A0A087X8R7_POEFO Loading...

Glutaredoxin and cysteine rich domain containing 2

AlphaFold DB , UniProt , Accession A0A087X8R7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 265 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	45.3	Very low	41.5	Very low	192 Å²	192	145.3 Å²	145.3	95%	0.946	66%	0.656	S	S	*	*				0	59.4	0	-77.5	-75.8	-81.1	0	0	111.9	L158 D159	M1-L158 CarbonylContact C-O 3.55Å; M1-L158 PolarHBondContact N-O 3.15Å; M1-D159 CarbonylContact C-O 3.57Å; M1-D159 WeakPolarHBondContact CA-O 3.36Å; M1-D159 PolarHBondContact N-O 3.39Å
2	E	49.4	Very low	41.7	Very low	48 Å²	48	149.4 Å²	149.4	22%	0.224	67%	0.665	C	S	.	*			trans	-133.7	-24.1	175.1	-74.6	-167.7	138.5	0	0	115.5	F4 Q5 P156 P157 L158 D159	E2-F4 PolarHBondContact O-N 3.47Å; E2-Q5 PolarHBondContact O-N 3.41Å; E2-Q5 VanDerWaalsContact O-N 3.16Å; E2-P156 WeakPolarHBondContact OE1-CB 3.39Å; E2-P157 VanDerWaalsContact CD-C 3.4Å; E2-P157 WeakPolarHBondContact OE1-CA 3.43Å; E2-L158 VanDerWaalsContact CD-N 3.32Å; E2-L158 VanDerWaalsContact CG-C 3.46Å; E2-L158 VanDerWaalsContact OE2-CA 3.24Å; E2-L158 WeakPolarHBondContact OE2-CA 3.31Å; E2-L158 PolarHBondContact OE2-N 2.91Å; E2-D159 PolarHBondContact N-O 3.42Å
3	E	42.2	Very low	41.7	Very low	68 Å²	68	152.9 Å²	152.9	32%	0.318	68%	0.684	S	S	.	*	H	α-helix	trans	-59.7	-27.9	-171.7	-89.7	-149.5	88.6	0	0	114.5	Q5 K7 E161	E3-Q5 VanDerWaalsContact C-N 3.29Å; E3-Q5 PolarHBondContact O-N 2.92Å; E3-K7 IonicContact OE1-NZ 3.35Å; E3-K7 PolarHBondContact OE1-NZ 3.41Å; E3-E161 WeakPolarHBondContact OE2-CG 3.34Å; E3-E161 PolarHBondContact OE2-N 2.89Å
4	F	40	Very low	42.2	Very low	148 Å²	148	147.1 Å²	147.1	65%	0.649	69%	0.688	S	S	*	*	H	α-helix	trans	-67.6	-22	-178.9	-76.4	-85.1	0	0	0	114.3	E2	E2-F4 PolarHBondContact O-N 3.47Å
5	Q	42.9	Very low	42.7	Very low	153 Å²	153	144.6 Å²	144.6	72%	0.715	69%	0.687	S	S	*	*	H	α-helix	trans	-81.6	-28.5	-178.4	-67.6	-165.2	0.5	0	0	113.8	E2 E3 N9	E2-Q5 PolarHBondContact O-N 3.41Å; E2-Q5 VanDerWaalsContact O-N 3.16Å; E3-Q5 VanDerWaalsContact C-N 3.29Å; E3-Q5 PolarHBondContact O-N 2.92Å; Q5-N9 PolarHBondContact O-ND2 2.74Å
6	R	43.1	Very low	43.8	Very low	187 Å²	187	147.1 Å²	147.1	71%	0.706	69%	0.694	S	S	*	*	H	α-helix	trans	-71.9	-36.5	-177.4	-59.7	-173.6	-165.1	168.4	8.6	112.4	L8	R6-L8 VanDerWaalsContact C-N 3.32Å; R6-L8 PolarHBondContact O-N 3.14Å
7	K	40.1	Very low	44.4	Very low	148 Å²	148	145.1 Å²	145.1	64%	0.643	70%	0.696	S	S	*	*	H	α-helix	trans	-74.7	-13.3	-177.1	-74.6	166.1	179.5	148.5	0	114.7	E3	E3-K7 IonicContact OE1-NZ 3.35Å; E3-K7 PolarHBondContact OE1-NZ 3.41Å
8	L	40.4	Very low	45.3	Very low	131 Å²	131	149.9 Å²	149.9	69%	0.686	71%	0.706	S	S	*	*	H	α-helix	trans	-86.2	-34.8	179.8	-126.6	167	0	0	0	112.8	R6	R6-L8 VanDerWaalsContact C-N 3.32Å; R6-L8 PolarHBondContact O-N 3.14Å
9	N	37.5	Very low	46.1	Very low	127 Å²	127	148.5 Å²	148.5	68%	0.679	70%	0.697	S	S	*	*	H	α-helix	trans	-74.7	-32.5	-177.2	-71.5	-72.7	0	0	0	113.1	Q5 R11 Y12	Q5-N9 PolarHBondContact O-ND2 2.74Å; N9-R11 PolarHBondContact O-N 3.46Å; N9-Y12 PolarHBondContact O-N 2.9Å
10	Q	38.4	Very low	46.5	Very low	175 Å²	175	146.1 Å²	146.1	82%	0.818	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-2.4	-174.6	-151.9	173.7	37.4	0	0	114.9
11	R	37.2	Very low	47.3	Very low	221 Å²	221	146.4 Å²	146.4	83%	0.834	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-6.7	175.3	-81.6	-154.3	-178.6	-162.7	4.3	115.3	N9	N9-R11 PolarHBondContact O-N 3.46Å
12	Y	44.3	Very low	47.9	Very low	195 Å²	195	144.2 Å²	144.2	77%	0.765	67%	0.673	S	S	*	*	S	Bend	trans	-100.2	-2.6	-171.2	-100.1	-81.4	0	0	0	116.3	N9	N9-Y12 PolarHBondContact O-N 2.9Å
13	E	41.7	Very low	48.7	Very low	195 Å²	195	148 Å²	148	91%	0.911	69%	0.688	S	S	*	*	S	Bend	trans	-94	-11	-175.5	-152.4	168	-125	0	0	114.2
14	G	48	Very low	49.9	Very low	71 Å²	71	150.1 Å²	150.1	73%	0.732	70%	0.701	S	S	*	*	S	Bend	trans	-99.7	-18.1	-172.1	0	0	0	0	0	116.9	K16	G14-K16 PolarHBondContact O-N 2.67Å
15	T	50	Low	51.3	Low	110 Å²	110	145.8 Å²	145.8	68%	0.675	69%	0.693	S	S	*	*			trans	-87.4	87.9	-174.3	22.7	0	0	0	0	112.8
16	K	59.7	Low	52.2	Low	184 Å²	184	139.8 Å²	139.8	80%	0.8	67%	0.668	S	S	*	*			trans	-47	137.5	155.6	-66.8	-179.6	179.4	179.1	0	108.9	G14 R18	G14-K16 PolarHBondContact O-N 2.67Å; K16-R18 PolarHBondContact O-N 2.77Å
17	P	54.7	Low	52.6	Low	113 Å²	113	136.1 Å²	136.1	73%	0.734	67%	0.671	S	S	*	*			trans	-57.9	127.7	179.2	24.2	-33.4	0	0	0	109.4	K19	P17-K19 PolarHBondContact O-N 3.03Å
18	R	60.6	Low	53.3	Low	233 Å²	233	139.7 Å²	139.7	88%	0.879	68%	0.682	S	S	*	*			trans	-63.7	103.2	-179.3	-80.2	-174.8	170.1	-174.6	-3.7	109.3	K16 V20	K16-R18 PolarHBondContact O-N 2.77Å; R18-V20 PolarHBondContact O-N 3.06Å
