Å; C227-R230 PolarHBondContact O-N 2.9Å; I228-R230 VanDerWaalsContact C-N 3.31Å; I228-R230 PolarHBondContact O-N 3.28Å; R230-K234 WeakPolarHBondContact O-CB 3.17Å; R230-K234 PolarHBondContact O-N 3.39Å
231	F	83.2	Confident	73.7	Confident	123 Å²	123	114.6 Å²	114.6	54%	0.539	58%	0.583	S	S	.	*	H	α-helix	trans	-70	-43	177.3	-168.9	-95.1	0	0	0	111.6	C227 I228 I229 K234 Q235	C227-F231 WeakPolarHBondContact O-CB 3.26Å; C227-F231 PolarHBondContact O-N 2.88Å; I228-F231 CarbonylContact O-C 3.57Å; I228-F231 WeakPolarHBondContact O-CB 3.29Å; I228-F231 PolarHBondContact O-N 3.39Å; I228-F231 VanDerWaalsContact O-N 3.08Å; I229-F231 VanDerWaalsContact C-N 3.31Å; I229-F231 PolarHBondContact O-N 3.03Å; F231-K234 CarbonylContact O-C 3.51Å; F231-K234 PolarHBondContact O-N 3.26Å; F231-Q235 HydrophobicContact CD1-CG 4.22Å; F231-Q235 VanDerWaalsContact CE1-CD 3.45Å; F231-Q235 HydrophobicContact CE1-CG 3.91Å; F231-Q235 HydrophobicContact CZ-CG 4.38Å; F231-Q235 PolarHBondContact O-N 2.87Å
232	L	82.3	Confident	71.5	Confident	80 Å²	80	117 Å²	117	42%	0.419	60%	0.595	S	S	.	*	H	α-helix	trans	-64.5	-43.2	174.4	-71.8	175.4	0	0	0	111.5	I228 I229 K234 Q235 I236	I228-L232 HydrophobicContact CG2-CD1 3.77Å; I228-L232 HydrophobicContact CG2-CG 4.08Å; I228-L232 WeakPolarHBondContact O-CB 3.36Å; I228-L232 WeakPolarHBondContact O-CG 3.41Å; I228-L232 PolarHBondContact O-N 3.44Å; I229-L232 PolarHBondContact O-N 3.25Å; L232-K234 VanDerWaalsContact C-N 3.3Å; L232-K234 PolarHBondContact O-N 2.88Å; L232-Q235 PolarHBondContact O-N 3.41Å; L232-Q235 VanDerWaalsContact O-N 3.17Å; L232-I236 HydrophobicContact CB-CD1 4.34Å; L232-I236 VanDerWaalsContact O-CB 3.29Å; L232-I236 WeakPolarHBondContact O-CB 3.25Å; L232-I236 WeakPolarHBondContact O-CG1 3.4Å; L232-I236 PolarHBondContact O-N 3.07Å
233	V	77.5	Confident	69	Low	80 Å²	80	119.5 Å²	119.5	49%	0.485	60%	0.604	S	S	.	*	H	α-helix	trans	-61	-40.9	172.5	171.5	0	0	0	0	110.2	I229 Q235 C237	I229-V233 HydrophobicContact CG2-CG2 4.27Å; I229-V233 WeakPolarHBondContact O-CB 3.27Å; I229-V233 WeakPolarHBondContact O-CG2 3.49Å; I229-V233 PolarHBondContact O-N 2.89Å; V233-Q235 PolarHBondContact O-N 3.13Å; V233-C237 WeakPolarHBondContact O-CA 3.36Å; V233-C237 WeakPolarHBondContact O-CB 3.49Å; V233-C237 PolarHBondContact O-N 3.09Å; V233-C237 PolarHBondContact O-SG 3.05Å
234	K	71.3	Confident	66.7	Low	169 Å²	169	122.4 Å²	122.4	74%	0.735	62%	0.615	S	S	*	*	H	α-helix	trans	-68.1	-29.8	174.5	-90.3	-173.7	172.9	-178.1	0	114.3	R230 F231 L232 G238	R230-K234 WeakPolarHBondContact O-CB 3.17Å; R230-K234 PolarHBondContact O-N 3.39Å; F231-K234 CarbonylContact O-C 3.51Å; F231-K234 PolarHBondContact O-N 3.26Å; L232-K234 VanDerWaalsContact C-N 3.3Å; L232-K234 PolarHBondContact O-N 2.88Å; K234-G238 VanDerWaalsContact O-CA 3.31Å; K234-G238 WeakPolarHBondContact O-CA 3.48Å; K234-G238 PolarHBondContact O-N 2.78Å
235	Q	67.8	Low	64	Low	126 Å²	126	129.2 Å²	129.2	59%	0.589	63%	0.633	S	S	*	*	H	α-helix	trans	-82.7	-40.1	177	-78.9	-159.9	-17.3	0	0	112.7	F231 L232 V233 G238	F231-Q235 HydrophobicContact CD1-CG 4.22Å; F231-Q235 VanDerWaalsContact CE1-CD 3.45Å; F231-Q235 HydrophobicContact CE1-CG 3.91Å; F231-Q235 HydrophobicContact CZ-CG 4.38Å; F231-Q235 PolarHBondContact O-N 2.87Å; L232-Q235 PolarHBondContact O-N 3.41Å; L232-Q235 VanDerWaalsContact O-N 3.17Å; V233-Q235 PolarHBondContact O-N 3.13Å; Q235-G238 WeakPolarHBondContact O-CA 3.44Å; Q235-G238 PolarHBondContact O-N 3.04Å
236	I	61.3	Low	61.5	Low	141 Å²	141	129.2 Å²	129.2	72%	0.723	64%	0.637	S	S	*	*	H	α-helix	trans	-76.7	-40.7	179	-61.5	166.5	0	0	0	110.4	L232 G238	L232-I236 HydrophobicContact CB-CD1 4.34Å; L232-I236 VanDerWaalsContact O-CB 3.29Å; L232-I236 WeakPolarHBondContact O-CB 3.25Å; L232-I236 WeakPolarHBondContact O-CG1 3.4Å; L232-I236 PolarHBondContact O-N 3.07Å; I236-G238 PolarHBondContact O-N 2.86Å
237	C	50.3	Low	58.9	Low	90 Å²	90	131.6 Å²	131.6	61%	0.608	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	30.8	165.5	-54.4	0	0	0	0	111.5	V233 N239	V233-C237 WeakPolarHBondContact O-CA 3.36Å; V233-C237 WeakPolarHBondContact O-CB 3.49Å; V233-C237 PolarHBondContact O-N 3.09Å; V233-C237 PolarHBondContact O-SG 3.05Å; C237-N239 PolarHBondContact O-N 3.13Å
238	G	41.2	Very low	56.3	Low	37 Å²	37	132.9 Å²	132.9	38%	0.381	66%	0.663	S	S	.	*	T	Hydrogen-bonded Turn	trans	-41.8	127.6	-176.7	0	0	0	0	0	112.1	K234 Q235 I236 Q240	K234-G238 VanDerWaalsContact O-CA 3.31Å; K234-G238 WeakPolarHBondContact O-CA 3.48Å; K234-G238 PolarHBondContact O-N 2.78Å; Q235-G238 WeakPolarHBondContact O-CA 3.44Å; Q235-G238 PolarHBondContact O-N 3.04Å; I236-G238 PolarHBondContact O-N 2.86Å; G238-Q240 PolarHBondContact O-N 2.91Å
239	N	45.7	Very low	53.8	Low	164 Å²	164	133.1 Å²	133.1	88%	0.877	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	27.7	55.7	160.9	-85.1	-5.6	0	0	0	114.9	C237 R241	C237-N239 PolarHBondContact O-N 3.13Å; N239-R241 PolarHBondContact O-N 2.82Å
240	Q	44	Very low	51.2	Low	174 Å²	174	132.8 Å²	132.8	81%	0.813	71%	0.705	S	S	*	*			trans	-67.5	89	149.3	-84	-175.8	-5.2	0	0	105	G238 I242	G238-Q240 PolarHBondContact O-N 2.91Å; Q240-I242 PolarHBondContact O-N 3.08Å
241	R	37.8	Very low	48.9	Very low	214 Å²	214	127.3 Å²	127.3	81%	0.808	71%	0.707	S	S	*	*			trans	-44.2	103	155.4	-82.7	179.4	177	175.7	0	105	N239 H243	N239-R241 PolarHBondContact O-N 2.82Å; R241-H243 HydrophobicContact CB-CB 4.47Å; R241-H243 PolarHBondContact O-N 2.85Å
242	I	43.3	Very low	46.8	Very low	160 Å²	160	127.7 Å²	127.7	82%	0.821	73%	0.725	S	S	*	*			trans	-72.1	68.2	160.2	-56	178	0	0	0	105.4	Q240 N244	Q240-I242 PolarHBondContact O-N 3.08Å; I242-N244 VanDerWaalsContact C-N 3.27Å
243	H	36.8	Very low	44.7	Very low	157 Å²	157	127.5 Å²	127.5	73%	0.727	74%	0.743	S	S	*	*			trans	-89.8	76.8	154.7	-108.5	-76.2	0	0	0	104.7	R241	R241-H243 HydrophobicContact CB-CB 4.47Å; R241-H243 PolarHBondContact O-N 2.85Å
244	N	40.2	Very low	42.8	Very low	136 Å²	136	128 Å²	128	73%	0.727	76%	0.755	S	S	*	*			trans	-148.1	79.5	155.9	-97.1	-14.3	0	0	0	107.7	I242 T246	I242-N244 VanDerWaalsContact C-N 3.27Å; N244-T246 VanDerWaalsContact C-N 3.27Å; N244-T246 PolarHBondContact O-N 3Å; N244-T246 VanDerWaalsContact O-N 3.17Å
245	R	33.4	Very low	41.5	Very low	248 Å²	248	124.9 Å²	124.9	94%	0.936	76%	0.755	S	S	*	*			trans	-62.9	99.1	143.2	-81.3	-177.7	175	175.4	-1.8	106.1
246	T	37.9	Very low	40.3	Very low	93 Å²	93	125.5 Å²	125.5	57%	0.571	77%	0.767	S	S	*	*			trans	-140.3	96.1	161.9	-40	0	0	0	0	107.6	N244 C248	N244-T246 VanDerWaalsContact C-N 3.27Å; N244-T246 PolarHBondContact O-N 3Å; N244-T246 VanDerWaalsContact O-N 3.17Å; T246-C248 HydrophobicContact CG2-CB 4.29Å; T246-C248 PolarHBondContact O-N 2.95Å
247	P	34.6	Very low	39.3	Very low	122 Å²	122	126 Å²	126	79%	0.792	77%	0.772	S	S	*	*			trans	-89.2	84.4	170.8	33.5	-24.7	0	0	0	107.7
248	C	34.2	Very low	39	Very low	112 Å²	112	128.7 Å²	128.7	76%	0.757	79%	0.785	S	S	*	*			trans	-149.2	117.3	178	-56.7	0	0	0	0	110.5	T246	T246-C248 HydrophobicContact CG2-CB 4.29Å; T246-C248 PolarHBondContact O-N 2.95Å
249	G	35.4	Very low	39	Very low	85 Å²	85	134.3 Å²	134.3	88%	0.876	81%	0.807	S	S	*	*			trans	134.5	88.8	151.2	0	0	0	0	0	116.8
250	G	33.1	Very low	38.8	Very low	89 Å²	89	132.1 Å²	132.1	92%	0.918	80%	0.804	S	S	*	*			trans	98.5	109.3	132.9	0	0	0	0	0	117.6
251	G	35.2	Very low	38.8	Very low	73 Å²	73	130.1 Å²	130.1	75%	0.753	80%	0.799	S	S	*	*			trans	160.3	58.5	161.8	0	0	0	0	0	116.5
252	S	40.5	Very low	39	Very low	131 Å²	131	127.3 Å²	127.3	92%	0.916	80%	0.8	S	S	*	*			trans	39.2	119.9	144.1	-47	0	0	0	0	121.3
253	G	37.8	Very low	39	Very low	76 Å²	76	124 Å²	124	78%	0.784	80%	0.797	S	S	*	*			trans	140.9	91.2	144.4	0	0	0	0	0	117.8
254	A	37.9	Very low	39.3	Very low	91 Å²	91	122 Å²	122	75%	0.752	80%	0.8	S	S	*	*			trans	21.6	113	146.2	0	0	0	0	0	120
255	S	42.9	Very low	39.1	Very low	104 Å²	104	122.7 Å²	122.7	73%	0.727	80%	0.804	S	S	*	*				63	123.9	106.3	80.9	0	0	0	0	114.9
256	T	43.2	Very low	39.6	Very low	138 Å²	138	122.5 Å²	122.5	85%	0.847	80%	0.803	S	S	*	*				-172.3	151.4	53.2	16	0	0	0	0	110.2
257	N	39.2	Very low	39.7	Very low	153 Å²	153	124.2 Å²	124.2	82%	0.818	82%	0.816	S	S	*	*			trans	-38.6	148	172.1	-80.6	-32.5	0	0	0	117.3
258	T	44.2	Very low	39.9	Very low	146 Å²	146	122.1 Å²	122.1	90%	0.896	82%	0.817	S	S	*	*				-167.2	134.5	113.5	19.1	0	0	0	0	112.4
259	N	42	Very low	40.1	Very low	155 Å²	155	126.8 Å²	126.8	83%	0.829	82%	0.819	S	S	*	*			trans	-60.3	151	175.5	-88.7	-29.5	0	0	0	113.9
260	S	41.1	Very low	40.2	Very low	118 Å²	118	132.1 Å²	132.1	83%	0.825	81%	0.812	S	S	*	*				-176.7	144.3	119.1	-177.2	0	0	0	0	111.9
261	N	44	Very low	40.4	Very low	132 Å²	132	138.7 Å²	138.7	71%	0.706	81%	0.809	S	S	*	*			trans	-88.9	156.2	-167	-53.2	-47.9	0	0	0	113.6
262	N	42.7	Very low	40.5	Very low	155 Å²	155	141.7 Å²	141.7	83%	0.829	81%	0.808	S	S	*	*				169.7	112.7	126.1	-90.9	-13.1	0	0	0	109.5
263	A	42	Very low	40.2	Very low	91 Å²	91	146.5 Å²	146.5	75%	0.752	81%	0.806	S	S	*	*				78.3	132.6	90.9	0	0	0	0	0	112.2
264	S	42.9	Very low	40	Very low	114 Å²	114	148.1 Å²	148.1	80%	0.797	81%	0.806	S	S	*	*			cis	-167.2	160.3	5.1	53.1	0	0	0	0	110.9
265	N	37.6	Very low	40.1	Very low	150 Å²	150	149.4 Å²	149.4	80%	0.802	81%	0.806	S	S	*	*			trans	-43.4	146.2	174	-62.5	-48.6	0	0	0	118.7
266	R	43.1	Very low	39.8	Very low	245 Å²	245	152.6 Å²	152.6	93%	0.925	81%	0.81	S	S	*	*				-175.8	125.3	113.2	-110.7	177.3	176.2	171.6	0	114
267	P	39.7	Very low	39.2	Very low	128 Å²	128	153.2 Å²	153.2	83%	0.831	81%	0.807	S	S	*	*			trans	-113.9	151.5	165.5	36.8	-25.3	0	0	0	112.6
268	G	38.5	Very low	38.8	Very low	79 Å²	79	153.7 Å²	153.7	81%	0.814	80%	0.804	S	S	*	*			trans	147.8	153.9	165.2	0	0	0	0	0	112
269	R	38.3	Very low	38.3	Very low	210 Å²	210	152.2 Å²	152.2	79%	0.792	79%	0.791	S	S	*	*			cis	-179.6	149.2	-11.1	-164.6	-172.7	179.4	177.5	2.8	104
270	R	39.1	Very low	37.8	Very low	196 Å²	196	151.8 Å²	151.8	74%	0.74	79%	0.788	S	S	*	*			trans	88.3	112.5	160.1	-53.4	-173.5	173	-178.1	-3.1	115.9
271	R	37.1	Very low	37.4	Very low	227 Å²	227	153.2 Å²	153.2	86%	0.857	78%	0.782	S	S	*	*				72.7	106.9	65.6	-76.9	-169	-173.2	173.9	1.1	113.9
272	N	36.9	Very low	36.8	Very low	137 Å²	137	155.7 Å²	155.7	73%	0.733	78%	0.781	S	S	*	*				150	132.9	112.9	-85	-21.5	0	0	0	113.6
273	R	33.6	Very low	36.6	Very low	232 Å²	232	154.8 Å²	154.8	88%	0.875	78%	0.776	S	S	*	*			trans	35.9	132.3	134.1	-63.9	-178.3	-177.4	177.7	-0.9	117.8
274	S	34.1	Very low	36	Very low	110 Å²	110	157.9 Å²	157.9	77%	0.769	78%	0.78	S	S	*	*			cis	-172.8	172.4	35.1	-98.9	0	0	0	0	109.3
275	P	40.2	Very low	35.4	Very low	118 Å²	118	157.2 Å²	157.2	77%	0.766	78%	0.782	S	S	*	*			trans	-93.7	146.2	-171.9	36.5	-30.7	0	0	0	113.2
276	Q	35.6	Very low	35	Very low	171 Å²	171	156.4 Å²	156.4	80%	0.799	78%	0.782	S	S	*	*			trans	-176.5	116.8	154.4	-84.8	-121.2	7.4	0	0	106.6
277	L	31	Very low	34.3	Very low	151 Å²	151	153.5 Å²	153.5	79%	0.791	78%	0.779	S	S	*	*				63	131.3	102.7	-101.4	159.1	0	0	0	113.9
278	Q	32.1	Very low	33.6	Very low	163 Å²	163	157.3 Å²	157.3	76%	0.762	78%	0.779	S	S	*	*			trans	110.5	115.7	160.3	-83.5	-175.9	-13.6	0	0	119.8
279	N	32.1	Very low	32.9	Very low	115 Å²	115	160.6 Å²	160.6	62%	0.615	78%	0.777	S	S	*	*				109.8	91.2	126.7	-68.3	-11.1	0	0	0	118.2
280	N	31.3	Very low	32.3	Very low	145 Å²	145	158.2 Å²	158.2	78%	0.775	77%	0.774	S	S	*	*				46	111.2	106.2	-60.8	-11.9	0	0	0	118.2
281	H	33	Very low	31.7	Very low	149 Å²	149	154.5 Å²	154.5	69%	0.69	77%	0.769	S	S	*	*			trans	-160.1	118.5	134	-124.5	26.2	0	0	0	109.6
282	R	31.8	Very low	31.4	Very low	183 Å²	183	151.1 Å²	151.1	69%	0.691	77%	0.768	S	S	*	*				85.7	126.1	105.6	-103.4	-166.8	161.6	113.7	-2.8	110.8
283	D	38.2	Very low	30.8	Very low	136 Å²	136	154.8 Å²	154.8	73%	0.727	77%	0.773	S	S	*	*			cis	-152.4	152.7	41.3	-75.8	-57.8	0	0	0	114
284	D	29	Very low	30.5	Very low	156 Å²	156	149.2 Å²	149.2	83%	0.834	77%	0.77	S	S	*	*			trans	-57.8	152.6	174.4	-69.7	-57.3	0	0	0	115.1
285	A	31.2	Very low	30.2	Very low	100 Å²	100	150 Å²	150	83%	0.826	77%	0.77	S	S	*	*				159.2	126.9	108.6	0	0	0	0	0	112.8
286	T	29.3	Very low	29.4	Very low	133 Å²	133	149.1 Å²	149.1	82%	0.816	77%	0.766	S	S	*	*			trans	-71	133.4	169.4	43.7	0	0	0	0	113.3
287	E	28.6	Very low	28.9	Very low	185 Å²	185	147.4 Å²	147.4	86%	0.864	77%	0.767	S	S	*	*			trans	-171.1	107.1	152.6	-113.5	173.8	172.6	0	0	108.4
288	Y	24	Very low	28.6	Very low	207 Å²	207	150 Å²	150	81%	0.812	77%	0.768	S	S	*	*				50.9	120.4	93.9	-81	-80.6	0	0	0	116
289	L	24.2	Very low	28.3	Very low	149 Å²	149	148 Å²	148	78%	0.78	77%	0.769	S	S	*	*			trans	62.3	102.9	147.4	-82	143.1	0	0	0	119.7
290	H	26.6	Very low	28	Very low	159 Å²	159	149 Å²	149	74%	0.736	78%	0.779	S	S	*	*				175.9	115.1	125.5	-116.3	45.7	0	0	0	109.9