19	K	60.7	Low	54.6	Low	122 Å²	122	136.3 Å²	136.3	53%	0.53	67%	0.669	S	S	.	*			trans	-61.3	123.2	-179.7	-56.7	-165.2	-177.9	-160	0	109.4	P17 E38	P17-K19 PolarHBondContact O-N 3.03Å; K19-E38 HydrophobicContact CD-CB 4.21Å; K19-E38 WeakPolarHBondContact CD-OE2 3.19Å; K19-E38 VanDerWaalsContact CE-OE2 3.25Å; K19-E38 WeakPolarHBondContact CE-OE2 3.14Å; K19-E38 PolarHBondContact NZ-O 3.35Å; K19-E38 IonicContact NZ-OE2 2.68Å; K19-E38 PolarHBondContact NZ-OE2 2.92Å
20	V	54.2	Low	55.8	Low	100 Å²	100	133 Å²	133	61%	0.606	67%	0.665	S	S	*	*			trans	-101	117.4	-178.3	-95.8	0	0	0	0	109	R18 F22	R18-V20 PolarHBondContact O-N 3.06Å; V20-F22 HydrophobicContact CB-CE1 4.25Å; V20-F22 HydrophobicContact CB-CE2 4.13Å; V20-F22 HydrophobicContact CB-CZ 3.83Å; V20-F22 HydrophobicContact CG2-CE1 4.21Å; V20-F22 HydrophobicContact CG2-CE2 3.64Å; V20-F22 HydrophobicContact CG2-CZ 3.35Å; V20-F22 WeakPolarHBondContact O-CD2 3.24Å; V20-F22 WeakPolarHBondContact O-CE2 3.18Å; V20-F22 PolarHBondContact O-N 3.16Å
21	R	63.2	Low	57.1	Low	153 Å²	153	133.9 Å²	133.9	58%	0.577	66%	0.661	S	S	*	*			trans	-76.1	101.8	-179.9	-179.2	-176.1	177.5	-158.6	4.8	109.8	Y37	R21-Y37 VanDerWaalsContact NE-CE1 3.32Å; R21-Y37 PolarHBondContact NH2-OH 2.83Å
22	F	57.3	Low	58.3	Low	147 Å²	147	126.3 Å²	126.3	65%	0.645	64%	0.639	S	S	*	*			trans	-87	139.6	174.2	-54.9	-73.4	0	0	0	111.1	V20	V20-F22 HydrophobicContact CB-CE1 4.25Å; V20-F22 HydrophobicContact CB-CE2 4.13Å; V20-F22 HydrophobicContact CB-CZ 3.83Å; V20-F22 HydrophobicContact CG2-CE1 4.21Å; V20-F22 HydrophobicContact CG2-CE2 3.64Å; V20-F22 HydrophobicContact CG2-CZ 3.35Å; V20-F22 WeakPolarHBondContact O-CD2 3.24Å; V20-F22 WeakPolarHBondContact O-CE2 3.18Å; V20-F22 PolarHBondContact O-N 3.16Å
23	K	66.5	Low	59.1	Low	127 Å²	127	123.1 Å²	123.1	55%	0.552	63%	0.634	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-112.3	124.3	165	-65	-164.7	176.6	-169.1	0	108.3	V32 H35	K23-V32 HydrophobicContact CB-CG1 4.4Å; K23-H35 WeakPolarHBondContact CD-NE2 3.44Å; K23-H35 VanDerWaalsContact CE-NE2 3.29Å; K23-H35 WeakPolarHBondContact CE-NE2 3.33Å
24	L	68	Low	60.2	Low	112 Å²	112	120 Å²	120	59%	0.586	62%	0.618	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.4	111.7	174.3	-74.9	161.7	0	0	0	108.6	V32 L33 K34	L24-V32 CarbonylContact O-C 3.41Å; L24-V32 WeakPolarHBondContact O-CG1 3.5Å; L24-L33 PolarHBondContact O-N 3.39Å; L24-K34 HydrophobicContact CB-CB 4.48Å; L24-K34 PolarHBondContact N-O 3.33Å; L24-K34 VanDerWaalsContact N-O 3.13Å; L24-K34 PolarHBondContact O-N 3.38Å
25	A	69.1	Low	60.6	Low	58 Å²	58	120.3 Å²	120.3	48%	0.479	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.1	148.3	-179.8	0	0	0	0	0	111.6	S27 R31 V32	A25-S27 PolarHBondContact O-N 3.02Å; A25-R31 WeakPolarHBondContact CA-O 3.25Å; A25-V32 HydrophobicContact CB-CG2 4.46Å
26	S	61.5	Low	61	Low	27 Å²	27	118.7 Å²	118.7	19%	0.189	59%	0.59	C	S	.	*			trans	-67.2	126.3	172.5	176.9	0	0	0	0	110.2	Y28 S29 G30 R31	S26-Y28 PolarHBondContact O-N 3.44Å; S26-Y28 PolarHBondContact OG-N 2.95Å; S26-S29 VanDerWaalsContact CB-OG 3.29Å; S26-S29 WeakPolarHBondContact CB-OG 3.35Å; S26-S29 PolarHBondContact OG-N 3.22Å; S26-S29 PolarHBondContact OG-OG 3.12Å; S26-G30 WeakPolarHBondContact O-CA 3.4Å; S26-G30 PolarHBondContact O-N 3.28Å; S26-R31 PolarHBondContact N-O 3Å
27	S	52.3	Low	60.5	Low	110 Å²	110	117.1 Å²	117.1	77%	0.769	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-24.6	172.8	51.4	0	0	0	0	113.1	A25	A25-S27 PolarHBondContact O-N 3.02Å
28	Y	53.2	Low	60.9	Low	223 Å²	223	118 Å²	118	88%	0.875	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-42	-178.3	-178.3	-105.7	0	0	0	113	S26	S26-Y28 PolarHBondContact O-N 3.44Å; S26-Y28 PolarHBondContact OG-N 2.95Å
29	S	68.6	Low	60.3	Low	60 Å²	60	112.9 Å²	112.9	42%	0.42	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-117.7	-1.5	-172	63.4	0	0	0	0	115.4	S26 R31	S26-S29 VanDerWaalsContact CB-OG 3.29Å; S26-S29 WeakPolarHBondContact CB-OG 3.35Å; S26-S29 PolarHBondContact OG-N 3.22Å; S26-S29 PolarHBondContact OG-OG 3.12Å; S29-R31 PolarHBondContact O-N 2.85Å
30	G	62.4	Low	60	Low	57 Å²	57	111.6 Å²	111.6	59%	0.588	59%	0.586	S	S	*	*			trans	68.2	-18.8	-178.7	0	0	0	0	0	115.5	S26 V32	S26-G30 WeakPolarHBondContact O-CA 3.4Å; S26-G30 PolarHBondContact O-N 3.28Å; G30-V32 PolarHBondContact O-N 2.93Å
31	R	65.6	Low	59.4	Low	194 Å²	194	114.3 Å²	114.3	73%	0.732	59%	0.592	S	S	*	*			trans	-57.5	133.2	179.4	-60.3	-174.5	-174.5	-175.6	0.8	110.5	A25 S26 S29 L33	A25-R31 WeakPolarHBondContact CA-O 3.25Å; S26-R31 PolarHBondContact N-O 3Å; S29-R31 PolarHBondContact O-N 2.85Å; R31-L33 PolarHBondContact O-N 2.73Å
32	V	62.5	Low	58.6	Low	61 Å²	61	116.7 Å²	116.7	37%	0.37	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.6	113.3	175.1	-169.6	0	0	0	0	108.6	K23 L24 A25 G30	K23-V32 HydrophobicContact CB-CG1 4.4Å; L24-V32 CarbonylContact O-C 3.41Å; L24-V32 WeakPolarHBondContact O-CG1 3.5Å; A25-V32 HydrophobicContact CB-CG2 4.46Å; G30-V32 PolarHBondContact O-N 2.93Å
33	L	62	Low	58.1	Low	128 Å²	128	116.3 Å²	116.3	67%	0.67	61%	0.614	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.6	-29.1	-178.3	-57.1	177.8	0	0	0	112	L24 R31	L24-L33 PolarHBondContact O-N 3.39Å; R31-L33 PolarHBondContact O-N 2.73Å
34	K	64.5	Low	57	Low	129 Å²	129	118.8 Å²	118.8	56%	0.561	63%	0.627	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-152.3	128.1	172.7	-157.1	168.3	-173.6	172	0	112.2	L24 V36	L24-K34 HydrophobicContact CB-CB 4.48Å; L24-K34 PolarHBondContact N-O 3.33Å; L24-K34 VanDerWaalsContact N-O 3.13Å; L24-K34 PolarHBondContact O-N 3.38Å; K34-V36 HydrophobicContact CD-CG2 4.07Å; K34-V36 HydrophobicContact CG-CG2 4.02Å
35	H	56.3	Low	56.1	Low	79 Å²	79	118.4 Å²	118.4	37%	0.366	63%	0.634	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.2	137.3	155.1	-69.9	103.4	0	0	0	107.6	K23 Y37	K23-H35 WeakPolarHBondContact CD-NE2 3.44Å; K23-H35 VanDerWaalsContact CE-NE2 3.29Å; K23-H35 WeakPolarHBondContact CE-NE2 3.33Å; H35-Y37 HydrophobicContact CB-CE2 4.11Å
36	V	57.2	Low	55.1	Low	76 Å²	76	121.3 Å²	121.3	46%	0.461	65%	0.648	S	S	.	*			trans	-120.3	118.1	165.6	-177.7	0	0	0	0	107.7	K34	K34-V36 HydrophobicContact CD-CG2 4.07Å; K34-V36 HydrophobicContact CG-CG2 4.02Å
37	Y	49.4	Very low	54.5	Low	151 Å²	151	128.4 Å²	128.4	59%	0.592	68%	0.678	S	S	*	*			trans	-100.4	137.6	159	-54.7	-86.8	0	0	0	106.1	R21 H35	R21-Y37 VanDerWaalsContact NE-CE1 3.32Å; R21-Y37 PolarHBondContact NH2-OH 2.83Å; H35-Y37 HydrophobicContact CB-CE2 4.11Å
38	E	64.8	Low	54.3	Low	131 Å²	131	130.9 Å²	130.9	61%	0.612	68%	0.677	S	S	*	*			trans	-128.8	38.3	-179.2	-158.4	-161.4	-114.9	0	0	110.4	K19	K19-E38 HydrophobicContact CD-CB 4.21Å; K19-E38 WeakPolarHBondContact CD-OE2 3.19Å; K19-E38 VanDerWaalsContact CE-OE2 3.25Å; K19-E38 WeakPolarHBondContact CE-OE2 3.14Å; K19-E38 PolarHBondContact NZ-O 3.35Å; K19-E38 IonicContact NZ-OE2 2.68Å; K19-E38 PolarHBondContact NZ-OE2 2.92Å
39	D	47.4	Very low	54	Low	126 Å²	126	129 Å²	129	67%	0.674	67%	0.674	S	S	*	*	S	Bend	trans	-110.6	130.6	158.2	-67.2	-56.5	0	0	0	106.1	Q41	D39-Q41 PolarHBondContact O-N 3.22Å
40	G	54.1	Low	52.5	Low	95 Å²	95	134.1 Å²	134.1	98%	0.979	69%	0.685	S	S	*	*	S	Bend	trans	-75.9	47.7	-158.3	0	0	0	0	0	116.4
41	Q	42.3	Very low	52	Low	157 Å²	157	136.6 Å²	136.6	73%	0.734	69%	0.691	S	S	*	*			trans	-100.7	114.4	160.5	-78.4	-172.5	-34.3	0	0	109.2	D39 L43	D39-Q41 PolarHBondContact O-N 3.22Å; Q41-L43 PolarHBondContact O-N 3.17Å
42	E	45.6	Very low	51.1	Low	202 Å²	202	133.3 Å²	133.3	94%	0.944	68%	0.683	S	S	*	*			trans	-69.6	79.9	151.3	-67.9	-177.8	162.6	0	0	107	E44	E42-E44 PolarHBondContact O-N 3.47Å; E42-E44 VanDerWaalsContact O-N 3.12Å
43	L	46.3	Very low	50.2	Low	140 Å²	140	135.8 Å²	135.8	73%	0.733	70%	0.703	S	S	*	*			trans	-71.2	105.6	170.3	-124.1	169.4	0	0	0	106.4	Q41 S45	Q41-L43 PolarHBondContact O-N 3.17Å; L43-S45 PolarHBondContact O-N 2.67Å
44	E	44.2	Very low	49.4	Very low	178 Å²	178	137.9 Å²	137.9	83%	0.832	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-47.3	133.3	-178	-170.6	161	-149.8	0	0	110.4	E42	E42-E44 PolarHBondContact O-N 3.47Å; E42-E44 VanDerWaalsContact O-N 3.12Å
45	S	49.9	Very low	48.5	Very low	104 Å²	104	139.1 Å²	139.1	73%	0.727	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-56.7	126.9	-171.6	-66.3	0	0	0	0	109.1	L43 E47	L43-S45 PolarHBondContact O-N 2.67Å; S45-E47 PolarHBondContact O-N 2.8Å
46	P	46.6	Very low	47.7	Very low	119 Å²	119	144 Å²	144	77%	0.773	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-53.7	119.9	173.5	-23.7	33.2	0	0	0	108	E48	P46-E48 VanDerWaalsContact C-N 3.25Å; P46-E48 PolarHBondContact O-N 2.67Å
47	E	48.6	Very low	46.8	Very low	176 Å²	176	151.3 Å²	151.3	82%	0.822	76%	0.76	S	S	*	*			trans	-72.4	85.7	-169.1	-162.5	176.8	-165.7	0	0	109.5	S45 K49	S45-E47 PolarHBondContact O-N 2.8Å; E47-K49 VanDerWaalsContact C-N 3.32Å; E47-K49 PolarHBondContact O-N 3.41Å
48	E	49.7	Very low	46.4	Very low	162 Å²	162	153.8 Å²	153.8	76%	0.757	77%	0.774	S	S	*	*			trans	-69.2	88	-171	-170.8	173.2	-171.4	0	0	109.2	P46 Y50	P46-E48 VanDerWaalsContact C-N 3.25Å; P46-E48 PolarHBondContact O-N 2.67Å; E48-Y50 PolarHBondContact O-N 3.12Å