291	N	26.7	Very low	27.8	Very low	118 Å²	118	145.3 Å²	145.3	63%	0.631	78%	0.776	S	S	*	*				67.1	114.9	96.5	-84.9	-10.7	0	0	0	113.8
292	D	30	Very low	27.7	Very low	156 Å²	156	145.6 Å²	145.6	83%	0.834	78%	0.781	S	S	*	*			trans	-157.9	107.2	132.5	-94.4	-28.9	0	0	0	112
293	Y	24.1	Very low	27.5	Very low	215 Å²	215	139.8 Å²	139.8	84%	0.843	78%	0.778	S	S	*	*			trans	32.4	109.1	139	-87.9	-98.3	0	0	0	120.4
294	S	27	Very low	27.1	Very low	115 Å²	115	141.2 Å²	141.2	80%	0.804	79%	0.786	S	S	*	*			trans	-156.9	102.1	132.8	-92.9	0	0	0	0	111.8
295	T	27.6	Very low	27.2	Very low	127 Å²	127	140.6 Å²	140.6	78%	0.779	78%	0.781	S	S	*	*			trans	47.3	96.5	136.5	1.9	0	0	0	0	118	V297	T295-V297 PolarHBondContact O-N 2.65Å
296	S	23.2	Very low	27.4	Very low	98 Å²	98	143.8 Å²	143.8	69%	0.685	79%	0.785	S	S	*	*			trans	-57.4	117	165	53.5	0	0	0	0	113.2
297	V	26.3	Very low	27.7	Very low	135 Å²	135	141 Å²	141	82%	0.818	76%	0.764	S	S	*	*			trans	-133.9	105	150.2	-179	0	0	0	0	106.3	T295 P299	T295-V297 PolarHBondContact O-N 2.65Å; V297-P299 WeakPolarHBondContact O-CD 3.22Å
298	Y	23.5	Very low	27.9	Very low	207 Å²	207	135.8 Å²	135.8	81%	0.812	75%	0.747	S	S	*	*			trans	-70.3	126.1	177.1	-76.9	-97.1	0	0	0	110.2
299	P	27	Very low	28.8	Very low	120 Å²	120	131.4 Å²	131.4	78%	0.779	74%	0.744	S	S	*	*			trans	-85.7	119.9	147.5	31.1	-24	0	0	0	107.6	V297 G301	V297-P299 WeakPolarHBondContact O-CD 3.22Å; P299-G301 PolarHBondContact O-N 2.82Å
300	V	26.4	Very low	29.4	Very low	135 Å²	135	128 Å²	128	82%	0.818	74%	0.737	S	S	*	*			trans	-59.1	94.7	177.7	177.8	0	0	0	0	109.4	I302	V300-I302 PolarHBondContact O-N 2.92Å
301	G	26.9	Very low	29.9	Very low	69 Å²	69	125.6 Å²	125.6	71%	0.711	72%	0.722	S	S	*	*			trans	-81.9	108.8	170.3	0	0	0	0	0	109.5	P299 G303	P299-G301 PolarHBondContact O-N 2.82Å; G301-G303 PolarHBondContact O-N 2.99Å
302	I	29.8	Very low	30.6	Very low	154 Å²	154	123.6 Å²	123.6	79%	0.79	72%	0.715	S	S	*	*			trans	-61.9	121.7	171.3	-57.8	173	0	0	0	107.3	V300	V300-I302 PolarHBondContact O-N 2.92Å
303	G	28	Very low	31	Very low	62 Å²	62	120.4 Å²	120.4	64%	0.639	70%	0.697	S	S	*	*			trans	-59.6	147.3	-165.6	0	0	0	0	0	115.1	G301 L305	G301-G303 PolarHBondContact O-N 2.99Å; G303-L305 VanDerWaalsContact C-N 3.29Å; G303-L305 PolarHBondContact O-N 2.95Å
304	N	29.7	Very low	31.6	Very low	166 Å²	166	115 Å²	115	89%	0.888	69%	0.686	S	S	*	*			trans	-58.1	90.9	161.4	-68.5	-22.2	0	0	0	109.1
305	L	30.9	Very low	32.1	Very low	142 Å²	142	113.7 Å²	113.7	74%	0.743	67%	0.673	S	S	*	*			trans	-93.2	116.3	155.2	-155.8	74.8	0	0	0	104.8	G303 L307	G303-L305 VanDerWaalsContact C-N 3.29Å; G303-L305 PolarHBondContact O-N 2.95Å; L305-L307 VanDerWaalsContact C-N 3.27Å; L305-L307 HydrophobicContact CB-CD1 3.76Å; L305-L307 HydrophobicContact CD2-CD1 4.04Å; L305-L307 HydrophobicContact CG-CD1 4.17Å; L305-L307 WeakPolarHBondContact O-CD1 3.29Å; L305-L307 PolarHBondContact O-N 3.17Å
306	D	34.7	Very low	32.6	Very low	167 Å²	167	114.9 Å²	114.9	89%	0.893	67%	0.668	S	S	*	*			trans	-64.5	87.5	177	-84.2	-33.9	0	0	0	109
307	L	36.2	Very low	33.1	Very low	74 Å²	74	115.7 Å²	115.7	39%	0.387	66%	0.664	S	S	.	*			trans	-82.2	137.8	173.9	-85.1	86.9	0	0	0	109.9	L305 Y311 V315	L305-L307 VanDerWaalsContact C-N 3.27Å; L305-L307 HydrophobicContact CB-CD1 3.76Å; L305-L307 HydrophobicContact CD2-CD1 4.04Å; L305-L307 HydrophobicContact CG-CD1 4.17Å; L305-L307 WeakPolarHBondContact O-CD1 3.29Å; L305-L307 PolarHBondContact O-N 3.17Å; L307-Y311 HydrophobicContact CD2-CG 4.33Å; L307-V315 HydrophobicContact CD2-CG2 4.21Å
308	P	33.7	Very low	33.3	Very low	76 Å²	76	114 Å²	114	49%	0.494	66%	0.659	S	S	.	*			trans	-54.4	150.5	173	-21.2	29.9	0	0	0	111.4	A310 Y311	P308-A310 PolarHBondContact O-N 3.3Å; P308-Y311 HydrophobicContact CB-CD2 4.16Å; P308-Y311 HydrophobicContact CG-CD2 4.27Å; P308-Y311 HydrophobicContact CG-CE2 4.47Å; P308-Y311 PolarHBondContact O-N 3.23Å
309	P	41.3	Very low	33.6	Very low	116 Å²	116	107.8 Å²	107.8	75%	0.753	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-50.7	-29	-171.1	-27.1	32.5	0	0	0	115	Y311 T312	P309-Y311 PolarHBondContact O-N 3.04Å; P309-T312 PolarHBondContact O-OG1 2.68Å
310	A	37.2	Very low	33.8	Very low	78 Å²	78	108 Å²	108	65%	0.645	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-67.3	-10.4	179.7	0	0	0	0	0	115.4	P308	P308-A310 PolarHBondContact O-N 3.3Å
311	Y	37.8	Very low	33.9	Very low	107 Å²	107	110.1 Å²	110.1	42%	0.42	64%	0.644	S	S	.	*	G	3₁₀ helix	trans	-115.7	-0.4	-172.6	-64.4	-83.1	0	0	0	115	L307 P308 P309 D313 V314	L307-Y311 HydrophobicContact CD2-CG 4.33Å; P308-Y311 HydrophobicContact CB-CD2 4.16Å; P308-Y311 HydrophobicContact CG-CD2 4.27Å; P308-Y311 HydrophobicContact CG-CE2 4.47Å; P308-Y311 PolarHBondContact O-N 3.23Å; P309-Y311 PolarHBondContact O-N 3.04Å; Y311-D313 PolarHBondContact O-N 2.99Å; Y311-V314 PolarHBondContact O-N 2.71Å
312	T	42.2	Very low	34	Very low	77 Å²	77	113.2 Å²	113.2	47%	0.472	65%	0.649	S	S	.	*	H	α-helix	trans	-67.1	-24.7	176.4	57.2	0	0	0	0	112.8	P309	P309-T312 PolarHBondContact O-OG1 2.68Å
313	D	37.3	Very low	34	Very low	88 Å²	88	114.9 Å²	114.9	47%	0.471	65%	0.654	S	S	.	*	H	α-helix	trans	-79.4	-28.3	178.2	-73	-12	0	0	0	113.1	Y311 L317	Y311-D313 PolarHBondContact O-N 2.99Å; D313-L317 WeakPolarHBondContact O-CD1 3.37Å
314	V	37.4	Very low	34	Very low	101 Å²	101	116.7 Å²	116.7	61%	0.612	66%	0.657	S	S	*	*	H	α-helix	trans	-81.5	-29.1	-175.5	-163	0	0	0	0	111.6	Y311	Y311-V314 PolarHBondContact O-N 2.71Å
315	V	36.6	Very low	33.9	Very low	88 Å²	88	115.9 Å²	115.9	53%	0.533	65%	0.652	S	S	.	*	H	α-helix	trans	-84.9	-21.5	179.9	-175.8	0	0	0	0	112	L307 S318	L307-V315 HydrophobicContact CD2-CG2 4.21Å; V315-S318 PolarHBondContact O-OG 2.81Å; V315-S318 VanDerWaalsContact O-OG 3.1Å
316	K	38.5	Very low	33.8	Very low	153 Å²	153	116.1 Å²	116.1	67%	0.665	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-13.1	175.9	-86.8	-178.1	174.8	-179	0	114.6
317	L	32.9	Very low	33.5	Very low	114 Å²	114	114.7 Å²	114.7	60%	0.597	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-13.7	176.5	-89.9	93.2	0	0	0	114.4	D313	D313-L317 WeakPolarHBondContact O-CD1 3.37Å
318	S	31.1	Very low	33.3	Very low	101 Å²	101	118.8 Å²	118.8	71%	0.706	67%	0.669	S	S	*	*	S	Bend	trans	-90.2	-7.3	178.6	54.6	0	0	0	0	114	V315	V315-S318 PolarHBondContact O-OG 2.81Å; V315-S318 VanDerWaalsContact O-OG 3.1Å