49	K	45.3	Very low	45.3	Very low	185 Å²	185	154.9 Å²	154.9	80%	0.804	78%	0.783	S	S	*	*			trans	-64.2	78.3	176.3	-82.6	-176.6	174.3	172.7	0	111.1	E47	E47-K49 VanDerWaalsContact C-N 3.32Å; E47-K49 PolarHBondContact O-N 3.41Å
50	Y	38.2	Very low	44.8	Very low	167 Å²	167	154 Å²	154	66%	0.655	78%	0.784	S	S	*	*			trans	-62.7	120.9	177	-146	-97.6	0	0	0	109.3	E48 H52	E48-Y50 PolarHBondContact O-N 3.12Å; Y50-H52 HydrophobicContact CD1-CB 4.4Å; Y50-H52 PolarHBondContact O-N 2.92Å
51	P	52.3	Low	44.4	Very low	109 Å²	109	155.9 Å²	155.9	71%	0.708	78%	0.779	S	S	*	*	S	Bend	trans	-79	30.7	-166.5	32.5	-37.5	0	0	0	114.3
52	H	46.3	Very low	44.3	Very low	124 Å²	124	153.5 Å²	153.5	57%	0.574	78%	0.78	S	S	*	*			trans	-136.8	84.1	-178	-64.4	-56.4	0	0	0	112.2	Y50 F54	Y50-H52 HydrophobicContact CD1-CB 4.4Å; Y50-H52 PolarHBondContact O-N 2.92Å; H52-F54 HydrophobicContact CB-CE2 4.12Å; H52-F54 WeakPolarHBondContact O-CD2 3.4Å; H52-F54 PolarHBondContact O-N 3.27Å; H52-F54 VanDerWaalsContact O-N 3.12Å
53	S	43.3	Very low	44.4	Very low	113 Å²	113	150.8 Å²	150.8	79%	0.79	77%	0.767	S	S	*	*			trans	-69.9	97.7	160.5	40.5	0	0	0	0	109.5	I55	S53-I55 PolarHBondContact O-N 3.21Å; S53-I55 VanDerWaalsContact O-N 3.14Å
54	F	46.2	Very low	44.3	Very low	173 Å²	173	152.2 Å²	152.2	76%	0.759	77%	0.774	S	S	*	*			trans	-62.2	116.2	176.1	-77.1	-88	0	0	0	110.6	H52 H56	H52-F54 HydrophobicContact CB-CE2 4.12Å; H52-F54 WeakPolarHBondContact O-CD2 3.4Å; H52-F54 PolarHBondContact O-N 3.27Å; H52-F54 VanDerWaalsContact O-N 3.12Å; F54-H56 PolarHBondContact O-N 3.43Å; F54-H56 VanDerWaalsContact O-N 3.1Å
55	I	44.7	Very low	44	Very low	155 Å²	155	150.9 Å²	150.9	80%	0.795	77%	0.768	S	S	*	*			trans	-69.1	108.2	179.6	-59.8	175.2	0	0	0	108.7	S53 R57	S53-I55 PolarHBondContact O-N 3.21Å; S53-I55 VanDerWaalsContact O-N 3.14Å; I55-R57 PolarHBondContact O-N 3.42Å
56	H	40	Very low	43.5	Very low	182 Å²	182	154.2 Å²	154.2	84%	0.843	77%	0.774	S	S	*	*			trans	-67.9	76.4	170.8	-89	-88.2	0	0	0	111.3	F54 K58	F54-H56 PolarHBondContact O-N 3.43Å; F54-H56 VanDerWaalsContact O-N 3.1Å; H56-K58 PolarHBondContact O-N 3.07Å
57	R	38.1	Very low	42.9	Very low	228 Å²	228	156.7 Å²	156.7	86%	0.86	78%	0.775	S	S	*	*			trans	-66.4	110.2	160.2	-97	-168.2	176.1	-164.7	0.5	108.3	I55 I59	I55-R57 PolarHBondContact O-N 3.42Å; R57-I59 PolarHBondContact O-N 2.9Å
58	K	39.6	Very low	42.4	Very low	204 Å²	204	155.4 Å²	155.4	89%	0.887	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-68.1	120.9	169.6	-65.2	-170.1	176.8	-173.2	0	109	H56	H56-K58 PolarHBondContact O-N 3.07Å
59	I	42.9	Very low	41.6	Very low	154 Å²	154	155 Å²	155	79%	0.79	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-96.2	126	167.6	-58.5	175.7	0	0	0	106.6	R57	R57-I59 PolarHBondContact O-N 2.9Å
60	P	37.5	Very low	40.9	Very low	107 Å²	107	152 Å²	152	70%	0.695	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-67.8	144.7	177.4	-19.4	32.6	0	0	0	112.1
61	P	45.1	Very low	40.4	Very low	134 Å²	134	148.7 Å²	148.7	87%	0.87	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-80.1	118.7	171.9	31.5	-31.4	0	0	0	110.4
62	S	40.4	Very low	39.4	Very low	108 Å²	108	152.1 Å²	152.1	76%	0.755	77%	0.772	S	S	*	*			trans	-129.9	97.4	172.6	61.8	0	0	0	0	111.8
63	H	47.9	Very low	38.7	Very low	145 Å²	145	153.4 Å²	153.4	67%	0.671	78%	0.778	S	S	*	*			trans	59.5	86.7	138.4	-159	-77.3	0	0	0	118.7	E65	H63-E65 VanDerWaalsContact CE1-CG 3.5Å; H63-E65 WeakPolarHBondContact CE1-CG 3.35Å; H63-E65 IonicContact CE1-OE1 3.18Å; H63-E65 PolarHBondContact CE1-OE1 3.26Å
64	L	44.4	Very low	38.1	Very low	170 Å²	170	157 Å²	157	89%	0.89	78%	0.782	S	S	*	*			trans	-130.2	131	139.7	-80.7	-179.7	0	0	0	109
65	E	37	Very low	37.6	Very low	150 Å²	150	154.9 Å²	154.9	70%	0.701	78%	0.784	S	S	*	*			trans	-71.2	152.2	-151.7	-70.2	142.7	142.4	0	0	116.6	H63	H63-E65 VanDerWaalsContact CE1-CG 3.5Å; H63-E65 WeakPolarHBondContact CE1-CG 3.35Å; H63-E65 IonicContact CE1-OE1 3.18Å; H63-E65 PolarHBondContact CE1-OE1 3.26Å
66	M	38.9	Very low	37.2	Very low	174 Å²	174	154.6 Å²	154.6	86%	0.857	78%	0.784	S	S	*	*			trans	-82.3	160.2	156.6	-177	80.2	167	0	0	108.4
67	E	35.3	Very low	36.7	Very low	170 Å²	170	155.9 Å²	155.9	79%	0.794	78%	0.781	S	S	*	*			trans	73.6	131.4	179.8	-43.2	-173.7	104.4	0	0	113
68	Q	36.8	Very low	36.5	Very low	150 Å²	150	150.6 Å²	150.6	70%	0.701	77%	0.77	S	S	*	*			cis	-150.1	138	41.3	-82.1	-173.7	-11	0	0	114.8
69	F	34.2	Very low	36.3	Very low	153 Å²	153	149.2 Å²	149.2	67%	0.671	77%	0.767	S	S	*	*			trans	56.8	151	154	-44.5	-50.2	0	0	0	120
70	C	30.8	Very low	36.1	Very low	122 Å²	122	149.3 Å²	149.3	82%	0.824	76%	0.764	S	S	*	*			cis	-116.9	148.2	-0.3	-54.3	0	0	0	0	109.4
71	S	27.3	Very low	35.7	Very low	98 Å²	98	148 Å²	148	69%	0.685	77%	0.77	S	S	*	*			cis	75.7	71.8	33	-47.7	0	0	0	0	114.4
72	F	29.9	Very low	35.4	Very low	180 Å²	180	149.7 Å²	149.7	79%	0.789	76%	0.764	S	S	*	*			trans	-142.4	106.4	150	-164.9	-97.5	0	0	0	112
73	E	32.5	Very low	35.1	Very low	151 Å²	151	154.7 Å²	154.7	71%	0.706	77%	0.768	S	S	*	*			trans	35.1	119.2	157.8	-52.1	-163.3	146.1	0	0	121.7	T75	E73-T75 PolarHBondContact O-N 3.13Å
74	E	31.5	Very low	34.9	Very low	189 Å²	189	153.1 Å²	153.1	88%	0.883	77%	0.77	S	S	*	*			trans	-92.6	83.1	176.9	-174.6	177.1	-136.7	0	0	111.6
75	T	33.9	Very low	35.1	Very low	129 Å²	129	151.3 Å²	151.3	79%	0.791	77%	0.766	S	S	*	*			trans	-85.3	121.9	172.3	49.6	0	0	0	0	112.1	E73 R77	E73-T75 PolarHBondContact O-N 3.13Å; T75-R77 PolarHBondContact O-N 3.2Å
76	N	36.4	Very low	35.7	Very low	149 Å²	149	150 Å²	150	80%	0.797	77%	0.769	S	S	*	*			trans	-62.1	121	179.1	-79.1	-124.7	0	0	0	112.5
77	R	31.4	Very low	35.9	Very low	208 Å²	208	144.2 Å²	144.2	79%	0.785	75%	0.753	S	S	*	*				170.9	138	123.7	-99.8	176.6	170.3	-83.6	-0.7	116.2	T75	T75-R77 PolarHBondContact O-N 3.2Å
78	D	33.4	Very low	36.5	Very low	117 Å²	117	144.2 Å²	144.2	63%	0.626	76%	0.758	S	S	*	*			trans	63.7	171.4	145.7	-49.8	-34.3	0	0	0	120.2
79	E	34.8	Very low	37	Very low	176 Å²	176	144.3 Å²	144.3	82%	0.822	76%	0.762	S	S	*	*			trans	69.1	75.9	171.2	-55.3	-57.9	84.2	0	0	121.5
80	Q	38.1	Very low	37.3	Very low	156 Å²	156	142 Å²	142	73%	0.729	77%	0.771	S	S	*	*				37.7	99.9	122.1	-158.7	76.7	-7.9	0	0	120.1
81	G	30	Very low	38.3	Very low	79 Å²	79	144.3 Å²	144.3	81%	0.814	77%	0.77	S	S	*	*			trans	-128.3	70.2	176.6	0	0	0	0	0	115.8
82	F	38.5	Very low	39.1	Very low	170 Å²	170	150.4 Å²	150.4	75%	0.746	78%	0.778	S	S	*	*			trans	-72.1	135.2	179.2	-96.5	-114.6	0	0	0	113.3
83	Y	35	Very low	40.4	Very low	213 Å²	213	148.8 Å²	148.8	84%	0.835	78%	0.775	S	S	*	*			trans	-58.6	135.4	158	-95	-99.7	0	0	0	109.7	T85	Y83-T85 PolarHBondContact O-N 3.35Å
84	P	42.8	Very low	41	Very low	112 Å²	112	147 Å²	147	73%	0.727	77%	0.771	S	S	*	*			trans	-71.5	93.6	176.8	28.7	-33.9	0	0	0	110.5	T86	P84-T86 PolarHBondContact O-N 3.28Å; P84-T86 PolarHBondContact O-OG1 2.8Å
85	T	48	Very low	41.9	Very low	132 Å²	132	143.3 Å²	143.3	81%	0.81	76%	0.761	S	S	*	*			trans	-68.1	93.6	167.3	-58.6	0	0	0	0	108.5	Y83 G87	Y83-T85 PolarHBondContact O-N 3.35Å; T85-G87 PolarHBondContact O-N 3.17Å
86	T	50.2	Low	42.3	Very low	123 Å²	123	146.8 Å²	146.8	76%	0.755	76%	0.761	S	S	*	*			trans	-69.1	72.4	-179.3	-50.7	0	0	0	0	111.5	P84	P84-T86 PolarHBondContact O-N 3.28Å; P84-T86 PolarHBondContact O-OG1 2.8Å
87	G	43.6	Very low	42.7	Very low	51 Å²	51	148 Å²	148	53%	0.526	75%	0.754	S	S	.	*			trans	-63.5	132.3	174.4	0	0	0	0	0	110.9	T85 I89	T85-G87 PolarHBondContact O-N 3.17Å; G87-I89 PolarHBondContact O-N 3.1Å
88	L	46.8	Very low	43.2	Very low	170 Å²	170	142 Å²	142	89%	0.89	76%	0.758	S	S	*	*			trans	-73.7	89.7	179.4	-63.7	177.2	0	0	0	110.3	A90	L88-A90 PolarHBondContact O-N 3.02Å
89	I	47.1	Very low	43.4	Very low	153 Å²	153	142.5 Å²	142.5	79%	0.785	76%	0.759	S	S	*	*			trans	-68.1	99.6	176.1	-57.8	176.6	0	0	0	109.1	G87 Q91	G87-I89 PolarHBondContact O-N 3.1Å; I89-Q91 PolarHBondContact O-N 2.74Å
90	A	41	Very low	44.1	Very low	105 Å²	105	145 Å²	145	87%	0.868	76%	0.761	S	S	*	*			trans	-73.3	73.9	177.1	0	0	0	0	0	111.6	L88	L88-A90 PolarHBondContact O-N 3.02Å
91	Q	52	Low	44.6	Very low	170 Å²	170	144.6 Å²	144.6	79%	0.794	76%	0.764	S	S	*	*			trans	-75.1	143.8	-178.7	-148.9	175.6	32.4	0	0	111.9	I89 I93	I89-Q91 PolarHBondContact O-N 2.74Å; Q91-I93 PolarHBondContact O-N 3.25Å
92	R	43.8	Very low	44.9	Very low	226 Å²	226	150.2 Å²	150.2	85%	0.853	76%	0.762	S	S	*	*			trans	-68.2	114.1	-174.7	-168.4	-178.1	-168.4	179.2	4.6	111.2	N94	R92-N94 PolarHBondContact O-N 2.88Å; R92-N94 VanDerWaalsContact O-N 3.12Å
93	I	56.8	Low	45.1	Very low	145 Å²	145	151.3 Å²	151.3	74%	0.744	77%	0.767	S	S	*	*			trans	-66.1	110.2	-177.2	-55.2	175.8	0	0	0	110.8	Q91 V95	Q91-I93 PolarHBondContact O-N 3.25Å; I93-V95 HydrophobicContact CG2-CG2 4.1Å; I93-V95 PolarHBondContact O-N 2.88Å
94	N	46.2	Very low	45.4	Very low	113 Å²	113	146.9 Å²	146.9	60%	0.604	76%	0.764	S	S	*	*			trans	-84.4	103.7	173.1	-73.5	-32	0	0	0	110.3	R92 Y96	R92-N94 PolarHBondContact O-N 2.88Å; R92-N94 VanDerWaalsContact O-N 3.12Å; N94-Y96 HydrophobicContact CB-CE2 4.09Å; N94-Y96 WeakPolarHBondContact O-CD2 3.19Å; N94-Y96 PolarHBondContact O-N 2.67Å
95	V	50.4	Low	45.2	Very low	112 Å²	112	146.7 Å²	146.7	68%	0.679	77%	0.772	S	S	*	*			trans	-84.3	93.2	-179.2	-176.4	0	0	0	0	110.6	I93 R97	I93-V95 HydrophobicContact CG2-CG2 4.1Å; I93-V95 PolarHBondContact O-N 2.88Å; V95-R97 PolarHBondContact O-N 3.37Å