319	A	30.1	Very low	32.9	Very low	76 Å²	76	122.3 Å²	122.3	63%	0.628	68%	0.684	S	S	*	*			trans	-99.2	62.5	169.5	0	0	0	0	0	110.2
320	I	30.3	Very low	32.4	Very low	123 Å²	123	124.2 Å²	124.2	63%	0.631	69%	0.688	S	S	*	*			trans	-95.6	101.7	160.6	-63.6	173.9	0	0	0	105	T322	I320-T322 PolarHBondContact O-N 3.35Å
321	E	30.2	Very low	31.8	Very low	181 Å²	181	128.3 Å²	128.3	85%	0.846	70%	0.699	S	S	*	*			trans	-60.1	117.9	167.9	-72.8	179.7	157.6	0	0	108.3	E323	E321-E323 PolarHBondContact O-N 2.74Å
322	T	28	Very low	31.4	Very low	134 Å²	134	128.7 Å²	128.7	82%	0.822	71%	0.712	S	S	*	*			trans	-65.7	96.7	170.6	-32.2	0	0	0	0	107.9	I320 S324	I320-T322 PolarHBondContact O-N 3.35Å; T322-S324 VanDerWaalsContact C-N 3.35Å; T322-S324 PolarHBondContact O-N 2.78Å
323	E	28.8	Very low	30.6	Very low	188 Å²	188	133.1 Å²	133.1	88%	0.879	73%	0.733	S	S	*	*			trans	-65.5	100	164.1	-88.8	-172.6	157.3	0	0	108.4	E321 N325	E321-E323 PolarHBondContact O-N 2.74Å; E323-N325 PolarHBondContact O-N 3.38Å
324	S	29.2	Very low	30.1	Very low	101 Å²	101	135.5 Å²	135.5	71%	0.706	75%	0.746	S	S	*	*			trans	-60.9	102.3	167.4	156.4	0	0	0	0	109	T322 N326	T322-S324 VanDerWaalsContact C-N 3.35Å; T322-S324 PolarHBondContact O-N 2.78Å; S324-N326 PolarHBondContact O-N 2.69Å
325	N	27	Very low	29.6	Very low	148 Å²	148	134.7 Å²	134.7	79%	0.791	75%	0.749	S	S	*	*			trans	-62.9	98.8	172.2	-158	10.5	0	0	0	109.7	E323	E323-N325 PolarHBondContact O-N 3.38Å
326	N	30.2	Very low	29.2	Very low	147 Å²	147	137.4 Å²	137.4	79%	0.786	76%	0.759	S	S	*	*			trans	-121.1	104.1	167.9	-135.2	1	0	0	0	108.7	S324 N328	S324-N326 PolarHBondContact O-N 2.69Å; N326-N328 PolarHBondContact O-N 3.19Å
327	N	27.7	Very low	28.6	Very low	137 Å²	137	137.5 Å²	137.5	73%	0.733	77%	0.766	S	S	*	*			trans	-48.4	119	171.7	-80.3	-30.2	0	0	0	110.3
328	N	30.9	Very low	28.5	Very low	160 Å²	160	138.3 Å²	138.3	86%	0.856	77%	0.769	S	S	*	*			trans	-155.3	121.1	137.8	-99.8	-24.2	0	0	0	110.5	N326 N330	N326-N328 PolarHBondContact O-N 3.19Å; N328-N330 PolarHBondContact O-N 2.68Å
329	N	27	Very low	28.4	Very low	150 Å²	150	138.7 Å²	138.7	80%	0.802	77%	0.769	S	S	*	*			trans	-41.5	127.7	169.3	-68.1	-35.4	0	0	0	111.4
330	N	30.4	Very low	28.2	Very low	157 Å²	157	142.2 Å²	142.2	84%	0.84	78%	0.778	S	S	*	*				-169.5	127.6	127.4	-89.3	-23.8	0	0	0	110.5	N328 T332	N328-N330 PolarHBondContact O-N 2.68Å; N330-T332 PolarHBondContact O-N 2.87Å
331	N	24.9	Very low	28	Very low	164 Å²	164	139.8 Å²	139.8	88%	0.877	78%	0.776	S	S	*	*			trans	-46.1	115	166.4	-85.6	-28.7	0	0	0	111.5
332	T	27.9	Very low	28	Very low	115 Å²	115	137.8 Å²	137.8	71%	0.706	77%	0.765	S	S	*	*			trans	-162.8	133.9	144.6	38.4	0	0	0	0	110.4	N330 N334	N330-T332 PolarHBondContact O-N 2.87Å; T332-N334 PolarHBondContact O-N 3.42Å
333	N	26.9	Very low	27.8	Very low	169 Å²	169	136.8 Å²	136.8	90%	0.904	76%	0.763	S	S	*	*			trans	-53.1	95.3	175.3	-58.5	-36	0	0	0	111.8	A335	N333-A335 PolarHBondContact O-N 2.82Å
334	N	27.1	Very low	27.8	Very low	139 Å²	139	135 Å²	135	74%	0.743	75%	0.753	S	S	*	*			trans	-95.8	84.8	174.3	-76	-5.4	0	0	0	109.7	T332 I336	T332-N334 PolarHBondContact O-N 3.42Å; N334-I336 PolarHBondContact O-N 3.29Å
335	A	27	Very low	27.5	Very low	83 Å²	83	137.7 Å²	137.7	69%	0.686	76%	0.759	S	S	*	*			trans	-58.2	125.2	155.4	0	0	0	0	0	108	N333 I337	N333-A335 PolarHBondContact O-N 2.82Å; A335-I337 PolarHBondContact O-N 3.44Å
336	I	27.4	Very low	27.5	Very low	145 Å²	145	138 Å²	138	74%	0.744	76%	0.76	S	S	*	*			trans	-64.5	103.2	172.8	-65.9	169.4	0	0	0	107.2	N334 I338	N334-I336 PolarHBondContact O-N 3.29Å; I336-I338 HydrophobicContact CG2-CG1 4.35Å; I336-I338 PolarHBondContact O-N 2.87Å
337	I	26	Very low	27.3	Very low	155 Å²	155	139.1 Å²	139.1	80%	0.795	77%	0.765	S	S	*	*			trans	-76.3	101.2	174.1	-60.1	171.3	0	0	0	106.8	A335	A335-I337 PolarHBondContact O-N 3.44Å
338	I	29.9	Very low	27.3	Very low	131 Å²	131	138.2 Å²	138.2	67%	0.672	77%	0.767	S	S	*	*			trans	-77.1	126.6	164.7	-57.8	175.1	0	0	0	106	I336 D340	I336-I338 HydrophobicContact CG2-CG1 4.35Å; I336-I338 PolarHBondContact O-N 2.87Å; I338-D340 PolarHBondContact O-N 2.77Å; I338-D340 VanDerWaalsContact O-N 3.14Å
339	P	28.8	Very low	27.3	Very low	110 Å²	110	138.4 Å²	138.4	71%	0.714	77%	0.768	S	S	*	*			trans	-64.3	118.7	-177.1	23.9	-31.2	0	0	0	110.4	A341	P339-A341 PolarHBondContact O-N 3.31Å
340	D	27.2	Very low	27.4	Very low	150 Å²	150	140.4 Å²	140.4	80%	0.802	77%	0.772	S	S	*	*			trans	-57.1	105.3	172.9	-83.7	-31.4	0	0	0	110.3	I338	I338-D340 PolarHBondContact O-N 2.77Å; I338-D340 VanDerWaalsContact O-N 3.14Å
341	A	25	Very low	27.2	Very low	72 Å²	72	141.9 Å²	141.9	60%	0.595	77%	0.774	S	S	*	*			trans	-99.4	56.2	169.7	0	0	0	0	0	110.4	P339	P339-A341 PolarHBondContact O-N 3.31Å
342	F	30.1	Very low	27.4	Very low	138 Å²	138	142.8 Å²	142.8	61%	0.605	77%	0.773	S	S	*	*			trans	-151	95.3	156.1	-80	-72.4	0	0	0	109.9	F344	F342-F344 HydrophobicContact CB-CD2 4.14Å; F342-F344 HydrophobicContact CB-CE2 3.96Å; F342-F344 HydrophobicContact CD1-CE2 4.24Å; F342-F344 HydrophobicContact CG-CE2 4.28Å; F342-F344 PolarHBondContact O-N 2.83Å; F342-F344 VanDerWaalsContact O-N 3.08Å
343	S	24.6	Very low	27.5	Very low	113 Å²	113	146.4 Å²	146.4	79%	0.79	78%	0.782	S	S	*	*			trans	-74.2	92.5	168.6	-39.5	0	0	0	0	109.2
344	F	28.1	Very low	27.4	Very low	150 Å²	150	145.8 Å²	145.8	66%	0.658	78%	0.777	S	S	*	*			trans	-88	104.7	159.2	-72	-76.8	0	0	0	107.9	F342 L346	F342-F344 HydrophobicContact CB-CD2 4.14Å; F342-F344 HydrophobicContact CB-CE2 3.96Å; F342-F344 HydrophobicContact CD1-CE2 4.24Å; F342-F344 HydrophobicContact CG-CE2 4.28Å; F342-F344 PolarHBondContact O-N 2.83Å; F342-F344 VanDerWaalsContact O-N 3.08Å; F344-L346 PolarHBondContact O-N 2.94Å
345	N	23.2	Very low	27.6	Very low	158 Å²	158	146.7 Å²	146.7	85%	0.845	78%	0.78	S	S	*	*			trans	-63	96.9	173.5	-76.6	-18.5	0	0	0	109.7
346	L	28.1	Very low	27.7	Very low	156 Å²	156	150.1 Å²	150.1	82%	0.817	79%	0.787	S	S	*	*			trans	-106.5	115.6	161.9	-79.2	156.2	0	0	0	107.2	F344	F344-L346 PolarHBondContact O-N 2.94Å
347	L	25.9	Very low	27.7	Very low	170 Å²	170	148.7 Å²	148.7	89%	0.89	79%	0.787	S	S	*	*			trans	-49.2	130.3	175.8	-110.6	70.2	0	0	0	110.4
348	P	28	Very low	27.9	Very low	117 Å²	117	146.8 Å²	146.8	76%	0.76	79%	0.788	S	S	*	*			trans	-86.7	116.2	173.6	32.4	-26.9	0	0	0	109
349	N	29.4	Very low	27.7	Very low	164 Å²	164	149.9 Å²	149.9	88%	0.877	80%	0.796	S	S	*	*			trans	-162	115.9	147.6	-106.1	-7.5	0	0	0	109.8