96	Y	41.6	Very low	44.7	Very low	202 Å²	202	143.6 Å²	143.6	79%	0.792	77%	0.766	S	S	*	*			trans	-67.6	124.4	168.9	-64.1	-83.3	0	0	0	110.2	N94 G98	N94-Y96 HydrophobicContact CB-CE2 4.09Å; N94-Y96 WeakPolarHBondContact O-CD2 3.19Å; N94-Y96 PolarHBondContact O-N 2.67Å; Y96-G98 PolarHBondContact O-N 2.79Å
97	R	46.1	Very low	44.2	Very low	175 Å²	175	141.2 Å²	141.2	66%	0.66	77%	0.766	S	S	*	*			trans	-78.9	112.1	168.1	-77	-171.3	170	-150.4	-5.3	108.6	V95 L99	V95-R97 PolarHBondContact O-N 3.37Å; R97-L99 VanDerWaalsContact C-N 3.31Å; R97-L99 PolarHBondContact O-N 2.81Å
98	G	41.3	Very low	44	Very low	83 Å²	83	148.2 Å²	148.2	86%	0.856	79%	0.785	S	S	*	*			trans	-62.6	92.4	165.1	0	0	0	0	0	110.1	Y96	Y96-G98 PolarHBondContact O-N 2.79Å
99	L	37.3	Very low	43.6	Very low	126 Å²	126	146.2 Å²	146.2	66%	0.66	78%	0.78	S	S	*	*			trans	-67.2	142.6	163.9	-136	71.6	0	0	0	107.7	R97 N101 Y102	R97-L99 VanDerWaalsContact C-N 3.31Å; R97-L99 PolarHBondContact O-N 2.81Å; L99-N101 PolarHBondContact O-N 3.24Å; L99-Y102 HydrophobicContact CB-CE2 4.32Å
100	R	49.6	Very low	43.1	Very low	228 Å²	228	145.7 Å²	145.7	86%	0.86	78%	0.784	S	S	*	*	S	Bend	trans	-55.2	143.1	174.3	-88.2	-172.6	173.4	-168.8	-2.1	109.9
101	N	47.9	Very low	43	Very low	148 Å²	148	149 Å²	149	79%	0.791	78%	0.781	S	S	*	*			trans	70.8	84	168.9	-47.8	-10.1	0	0	0	115.1	L99	L99-N101 PolarHBondContact O-N 3.24Å
102	Y	37.4	Very low	42	Very low	197 Å²	197	147.6 Å²	147.6	77%	0.773	79%	0.785	S	S	*	*			trans	-123.3	111	151.5	-76.9	-85.7	0	0	0	109.2	L99	L99-Y102 HydrophobicContact CB-CE2 4.32Å
103	K	42.7	Very low	41.8	Very low	193 Å²	193	146.3 Å²	146.3	84%	0.839	79%	0.788	S	S	*	*			trans	-58.9	139.8	149.8	-76.7	-91.5	-171.3	168.8	0	106.4	A105	K103-A105 PolarHBondContact O-N 3.06Å
104	P	40.3	Very low	40.6	Very low	120 Å²	120	143.1 Å²	143.1	78%	0.779	79%	0.791	S	S	*	*			trans	-60.7	127.9	169.9	26.8	-32.8	0	0	0	108.4	G106	P104-G106 PolarHBondContact O-N 3.28Å
105	A	38.6	Very low	40.2	Very low	109 Å²	109	145.1 Å²	145.1	90%	0.901	80%	0.802	S	S	*	*			trans	-75.3	74.7	170.7	0	0	0	0	0	108.7	K103	K103-A105 PolarHBondContact O-N 3.06Å
106	G	38.2	Very low	39.9	Very low	66 Å²	66	143.3 Å²	143.3	68%	0.68	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-62.2	139.2	168.5	0	0	0	0	0	109.8	P104	P104-G106 PolarHBondContact O-N 3.28Å
107	G	39.5	Very low	39.9	Very low	73 Å²	73	142.8 Å²	142.8	75%	0.753	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-62.5	151.2	168.3	0	0	0	0	0	110.7	T109	G107-T109 PolarHBondContact O-N 3.44Å
108	Q	40.2	Very low	39.7	Very low	198 Å²	198	143.1 Å²	143.1	93%	0.925	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-67.8	117.2	174.2	-66.9	176.1	-0.4	0	0	110.5
109	T	37.6	Very low	39.7	Very low	129 Å²	129	148.3 Å²	148.3	79%	0.791	81%	0.806	S	S	*	*			trans	-151.1	103.4	146.4	44.4	0	0	0	0	110.1	G107	G107-T109 PolarHBondContact O-N 3.44Å
110	V	37.6	Very low	39.8	Very low	141 Å²	141	151.4 Å²	151.4	86%	0.855	82%	0.815	S	S	*	*			trans	49.7	122.8	147.5	-166.4	0	0	0	0	119.3
111	E	37.5	Very low	39.6	Very low	174 Å²	174	146.7 Å²	146.7	81%	0.813	81%	0.811	S	S	*	*			trans	-42.4	137.3	166.3	-53.2	-66	131.2	0	0	115
112	T	31.2	Very low	39.5	Very low	142 Å²	142	144.3 Å²	144.3	87%	0.871	81%	0.806	S	S	*	*			trans	-149.4	135	137.7	-55	0	0	0	0	108.8
113	E	39.4	Very low	40.2	Very low	198 Å²	198	140.4 Å²	140.4	93%	0.925	81%	0.807	S	S	*	*			trans	-81.8	138.8	-174.6	-168.4	170.6	-149.7	0	0	111.5
114	G	32.6	Very low	40.3	Very low	78 Å²	78	136.3 Å²	136.3	80%	0.804	80%	0.798	S	S	*	*			trans	-176.2	128.2	-179.7	0	0	0	0	0	113.7
115	D	37.6	Very low	40.8	Very low	156 Å²	156	137.3 Å²	137.3	83%	0.834	80%	0.796	S	S	*	*			trans	-92.5	156.7	-172.9	-179.4	41.6	0	0	0	114.4
116	S	43.3	Very low	41.3	Very low	73 Å²	73	135.9 Å²	135.9	51%	0.51	77%	0.773	S	S	.	*			trans	89.6	126.6	152.3	85.6	0	0	0	0	120.3
117	K	42.9	Very low	41.3	Very low	191 Å²	191	142.1 Å²	142.1	83%	0.83	78%	0.782	S	S	*	*			trans	85.7	145.6	146.1	-67.5	157	-174.2	165.8	0	120.8
118	E	40.5	Very low	42.1	Very low	182 Å²	182	142.9 Å²	142.9	85%	0.85	79%	0.79	S	S	*	*			trans	47.8	88.5	162.5	-62.4	-166.4	152.3	0	0	118.6	K120	E118-K120 PolarHBondContact O-N 3.29Å
119	H	41.5	Very low	43	Very low	192 Å²	192	139.8 Å²	139.8	89%	0.889	77%	0.773	S	S	*	*			trans	-65.9	81.5	156.4	-139.5	-59.6	0	0	0	109.6	V121	H119-V121 PolarHBondContact O-N 2.95Å
120	K	40.8	Very low	44	Very low	192 Å²	192	140.6 Å²	140.6	84%	0.835	77%	0.772	S	S	*	*			trans	-55.3	101.5	-177.5	-171.2	173.5	-175.3	173.3	0	110.5	E118 S122	E118-K120 PolarHBondContact O-N 3.29Å; K120-S122 PolarHBondContact O-N 2.75Å; K120-S122 VanDerWaalsContact O-N 3.15Å
121	V	45	Very low	45.4	Very low	129 Å²	129	139.1 Å²	139.1	78%	0.782	76%	0.758	S	S	*	*			trans	-61	118.6	179.6	-179.9	0	0	0	0	108	H119 S123	H119-V121 PolarHBondContact O-N 2.95Å; V121-S123 PolarHBondContact O-N 3.14Å
122	S	46.4	Very low	46.8	Very low	98 Å²	98	136.5 Å²	136.5	69%	0.685	75%	0.748	S	S	*	*			trans	-64.6	99.9	-176.3	-173.5	0	0	0	0	110.1	K120 V124	K120-S122 PolarHBondContact O-N 2.75Å; K120-S122 VanDerWaalsContact O-N 3.15Å; S122-V124 PolarHBondContact O-N 2.81Å
123	S	50.7	Low	47.4	Very low	114 Å²	114	139.4 Å²	139.4	80%	0.797	75%	0.745	S	S	*	*			trans	-79.5	23.9	-176.7	56.3	0	0	0	0	113.6	V121 L125	V121-S123 PolarHBondContact O-N 3.14Å; S123-L125 VanDerWaalsContact C-N 3.34Å; S123-L125 PolarHBondContact O-N 3.12Å
124	V	45.5	Very low	48.7	Very low	108 Å²	108	133.8 Å²	133.8	66%	0.655	72%	0.724	S	S	*	*			trans	-78.1	89.2	168.4	-175.7	0	0	0	0	107.7	S122 D126	S122-V124 PolarHBondContact O-N 2.81Å; V124-D126 PolarHBondContact O-N 2.85Å
125	L	49.7	Very low	49.6	Very low	140 Å²	140	135.5 Å²	135.5	73%	0.733	72%	0.724	S	S	*	*			trans	-59.4	136	169.3	-67.4	173.5	0	0	0	109.2	S123 F127	S123-L125 VanDerWaalsContact C-N 3.34Å; S123-L125 PolarHBondContact O-N 3.12Å; L125-F127 VanDerWaalsContact C-N 3.3Å; L125-F127 WeakPolarHBondContact O-CD2 3.4Å; L125-F127 PolarHBondContact O-N 3.06Å
126	D	50.2	Low	49.8	Very low	79 Å²	79	134.9 Å²	134.9	42%	0.422	72%	0.72	S	S	.	*			trans	-74.8	74.7	-167.9	-89.7	-27.9	0	0	0	113.2	V124 G128 K129	V124-D126 PolarHBondContact O-N 2.85Å; D126-G128 PolarHBondContact O-N 2.72Å; D126-K129 HydrophobicContact CB-CB 3.98Å; D126-K129 HydrophobicContact CB-CD 3.77Å; D126-K129 HydrophobicContact CB-CG 3.92Å; D126-K129 PolarHBondContact O-N 2.82Å; D126-K129 WeakPolarHBondContact OD1-CE 3.41Å; D126-K129 IonicContact OD1-NZ 2.85Å; D126-K129 PolarHBondContact OD1-NZ 3.5Å; D126-K129 WeakPolarHBondContact OD2-CD 3.29Å; D126-K129 WeakPolarHBondContact OD2-CE 3.35Å; D126-K129 IonicContact OD2-NZ 3.47Å; D126-K129 PolarHBondContact OD2-NZ 3.06Å
127	F	38.7	Very low	50.7	Low	198 Å²	198	137.2 Å²	137.2	87%	0.868	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.6	125.1	172.2	-73.2	-83.5	0	0	0	110.7	L125	L125-F127 VanDerWaalsContact C-N 3.3Å; L125-F127 WeakPolarHBondContact O-CD2 3.4Å; L125-F127 PolarHBondContact O-N 3.06Å
128	G	55.3	Low	51.1	Low	89 Å²	89	139 Å²	139	92%	0.918	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	86.2	-5	-179.3	0	0	0	0	0	116.2	D126	D126-G128 PolarHBondContact O-N 2.72Å
129	K	60.1	Low	51.9	Low	132 Å²	132	136.3 Å²	136.3	57%	0.574	72%	0.718	S	S	*	*			trans	-98	143.3	174.3	-51.2	-170.9	-153.9	159.9	0	111.9	D126	D126-K129 HydrophobicContact CB-CB 3.98Å; D126-K129 HydrophobicContact CB-CD 3.77Å; D126-K129 HydrophobicContact CB-CG 3.92Å; D126-K129 PolarHBondContact O-N 2.82Å; D126-K129 WeakPolarHBondContact OD1-CE 3.41Å; D126-K129 IonicContact OD1-NZ 2.85Å; D126-K129 PolarHBondContact OD1-NZ 3.5Å; D126-K129 WeakPolarHBondContact OD2-CD 3.29Å; D126-K129 WeakPolarHBondContact OD2-CE 3.35Å; D126-K129 IonicContact OD2-NZ 3.47Å; D126-K129 PolarHBondContact OD2-NZ 3.06Å
130	I	58.7	Low	52.3	Low	147 Å²	147	134.7 Å²	134.7	75%	0.754	71%	0.714	S	S	*	*			trans	-100.1	110.9	176.2	-56.2	176.5	0	0	0	108.7	I132	I130-I132 HydrophobicContact CG2-CD1 4.42Å; I130-I132 HydrophobicContact CG2-CG1 3.93Å
131	I	66.1	Low	52.8	Low	109 Å²	109	134.3 Å²	134.3	56%	0.559	71%	0.707	S	S	*	*			trans	-89	118.2	175.4	-52.4	179.4	0	0	0	109	Y133	I131-Y133 HydrophobicContact CB-CE2 4.24Å; I131-Y133 HydrophobicContact CG2-CD2 3.98Å; I131-Y133 HydrophobicContact CG2-CE1 4.24Å; I131-Y133 HydrophobicContact CG2-CE2 3.44Å; I131-Y133 VanDerWaalsContact CG2-CE2 3.44Å
132	I	66.6	Low	52.8	Low	120 Å²	120	132.2 Å²	132.2	62%	0.615	70%	0.704	S	S	*	*			trans	-107.6	98	-176.6	-56.4	178.1	0	0	0	109.4	I130 T134 L137	I130-I132 HydrophobicContact CG2-CD1 4.42Å; I130-I132 HydrophobicContact CG2-CG1 3.93Å; I132-T134 HydrophobicContact CG2-CG2 3.89Å; I132-L137 HydrophobicContact CG2-CD1 4.31Å
133	Y	44.4	Very low	52.6	Low	203 Å²	203	133.2 Å²	133.2	80%	0.796	71%	0.708	S	S	*	*			trans	-84	110.7	173.4	-65.5	-79	0	0	0	110.7	I131	I131-Y133 HydrophobicContact CB-CE2 4.24Å; I131-Y133 HydrophobicContact CG2-CD2 3.98Å; I131-Y133 HydrophobicContact CG2-CE1 4.24Å; I131-Y133 HydrophobicContact CG2-CE2 3.44Å; I131-Y133 VanDerWaalsContact CG2-CE2 3.44Å