350	E	30	Very low	27.5	Very low	192 Å²	192	152 Å²	152	90%	0.897	80%	0.801	S	S	*	*			trans	136.6	63.2	155.6	-72.6	-170.2	176	0	0	112.1
351	Q	25.9	Very low	27.4	Very low	188 Å²	188	149.3 Å²	149.3	88%	0.879	79%	0.794	S	S	*	*			trans	-79.4	112.4	145.8	-79.1	-176.7	-21.2	0	0	107.5
352	Q	28.4	Very low	27.4	Very low	184 Å²	184	155.1 Å²	155.1	86%	0.86	81%	0.806	S	S	*	*			trans	166.6	96.7	143	-94.3	164	11.4	0	0	110.3
353	Q	29.6	Very low	27	Very low	191 Å²	191	154.6 Å²	154.6	89%	0.893	82%	0.82	S	S	*	*				167.2	109	113.4	-97.2	175.9	-15.3	0	0	111.1
354	I	25.4	Very low	27.1	Very low	156 Å²	156	154 Å²	154	80%	0.8	82%	0.816	S	S	*	*			trans	-58.9	135.6	153.8	-63.5	159.9	0	0	0	107.9
355	I	31.4	Very low	27.1	Very low	157 Å²	157	151.9 Å²	151.9	81%	0.805	82%	0.819	S	S	*	*			trans	177.2	105.9	134.4	-81.1	146.6	0	0	0	108.9
356	N	28.7	Very low	27.3	Very low	155 Å²	155	151.1 Å²	151.1	83%	0.829	82%	0.815	S	S	*	*			trans	37.6	152.3	145.7	-87.4	-3.8	0	0	0	125.4
357	P	28.5	Very low	27.3	Very low	115 Å²	115	153 Å²	153	75%	0.747	82%	0.819	S	S	*	*			trans	-101.3	150.9	-152.3	38.8	-31.5	0	0	0	113.5
358	S	29.9	Very low	27.5	Very low	115 Å²	115	149.7 Å²	149.7	80%	0.804	81%	0.806	S	S	*	*			trans	-153.6	113.7	160.2	49	0	0	0	0	111.2
359	F	24.7	Very low	27.8	Very low	196 Å²	196	151.3 Å²	151.3	86%	0.86	80%	0.803	S	S	*	*			trans	-12.6	129.4	151.9	-76.7	-98.3	0	0	0	116.5
360	L	25.7	Very low	27.9	Very low	155 Å²	155	149.6 Å²	149.6	81%	0.812	79%	0.79	S	S	*	*				144.7	109.8	129.2	-83.1	154.1	0	0	0	112.6
361	S	24	Very low	28.3	Very low	94 Å²	94	143.6 Å²	143.6	66%	0.657	76%	0.761	S	S	*	*			trans	53.7	104.2	138.5	53.9	0	0	0	0	119.2
362	K	24.8	Very low	28.6	Very low	193 Å²	193	139 Å²	139	84%	0.839	74%	0.743	S	S	*	*				161.6	121	113.9	-92.7	167.9	177	173	0	110.1	S364	K362-S364 PolarHBondContact O-N 3.34Å
363	S	23.2	Very low	28.7	Very low	128 Å²	128	133.3 Å²	133.3	90%	0.895	72%	0.722	S	S	*	*			trans	22.6	90.4	139.5	167	0	0	0	0	115.2
364	S	26.2	Very low	28.9	Very low	101 Å²	101	125.9 Å²	125.9	71%	0.706	69%	0.694	S	S	*	*			trans	-151.9	114.7	163.1	-175.1	0	0	0	0	109.1	K362 N366	K362-S364 PolarHBondContact O-N 3.34Å; S364-N366 PolarHBondContact O-N 2.97Å; S364-N366 VanDerWaalsContact O-N 3.13Å
365	S	27.3	Very low	29.1	Very low	104 Å²	104	124.3 Å²	124.3	73%	0.727	69%	0.686	S	S	*	*			trans	-58.3	103.7	177.2	50.1	0	0	0	0	111.1
366	N	27.8	Very low	29	Very low	142 Å²	142	124.5 Å²	124.5	76%	0.759	68%	0.678	S	S	*	*			trans	-116	103.5	161.5	-88.4	-16.1	0	0	0	108.3	S364 T368	S364-N366 PolarHBondContact O-N 2.97Å; S364-N366 VanDerWaalsContact O-N 3.13Å; N366-T368 PolarHBondContact O-N 3.2Å
367	H	28	Very low	28.9	Very low	196 Å²	196	124.4 Å²	124.4	91%	0.907	68%	0.677	S	S	*	*			trans	-61.1	102.2	173	-78.6	-71.5	0	0	0	109.9
368	T	29.6	Very low	29	Very low	101 Å²	101	123.6 Å²	123.6	62%	0.62	67%	0.667	S	S	*	*			trans	-107.1	136	161.3	39.7	0	0	0	0	107.2	N366 Q370	N366-T368 PolarHBondContact O-N 3.2Å; T368-Q370 PolarHBondContact O-N 3.46Å
369	H	36.2	Very low	28.8	Very low	151 Å²	151	127.8 Å²	127.8	70%	0.699	67%	0.674	S	S	*	*			trans	-59.1	95.3	-178.6	-80.7	-89.5	0	0	0	110.5	Q126	Q126-H369 PolarHBondContact NE2-O 3.12Å
370	Q	30.5	Very low	29	Very low	127 Å²	127	125.6 Å²	125.6	59%	0.593	67%	0.666	S	S	*	*			trans	-106.7	121.6	-179.8	-155.6	171.2	19.8	0	0	108.7	T368 N372	T368-Q370 PolarHBondContact O-N 3.46Å; Q370-N372 PolarHBondContact O-N 3.42Å
371	F	38.1	Very low	28.9	Very low	67 Å²	67	125.1 Å²	125.1	29%	0.294	66%	0.664	S	S	.	*	P	Polyproline II helix	trans	-72.5	119.2	172	-70.9	-73.6	0	0	0	109.6	Q126 C199	Q126-F371 HydrophobicContact CB-CD2 4.44Å; Q126-F371 HydrophobicContact CG-CD2 4.42Å; C199-F371 HydrophobicContact CB-CD1 4.48Å
372	N	32.3	Very low	28.9	Very low	91 Å²	91	125.3 Å²	125.3	49%	0.487	67%	0.672	S	S	.	*	P	Polyproline II helix	trans	-80.2	128	169.8	-85.1	-11.1	0	0	0	110	S200 Q370	S200-N372 WeakPolarHBondContact CB-O 3.44Å; S200-N372 PolarHBondContact OG-O 2.94Å; Q370-N372 PolarHBondContact O-N 3.42Å
373	C	31.7	Very low	28.9	Very low	65 Å²	65	121.9 Å²	121.9	44%	0.439	67%	0.667	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.1	122.6	173.9	-68	0	0	0	0	109.5	P197	P197-C373 HydrophobicContact CB-CB 4.03Å; P197-C373 HydrophobicContact CG-CB 3.52Å; P197-C373 VanDerWaalsContact CG-SG 3.6Å
374	A	32.8	Very low	29	Very low	35 Å²	35	120 Å²	120	29%	0.289	65%	0.654	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.3	123.3	170.9	0	0	0	0	0	109.2	Y376	A374-Y376 HydrophobicContact CB-CE2 4.25Å; A374-Y376 PolarHBondContact O-N 3.3Å
375	L	28.8	Very low	28.9	Very low	122 Å²	122	120.6 Å²	120.6	64%	0.639	66%	0.658	S	S	*	*			trans	-72.7	117	164.2	-87.4	157.7	0	0	0	107.5
376	Y	30.4	Very low	28.9	Very low	162 Å²	162	123 Å²	123	64%	0.635	66%	0.657	S	S	*	*			trans	-94	101.5	169.8	-83.6	-84.9	0	0	0	108.9	A374 N378	A374-Y376 HydrophobicContact CB-CE2 4.25Å; A374-Y376 PolarHBondContact O-N 3.3Å; Y376-N378 PolarHBondContact O-N 3.42Å
377	D	26.3	Very low	28.8	Very low	153 Å²	153	123.3 Å²	123.3	82%	0.818	66%	0.658	S	S	*	*			trans	-78.3	94.2	157.2	-72.2	-24.7	0	0	0	107.3
378	N	30.8	Very low	28.7	Very low	98 Å²	98	120.4 Å²	120.4	52%	0.524	65%	0.648	S	S	.	*			trans	-130.8	90.3	167.7	-95.4	-24.2	0	0	0	109.1	Y376 Q380	Y376-N378 PolarHBondContact O-N 3.42Å; N378-Q380 HydrophobicContact CB-CB 4.36Å; N378-Q380 HydrophobicContact CB-CG 4.1Å; N378-Q380 PolarHBondContact O-N 3.36Å
379	E	26.3	Very low	28.5	Very low	203 Å²	203	122.5 Å²	122.5	95%	0.949	66%	0.656	S	S	*	*			trans	-58.6	71.4	135.9	-71.7	-170.7	152.6	0	0	108.4	N381	E379-N381 VanDerWaalsContact C-N 3.35Å; E379-N381 PolarHBondContact O-N 2.96Å
380	Q	28.2	Very low	28.1	Very low	150 Å²	150	122 Å²	122	70%	0.701	66%	0.657	S	S	*	*			trans	-86.5	91.4	162.4	-88.9	-172.5	-0.8	0	0	107.8	N378 A382	N378-Q380 HydrophobicContact CB-CB 4.36Å; N378-Q380 HydrophobicContact CB-CG 4.1Å; N378-Q380 PolarHBondContact O-N 3.36Å; Q380-A382 VanDerWaalsContact C-N 3.32Å; Q380-A382 PolarHBondContact O-N 2.87Å
381	N	23.8	Very low	28	Very low	145 Å²	145	121.8 Å²	121.8	78%	0.775	66%	0.664	S	S	*	*			trans	-37.2	93.8	155.4	-133.1	-2.7	0	0	0	109.8	E379 T383	E379-N381 VanDerWaalsContact C-N 3.35Å; E379-N381 PolarHBondContact O-N 2.96Å; N381-T383 PolarHBondContact O-N 2.95Å
382	A	24.7	Very low	27.5	Very low	98 Å²	98	124.1 Å²	124.1	81%	0.81	69%	0.689	S	S	*	*			trans	-80.9	72.1	171.5	0	0	0	0	0	108.5	Q380 S384	Q380-A382 VanDerWaalsContact C-N 3.32Å; Q380-A382 PolarHBondContact O-N 2.87Å; A382-S384 PolarHBondContact O-N 3.23Å
383	T	23.3	Very low	27.3	Very low	121 Å²	121	125.5 Å²	125.5	74%	0.742	70%	0.701	S	S	*	*			trans	-68	86.6	157	46	0	0	0	0	107.9	N381	N381-T383 PolarHBondContact O-N 2.95Å
384	S	25.7	Very low	27.2	Very low	89 Å²	89	130.3 Å²	130.3	62%	0.622	72%	0.722	S	S	*	*			trans	-115.7	84.2	158.5	-167.5	0	0	0	0	107.8	A382 Q386	A382-S384 PolarHBondContact O-N 3.23Å; S384-Q386 PolarHBondContact O-N 3.48Å
385	S	24.3	Very low	27.2	Very low	112 Å²	112	136.6 Å²	136.6	78%	0.783	75%	0.749	S	S	*	*			trans	-59.3	87.9	159	48.8	0	0	0	0	108.8
386	Q	27.8	Very low	27.5	Very low	154 Å²	154	134.7 Å²	134.7	72%	0.72	75%	0.751	S	S	*	*			trans	-112	94.9	156.9	-73.3	-169.9	5.5	0	0	107.7	S384 L388	S384-Q386 PolarHBondContact O-N 3.48Å; Q386-L388 VanDerWaalsContact C-N 3.3Å; Q386-L388 PolarHBondContact O-N 3.26Å
387	I	24.8	Very low	27.8	Very low	150 Å²	150	132.4 Å²	132.4	77%	0.769	76%	0.756	S	S	*	*			trans	-64.3	95.3	164.1	-62.2	167.8	0	0	0	106.1	N389	I387-N389 VanDerWaalsContact C-N 3.32Å; I387-N389 PolarHBondContact O-N 3.43Å; I387-N389 VanDerWaalsContact O-N 3.17Å
388	L	26	Very low	28.6	Very low	135 Å²	135	130.7 Å²	130.7	71%	0.707	75%	0.753	S	S	*	*			trans	-78.5	90.5	162.7	-103	143	0	0	0	107.1	Q386 I390	Q386-L388 VanDerWaalsContact C-N 3.3Å; Q386-L388 PolarHBondContact O-N 3.26Å; L388-I390 VanDerWaalsContact C-N 3.28Å; L388-I390 HydrophobicContact CD2-CD1 4.33Å; L388-I390 HydrophobicContact CD2-CG1 4.21Å; L388-I390 PolarHBondContact O-N 2.99Å
389	N	25	Very low	29.2	Very low	145 Å²	145	131.5 Å²	131.5	78%	0.775	76%	0.764	S	S	*	*			trans	-61.5	92.1	162.2	-106	-0.1	0	0	0	107.8	I387	I387-N389 VanDerWaalsContact C-N 3.32Å; I387-N389 PolarHBondContact O-N 3.43Å; I387-N389 VanDerWaalsContact O-N 3.17Å
390	I	29.5	Very low	30.2	Very low	140 Å²	140	127.3 Å²	127.3	72%	0.718	75%	0.754	S	S	*	*			trans	-99.9	96.9	163.3	-58.5	175.3	0	0	0	106	L388 S392	L388-I390 VanDerWaalsContact C-N 3.28Å; L388-I390 HydrophobicContact CD2-CD1 4.33Å; L388-I390 HydrophobicContact CD2-CG1 4.21Å; L388-I390 PolarHBondContact O-N 2.99Å; I390-S392 PolarHBondContact O-N 2.85Å
391	T	28.3	Very low	31.1	Very low	123 Å²	123	125 Å²	125	76%	0.755	75%	0.752	S	S	*	*			trans	-56.1	122.7	171.3	-30	0	0	0	0	108.7	T393	T391-T393 PolarHBondContact O-N 3.46Å
392	S	27.2	Very low	32.3	Very low	116 Å²	116	121.7 Å²	121.7	81%	0.811	74%	0.738	S	S	*	*			trans	-61	110	178.9	-179.6	0	0	0	0	111.6	I390	I390-S392 PolarHBondContact O-N 2.85Å
393	T	28	Very low	33.4	Very low	120 Å²	120	119.7 Å²	119.7	74%	0.736	72%	0.719	S	S	*	*			trans	-149.4	120.4	159.1	45.4	0	0	0	0	109.5	T391	T391-T393 PolarHBondContact O-N 3.46Å
394	D	30	Very low	34.2	Very low	166 Å²	166	122.4 Å²	122.4	89%	0.888	72%	0.717	S	S	*	*			trans	60.9	78.7	171.2	-71.7	-23.5	0	0	0	118.8
395	I	32.3	Very low	35.6	Very low	166 Å²	166	125.6 Å²	125.6	85%	0.851	72%	0.722	S	S	*	*			trans	-118.2	103.5	156.3	-54.5	177.5	0	0	0	107.5
396	A	34.8	Very low	36.7	Very low	82 Å²	82	126 Å²	126	68%	0.678	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-57.3	141.4	169.5	0	0	0	0	0	109.7
397	P	37.7	Very low	37.6	Very low	115 Å²	115	122.9 Å²	122.9	75%	0.747	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-57.8	141.6	176.5	24	-32.3	0	0	0	110
398	P	41.3	Very low	38.6	Very low	116 Å²	116	118.2 Å²	118.2	75%	0.753	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-58	141.6	178.1	23.8	-32.5	0	0	0	110.1
399	P	43.8	Very low	39.5	Very low	116 Å²	116	114.6 Å²	114.6	75%	0.753	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-61.8	147.7	-179.9	25.2	-32.9	0	0	0	110.9
400	P	47.2	Very low	40.3	Very low	115 Å²	115	110.6 Å²	110.6	75%	0.747	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-61.8	150.3	175.9	26.4	-33.2	0	0	0	111
401	P	48.2	Very low	41.1	Very low	100 Å²	100	108 Å²	108	65%	0.649	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-60.1	145.9	178.1	25.4	-33.5	0	0	0	111.2
402	P	48.1	Very low	41.7	Very low	76 Å²	76	106.4 Å²	106.4	49%	0.494	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-61	146.6	178.5	24.6	-32.6	0	0	0	111.1	E406	P402-E406 WeakPolarHBondContact CA-OE2 3.49Å; P402-E406 HydrophobicContact CB-CB 4.19Å; P402-E406 VanDerWaalsContact CB-OE2 3.22Å; P402-E406 WeakPolarHBondContact CB-OE2 3.42Å
403	S	47.6	Very low	42.5	Very low	57 Å²	57	103.2 Å²	103.2	40%	0.399	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-68.6	156.7	-179	71.8	0	0	0	0	111.4	E405 E406 I407	S403-E405 PolarHBondContact O-N 3.16Å; S403-E405 VanDerWaalsContact O-N 3.16Å; S403-E406 PolarHBondContact N-OE2 3.23Å; S403-E406 WeakPolarHBondContact O-CB 3.36Å; S403-E406 PolarHBondContact O-N 3.46Å; S403-E406 PolarHBondContact OG-N 2.88Å; S403-I407 PolarHBondContact O-N 3.42Å
404	Y	40.6	Very low	43.1	Very low	177 Å²	177	104.3 Å²	104.3	69%	0.694	61%	0.61	S	S	*	*	H	α-helix	trans	-53.7	-34.6	175.2	175	-101.8	0	0	0	112.6	I407 V408	Y404-I407 PolarHBondContact O-N 3.39Å; Y404-V408 HydrophobicContact CD1-CG2 4.33Å; Y404-V408 HydrophobicContact CE1-CG2 3.91Å; Y404-V408 HydrophobicContact CE2-CG2 4.15Å; Y404-V408 WeakPolarHBondContact O-CG2 3.38Å; Y404-V408 PolarHBondContact O-N 3.3Å
405	E	55.4	Low	43.6	Very low	156 Å²	156	102.6 Å²	102.6	73%	0.729	60%	0.595	S	S	*	*	H	α-helix	trans	-66	-37.4	177.8	-68.4	163.5	-178.2	0	0	112	S403 V408 A409	S403-E405 PolarHBondContact O-N 3.16Å; S403-E405 VanDerWaalsContact O-N 3.16Å; E405-V408 PolarHBondContact O-N 2.95Å; E405-A409 WeakPolarHBondContact O-CB 3.06Å; E405-A409 PolarHBondContact O-N 3.01Å
406	E	48	Very low	44	Very low	120 Å²	120	99.3 Å²	99.3	56%	0.561	58%	0.578	S	S	*	*	H	α-helix	trans	-68.9	-38.2	177.6	-134.8	173.2	176.5	0	0	111.8	P402 S403 A409 A410	P402-E406 WeakPolarHBondContact CA-OE2 3.49Å; P402-E406 HydrophobicContact CB-CB 4.19Å; P402-E406 VanDerWaalsContact CB-OE2 3.22Å; P402-E406 WeakPolarHBondContact CB-OE2 3.42Å; S403-E406 PolarHBondContact N-OE2 3.23Å; S403-E406 WeakPolarHBondContact O-CB 3.36Å; S403-E406 PolarHBondContact O-N 3.46Å; S403-E406 PolarHBondContact OG-N 2.88Å; E406-A409 PolarHBondContact O-N 3.43Å; E406-A410 WeakPolarHBondContact O-CB 3.43Å; E406-A410 PolarHBondContact O-N 2.85Å
407	I	46.5	Very low	44.3	Very low	90 Å²	90	100.6 Å²	100.6	46%	0.462	57%	0.574	S	S	.	*	H	α-helix	trans	-66.8	-43.8	176	-60	169.1	0	0	0	110.2	S403 Y404 A410 T411	S403-I407 PolarHBondContact O-N 3.42Å; Y404-I407 PolarHBondContact O-N 3.39Å; I407-A410 PolarHBondContact O-N 2.98Å; I407-T411 PolarHBondContact O-N 3.21Å; I407-T411 PolarHBondContact O-OG1 3.41Å
408	V	45.8	Very low	44.3	Very low	52 Å²	52	104.6 Å²	104.6	32%	0.315	57%	0.574	S	S	.	*	H	α-helix	trans	-65.5	-40.3	177.3	173.3	0	0	0	0	111.2	Y404 E405 T411 N412	Y404-V408 HydrophobicContact CD1-CG2 4.33Å; Y404-V408 HydrophobicContact CE1-CG2 3.91Å; Y404-V408 HydrophobicContact CE2-CG2 4.15Å; Y404-V408 WeakPolarHBondContact O-CG2 3.38Å; Y404-V408 PolarHBondContact O-N 3.3Å; E405-V408 PolarHBondContact O-N 2.95Å; V408-T411 PolarHBondContact O-N 3.4Å; V408-N412 WeakPolarHBondContact O-CB 3.22Å; V408-N412 PolarHBondContact O-N 2.76Å; V408-N412 PolarHBondContact O-ND2 3.17Å
409	A	45.1	Very low	44.3	Very low	58 Å²	58	104.9 Å²	104.9	48%	0.479	57%	0.565	S	S	.	*	H	α-helix	trans	-62.9	-44.4	175.9	0	0	0	0	0	112.3	E405 E406 T411 N412 A413	E405-A409 WeakPolarHBondContact O-CB 3.06Å; E405-A409 PolarHBondContact O-N 3.01Å; E406-A409 PolarHBondContact O-N 3.43Å; A409-T411 VanDerWaalsContact C-N 3.34Å; A409-T411 PolarHBondContact O-N 3.08Å; A409-N412 PolarHBondContact O-N 2.77Å; A409-A413 WeakPolarHBondContact O-CB 3.41Å; A409-A413 PolarHBondContact O-N 3.37Å
410	A	41.9	Very low	44.2	Very low	61 Å²	61	104.5 Å²	104.5	50%	0.504	56%	0.557	S	S	.	*	H	α-helix	trans	-63.9	-38.3	176.8	0	0	0	0	0	112.4	E406 I407 A413 M414	E406-A410 WeakPolarHBondContact O-CB 3.43Å; E406-A410 PolarHBondContact O-N 2.85Å; I407-A410 PolarHBondContact O-N 2.98Å; A410-A413 PolarHBondContact O-N 2.8Å; A410-M414 PolarHBondContact O-N 2.8Å; A410-M414 VanDerWaalsContact O-N 3.13Å
411	T	44.7	Very low	43.8	Very low	87 Å²	87	105.9 Å²	105.9	53%	0.534	56%	0.558	S	S	.	*	H	α-helix	trans	-69.7	-37.9	178.5	-41.8	0	0	0	0	111.7	I407 V408 A409 M414 K415	I407-T411 PolarHBondContact O-N 3.21Å; I407-T411 PolarHBondContact O-OG1 3.41Å; V408-T411 PolarHBondContact O-N 3.4Å; A409-T411 VanDerWaalsContact C-N 3.34Å; A409-T411 PolarHBondContact O-N 3.08Å; T411-M414 PolarHBondContact O-N 2.91Å; T411-K415 PolarHBondContact O-N 2.96Å
412	N	42.6	Very low	43.2	Very low	88 Å²	88	107.6 Å²	107.6	47%	0.471	56%	0.562	S	S	.	*	H	α-helix	trans	-70.7	-36.5	176	-73.1	-19.9	0	0	0	112.2	V408 A409 M414 K415 I416	V408-N412 WeakPolarHBondContact O-CB 3.22Å; V408-N412 PolarHBondContact O-N 2.76Å; V408-N412 PolarHBondContact O-ND2 3.17Å; A409-N412 PolarHBondContact O-N 2.77Å; N412-M414 VanDerWaalsContact C-N 3.34Å; N412-M414 PolarHBondContact O-N 3.36Å; N412-K415 PolarHBondContact O-N 3.21Å; N412-I416 WeakPolarHBondContact O-CG1 3.31Å; N412-I416 PolarHBondContact O-N 3.5Å; N412-I416 VanDerWaalsContact O-N 3.1Å
413	A	42.2	Very low	42.4	Very low	50 Å²	50	108.3 Å²	108.3	41%	0.413	57%	0.569	S	S	.	*	H	α-helix	trans	-64.3	-37.6	174	0	0	0	0	0	112.4	A409 A410 K415 N417	A409-A413 WeakPolarHBondContact O-CB 3.41Å; A409-A413 PolarHBondContact O-N 3.37Å; A410-A413 PolarHBondContact O-N 2.8Å; A413-K415 VanDerWaalsContact C-N 3.32Å; A413-K415 PolarHBondContact O-N 3.49Å; A413-N417 PolarHBondContact O-N 3.3Å; A413-N417 PolarHBondContact O-ND2 2.79Å
414	M	41	Very low	41.4	Very low	142 Å²	142	114.9 Å²	114.9	70%	0.7	59%	0.59	S	S	*	*	H	α-helix	trans	-65.8	-32.9	173.3	-108.8	-178.1	179.9	0	0	113	A410 T411 N412 R418	A410-M414 PolarHBondContact O-N 2.8Å; A410-M414 VanDerWaalsContact O-N 3.13Å; T411-M414 PolarHBondContact O-N 2.91Å; N412-M414 VanDerWaalsContact C-N 3.34Å; N412-M414 PolarHBondContact O-N 3.36Å; M414-R418 PolarHBondContact O-N 2.79Å
415	K	41	Very low	41	Very low	130 Å²	130	114.5 Å²	114.5	57%	0.565	60%	0.599	S	S	*	*	H	α-helix	trans	-72.2	-39.5	178.6	-159.5	177.7	179.4	-170.9	0	112.1	T411 N412 A413 R418 E419	T411-K415 PolarHBondContact O-N 2.96Å; N412-K415 PolarHBondContact O-N 3.21Å; A413-K415 VanDerWaalsContact C-N 3.32Å; A413-K415 PolarHBondContact O-N 3.49Å; K415-R418 PolarHBondContact O-N 3.19Å; K415-E419 PolarHBondContact O-N 3.4Å; K415-E419 VanDerWaalsContact O-N 3.12Å
416	I	41.6	Very low	39.7	Very low	97 Å²	97	113.1 Å²	113.1	50%	0.497	61%	0.606	S	S	.	*	H	α-helix	trans	-68.1	-36.4	178.6	-63.9	163.1	0	0	0	111.5	N412 R418 E419 N420	N412-I416 WeakPolarHBondContact O-CG1 3.31Å; N412-I416 PolarHBondContact O-N 3.5Å; N412-I416 VanDerWaalsContact O-N 3.1Å; I416-R418 VanDerWaalsContact C-N 3.31Å; I416-R418 PolarHBondContact O-N 2.81Å; I416-E419 PolarHBondContact O-N 2.76Å; I416-N420 PolarHBondContact O-N 3.17Å
417	N	40.5	Very low	38.8	Very low	109 Å²	109	110.4 Å²	110.4	58%	0.583	61%	0.61	S	S	*	*	H	α-helix	trans	-70.8	-27	176.4	-71.2	-21.2	0	0	0	112.8	A413	A413-N417 PolarHBondContact O-N 3.3Å; A413-N417 PolarHBondContact O-ND2 2.79Å
418	R	38	Very low	38	Very low	199 Å²	199	114 Å²	114	75%	0.751	63%	0.631	S	S	*	*	H	α-helix	trans	-84.6	-22.5	178.2	-158.1	172	177.8	151	-1.1	113.3	M414 K415 I416	M414-R418 PolarHBondContact O-N 2.79Å; K415-R418 PolarHBondContact O-N 3.19Å; I416-R418 VanDerWaalsContact C-N 3.31Å; I416-R418 PolarHBondContact O-N 2.81Å
419	E	39.6	Very low	37.1	Very low	123 Å²	123	121.6 Å²	121.6	58%	0.575	66%	0.659	S	S	*	*	H	α-helix	trans	-80.9	-21.6	174.1	-77.8	173	-177.5	0	0	112.7	K415 I416	K415-E419 PolarHBondContact O-N 3.4Å; K415-E419 VanDerWaalsContact O-N 3.12Å; I416-E419 PolarHBondContact O-N 2.76Å
420	N	42.6	Very low	36.3	Very low	108 Å²	108	127 Å²	127	58%	0.578	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-82.8	-15.8	176.7	-76.1	-18.8	0	0	0	114.8	I416	I416-N420 PolarHBondContact O-N 3.17Å
421	D	39.7	Very low	35.5	Very low	143 Å²	143	131.8 Å²	131.8	77%	0.765	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-90.4	-3.1	179.2	-76.7	-20.7	0	0	0	114
422	N	35.4	Very low	34.8	Very low	136 Å²	136	135 Å²	135	73%	0.727	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-101.8	14.4	179.9	-73.7	-24.3	0	0	0	114	F424	N422-F424 VanDerWaalsContact C-N 3.28Å; N422-F424 PolarHBondContact O-N 3.4Å; N422-F424 VanDerWaalsContact O-N 3.13Å
423	S	29.9	Very low	34.1	Very low	92 Å²	92	134.7 Å²	134.7	64%	0.643	72%	0.716	S	S	*	*			trans	-85.9	43.5	-177.9	77	0	0	0	0	113.9
424	F	27.9	Very low	33.3	Very low	195 Å²	195	141.1 Å²	141.1	86%	0.855	74%	0.737	S	S	*	*			trans	-160.2	84.2	166.2	-104.5	-81.9	0	0	0	109.4	N422	N422-F424 VanDerWaalsContact C-N 3.28Å; N422-F424 PolarHBondContact O-N 3.4Å; N422-F424 VanDerWaalsContact O-N 3.13Å
425	I	31.6	Very low	32.7	Very low	169 Å²	169	140.7 Å²	140.7	87%	0.867	74%	0.742	S	S	*	*			trans	-174.5	102	136.9	-86.5	147.1	0	0	0	106.4
426	S	28.3	Very low	32.2	Very low	126 Å²	126	140.6 Å²	140.6	88%	0.881	75%	0.753	S	S	*	*			trans	-66.5	132.1	169.5	153.9	0	0	0	0	110.2
427	G	28	Very low	31.5	Very low	63 Å²	63	144.7 Å²	144.7	65%	0.649	77%	0.77	S	S	*	*			trans	172.7	95.7	164.9	0	0	0	0	0	115.4
428	N	30.9	Very low	31	Very low	167 Å²	167	148.8 Å²	148.8	89%	0.893	79%	0.785	S	S	*	*			trans	75.9	93.4	157.6	-64.8	-9.2	0	0	0	119.4
429	K	27.2	Very low	30.6	Very low	210 Å²	210	145.2 Å²	145.2	91%	0.913	79%	0.786	S	S	*	*			trans	-51.2	132.9	147.5	-76.8	174.2	171.2	176.5	0	111
430	M	27.7	Very low	30.2	Very low	171 Å²	171	147.4 Å²	147.4	84%	0.842	80%	0.796	S	S	*	*			trans	-146.6	110.9	139	-155.8	175.6	-67	0	0	110.1
431	N	26.1	Very low	29.7	Very low	162 Å²	162	148.4 Å²	148.4	87%	0.866	80%	0.801	S	S	*	*			trans	-58.5	130.7	163.2	-93.3	-19.7	0	0	0	109.2
432	I	29.4	Very low	29.2	Very low	156 Å²	156	147 Å²	147	80%	0.8	80%	0.798	S	S	*	*			trans	-134	115.8	148.3	-61.5	-177	0	0	0	108.4
433	A	28.3	Very low	29.1	Very low	81 Å²	81	147.4 Å²	147.4	67%	0.669	81%	0.805	S	S	*	*			trans	-70.5	165.2	174.8	0	0	0	0	0	111.7
434	Q	25.5	Very low	29	Very low	185 Å²	185	148.4 Å²	148.4	86%	0.864	81%	0.807	S	S	*	*			trans	-23.3	140.3	156.9	-61.1	169.6	-62.9	0	0	113.9
435	V	28.6	Very low	29.3	Very low	133 Å²	133	145 Å²	145	81%	0.806	80%	0.803	S	S	*	*			trans	-176.3	112.7	133.2	150.5	0	0	0	0	110
436	T	28.7	Very low	29.3	Very low	127 Å²	127	142.4 Å²	142.4	78%	0.779	80%	0.795	S	S	*	*			trans	12	137.5	141.9	21.1	0	0	0	0	122.2
437	H	27.2	Very low	29.4	Very low	184 Å²	184	141.5 Å²	141.5	85%	0.852	78%	0.784	S	S	*	*			trans	-40	137.4	157	-82.5	-104.1	0	0	0	114.4
438	Q	31.3	Very low	29.8	Very low	195 Å²	195	143.4 Å²	143.4	91%	0.911	79%	0.794	S	S	*	*			trans	-159.8	135.5	136	-108	171.4	23.9	0	0	110.9
439	T	29.3	Very low	29.8	Very low	124 Å²	124	142 Å²	142	76%	0.761	79%	0.786	S	S	*	*			trans	-63.3	147.7	175	32.3	0	0	0	0	113.7
440	E	31	Very low	30.3	Very low	168 Å²	168	139.5 Å²	139.5	79%	0.785	78%	0.783	S	S	*	*				158.5	140.3	119.2	-88.8	179.9	168.7	0	0	113.6
441	D	32.4	Very low	30.7	Very low	129 Å²	129	136.5 Å²	136.5	69%	0.69	78%	0.779	S	S	*	*			trans	79.7	98.9	144.4	-63.9	-15.4	0	0	0	124.5
442	T	29.5	Very low	31	Very low	113 Å²	113	135.9 Å²	135.9	69%	0.693	78%	0.775	S	S	*	*				44.5	111	110.4	-39.6	0	0	0	0	119.7
443	V	33.1	Very low	31.4	Very low	146 Å²	146	135.4 Å²	135.4	89%	0.885	78%	0.78	S	S	*	*			trans	-151.3	125.1	134.2	-178.6	0	0	0	0	111.3
444	T	27.6	Very low	31.5	Very low	113 Å²	113	137.4 Å²	137.4	69%	0.693	78%	0.784	S	S	*	*			trans	-79.2	142.2	176.2	-42.2	0	0	0	0	113
445	T	34	Very low	31.8	Very low	123 Å²	123	140 Å²	140	76%	0.755	79%	0.788	S	S	*	*			trans	-159.2	103.5	144	-34.6	0	0	0	0	112.5
446	T	31.9	Very low	32	Very low	115 Å²	115	139.2 Å²	139.2	71%	0.706	79%	0.788	S	S	*	*				21.7	145.1	126.5	23.2	0	0	0	0	120
447	T	30.6	Very low	32.4	Very low	107 Å²	107	137 Å²	137	66%	0.656	79%	0.791	S	S	*	*			cis	-171.9	145.6	6.4	-52.7	0	0	0	0	107.3
448	A	34.7	Very low	32.8	Very low	103 Å²	103	133.2 Å²	133.2	85%	0.851	79%	0.785	S	S	*	*			trans	-160.3	124.7	144.7	0	0	0	0	0	111.2
449	N	32.5	Very low	33.1	Very low	136 Å²	136	130.7 Å²	130.7	73%	0.727	78%	0.778	S	S	*	*			trans	-85	168.1	-171.1	-81	-24.6	0	0	0	114.8
450	N	36.4	Very low	33.6	Very low	158 Å²	158	131.2 Å²	131.2	85%	0.845	78%	0.775	S	S	*	*			trans	111.3	120.9	160.8	-58.3	-18	0	0	0	111.8
451	S	36.6	Very low	34	Very low	108 Å²	108	130.7 Å²	130.7	76%	0.755	78%	0.778	S	S	*	*			cis	-171.6	142.5	31.7	36.5	0	0	0	0	111.9
452	N	33.2	Very low	34.3	Very low	149 Å²	149	131.2 Å²	131.2	80%	0.797	79%	0.786	S	S	*	*			trans	27.8	122.9	148.2	-62	-14.4	0	0	0	121.9
453	T	36.5	Very low	34.8	Very low	146 Å²	146	129.3 Å²	129.3	90%	0.896	79%	0.788	S	S	*	*				177.6	136.9	96	29.6	0	0	0	0	112.9
454	T	32.1	Very low	35.2	Very low	124 Å²	124	133.3 Å²	133.3	76%	0.761	79%	0.787	S	S	*	*			trans	-80.8	147.2	-175.6	-47.4	0	0	0	0	112.8
455	Y	31.8	Very low	35.8	Very low	239 Å²	239	133.5 Å²	133.5	94%	0.937	79%	0.789	S	S	*	*			trans	-168.3	126.9	130.7	-111.2	-78.8	0	0	0	111.7
456	S	31.7	Very low	36.1	Very low	116 Å²	116	136.1 Å²	136.1	81%	0.811	79%	0.792	S	S	*	*			trans	-92.8	151.5	175.2	-67.3	0	0	0	0	111.6
457	G	37.1	Very low	36.6	Very low	82 Å²	82	137.5 Å²	137.5	85%	0.845	80%	0.801	S	S	*	*			trans	-158.8	108.3	168	0	0	0	0	0	111.3
458	S	36.1	Very low	37	Very low	103 Å²	103	137.7 Å²	137.7	72%	0.72	81%	0.807	S	S	*	*			trans	-86.3	153.4	-177.3	44.2	0	0	0	0	114
459	N	37.9	Very low	37.6	Very low	142 Å²	142	138.3 Å²	138.3	76%	0.759	81%	0.805	S	S	*	*			trans	171.4	111.2	132.5	-84.4	-18.7	0	0	0	110
460	L	39	Very low	38.6	Very low	135 Å²	135	141.5 Å²	141.5	71%	0.707	84%	0.838	S	S	*	*				69.4	105.1	87.3	-96.6	142.5	0	0	0	114.7
461	N	39	Very low	38.7	Very low	157 Å²	157	140.7 Å²	140.7	84%	0.84	84%	0.838	S	S	*	*				-173.9	135.7	110.5	-95.4	-18.9	0	0	0	113.7
462	T	39.1	Very low	38.8	Very low	141 Å²	141	142.4 Å²	142.4	87%	0.865	84%	0.842	S	S	*	*			trans	-114.6	145.9	-177.5	-19.4	0	0	0	0	108.6
463	G	40.9	Very low	39.1	Very low	72 Å²	72	142.1 Å²	142.1	74%	0.742	84%	0.844	S	S	*	*			trans	167.4	80.2	171.6	0	0	0	0	0	110.8
464	R	39.8	Very low	39.3	Very low	230 Å²	230	141.8 Å²	141.8	87%	0.868	84%	0.841	S	S	*	*				83.7	126	77.4	-154.7	-159.2	174.1	109.1	-1.4	113.4
465	T	41.2	Very low	39.7	Very low	118 Å²	118	142.9 Å²	142.9	72%	0.724	85%	0.846	S	S	*	*			trans	91.5	111.3	146.2	15	0	0	0	0	120.7
466	E	40.1	Very low	40.2	Very low	177 Å²	177	136.5 Å²	136.5	83%	0.827	84%	0.84	S	S	*	*			trans	-52.3	150.4	155.2	-55.5	166.7	160.2	0	0	112.8
467	T	43.3	Very low	40.9	Very low	145 Å²	145	138 Å²	138	89%	0.89	84%	0.842	S	S	*	*				-173.4	133.6	122.2	18.6	0	0	0	0	110.7
468	S	37.3	Very low	41.1	Very low	111 Å²	111	142.3 Å²	142.3	78%	0.776	84%	0.842	S	S	*	*			trans	-76.3	149.5	172.4	33.6	0	0	0	0	111.9
469	S	47.3	Very low	41.6	Very low	116 Å²	116	145.6 Å²	145.6	81%	0.811	85%	0.852	S	S	*	*			trans	151.2	109.8	136.1	49.9	0	0	0	0	112.1
470	S	53.7	Low	41.9	Very low	203 Å²	203	145.9 Å²	145.9	100%	1.42	86%	0.861	S	S	*	*			trans	171.7	0	139.3	-69	0	0	0	0	108.7

Retrieved 470 of 470 residues in 226.5 ms (Link to these results)

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