134	T	66.6	Low	52.3	Low	79 Å²	79	136.6 Å²	136.6	49%	0.485	71%	0.711	S	S	.	*			trans	-143.1	129.4	175.1	58	0	0	0	0	111.8	I132 L137	I132-T134 HydrophobicContact CG2-CG2 3.89Å; T134-L137 HydrophobicContact CG2-CD1 3.75Å; T134-L137 HydrophobicContact CG2-CG 3.85Å; T134-L137 WeakPolarHBondContact OG1-CB 3.29Å; T134-L137 WeakPolarHBondContact OG1-CD1 3.47Å; T134-L137 VanDerWaalsContact OG1-CG 3.31Å; T134-L137 WeakPolarHBondContact OG1-CG 3.48Å
135	S	50.7	Low	52.2	Low	115 Å²	115	143 Å²	143	80%	0.804	72%	0.724	S	S	*	*	S	Bend	trans	-71.8	-27.7	171.2	47.5	0	0	0	0	113.6
136	N	42.3	Very low	51.9	Low	142 Å²	142	145 Å²	145	76%	0.759	73%	0.726	S	S	*	*	S	Bend	trans	-119.2	3.6	-162.8	-71.5	-36.3	0	0	0	115.9	R138	N136-R138 PolarHBondContact O-N 3.49Å
137	L	61.8	Low	51.7	Low	123 Å²	123	147.2 Å²	147.2	64%	0.644	75%	0.745	S	S	*	*			trans	-75.5	113.7	172.9	-71	-176.3	0	0	0	111.1	I132 T134	I132-L137 HydrophobicContact CG2-CD1 4.31Å; T134-L137 HydrophobicContact CG2-CD1 3.75Å; T134-L137 HydrophobicContact CG2-CG 3.85Å; T134-L137 WeakPolarHBondContact OG1-CB 3.29Å; T134-L137 WeakPolarHBondContact OG1-CD1 3.47Å; T134-L137 VanDerWaalsContact OG1-CG 3.31Å; T134-L137 WeakPolarHBondContact OG1-CG 3.48Å
138	R	52.3	Low	51.6	Low	229 Å²	229	147 Å²	147	86%	0.864	75%	0.747	S	S	*	*			trans	-79.5	124.8	164.6	-65.4	-177.2	177.9	-172.5	-1.2	108.7	N136 I140	N136-R138 PolarHBondContact O-N 3.49Å; R138-I140 PolarHBondContact O-N 3.29Å
139	I	57.1	Low	50.9	Low	124 Å²	124	151.8 Å²	151.8	64%	0.636	75%	0.748	S	S	*	*			trans	-69	93.9	175.8	-56.3	175.1	0	0	0	109	R141	I139-R141 PolarHBondContact O-N 3.32Å; I139-R141 VanDerWaalsContact O-N 3.07Å
140	I	50.5	Low	49.9	Very low	158 Å²	158	150.9 Å²	150.9	81%	0.81	75%	0.753	S	S	*	*			trans	-72.1	99.9	170.2	-56.8	179.3	0	0	0	107.3	R138 A142	R138-I140 PolarHBondContact O-N 3.29Å; I140-A142 PolarHBondContact O-N 3.24Å
141	R	49.6	Very low	48.8	Very low	184 Å²	184	154 Å²	154	69%	0.694	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-63.9	127	167.6	-70.9	175.2	170.9	150.4	-8.4	108.1	I139	I139-R141 PolarHBondContact O-N 3.32Å; I139-R141 VanDerWaalsContact O-N 3.07Å
142	A	45.9	Very low	47.2	Very low	85 Å²	85	155.5 Å²	155.5	70%	0.702	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-57.1	130.7	163.7	0	0	0	0	0	108.4	I140 Q144	I140-A142 PolarHBondContact O-N 3.24Å; A142-Q144 PolarHBondContact O-N 3.23Å
143	P	41.9	Very low	45.4	Very low	120 Å²	120	157.5 Å²	157.5	78%	0.779	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-61.3	138.5	176.7	26	-33.4	0	0	0	109.1	R145	P143-R145 PolarHBondContact O-N 2.92Å; P143-R145 VanDerWaalsContact O-N 3.14Å
144	Q	44.1	Very low	44.5	Very low	184 Å²	184	153.5 Å²	153.5	86%	0.86	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-64.2	119	178.1	-73.4	-173.5	-18.1	0	0	109.4	A142 K146	A142-Q144 PolarHBondContact O-N 3.23Å; Q144-K146 VanDerWaalsContact C-N 3.32Å; Q144-K146 PolarHBondContact O-N 2.85Å
145	R	44.4	Very low	42.8	Very low	244 Å²	244	156.3 Å²	156.3	92%	0.921	79%	0.785	S	S	*	*			trans	-61.4	96.5	163.1	-74.3	-77.8	-174.4	107.6	-1.4	107.4	P143	P143-R145 PolarHBondContact O-N 2.92Å; P143-R145 VanDerWaalsContact O-N 3.14Å
146	K	43	Very low	42.6	Very low	181 Å²	181	155.2 Å²	155.2	79%	0.787	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-62.2	134.8	158.5	-66.3	-175.4	178	-176.3	0	106.8	Q144 E148	Q144-K146 VanDerWaalsContact C-N 3.32Å; Q144-K146 PolarHBondContact O-N 2.85Å; K146-E148 PolarHBondContact O-N 3.44Å
147	P	45.6	Very low	42.4	Very low	125 Å²	125	153.2 Å²	153.2	81%	0.812	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-61.2	133.2	167.2	27.1	-32.6	0	0	0	108.3	M149	P147-M149 PolarHBondContact O-N 2.8Å
148	E	37.1	Very low	41	Very low	195 Å²	195	153 Å²	153	91%	0.911	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-74.2	125.3	-177.3	-65.3	173.5	143.3	0	0	109.6	K146	K146-E148 PolarHBondContact O-N 3.44Å
149	M	39.7	Very low	39.9	Very low	189 Å²	189	145.9 Å²	145.9	93%	0.931	75%	0.748	S	S	*	*			trans	-109.7	146.3	162.6	-164.4	149.5	72.3	0	0	109.5	P147	P147-M149 PolarHBondContact O-N 2.8Å
150	T	39.1	Very low	38.8	Very low	113 Å²	113	144.8 Å²	144.8	69%	0.693	74%	0.743	S	S	*	*			trans	-92	161.4	-150.4	-22.2	0	0	0	0	113.6
151	R	35.7	Very low	37.9	Very low	212 Å²	212	144.1 Å²	144.1	80%	0.8	74%	0.736	S	S	*	*			trans	76.7	150.7	162.3	-57.9	168	-170.1	173.1	2.4	115.3
152	Q	33.3	Very low	36.8	Very low	141 Å²	141	138.7 Å²	138.7	66%	0.659	74%	0.738	S	S	*	*			cis	-167.4	164.4	-13.2	-116.3	164.9	-39.1	0	0	110.9
153	H	29.1	Very low	36.2	Very low	161 Å²	161	140.6 Å²	140.6	75%	0.745	74%	0.744	S	S	*	*			trans	73.5	152	154.2	-64.2	-54.4	0	0	0	123.6
154	S	25.9	Very low	36.3	Very low	120 Å²	120	140.4 Å²	140.4	84%	0.839	74%	0.743	S	S	*	*			trans	88.9	160.9	161.8	75.2	0	0	0	0	120.1
155	V	29.6	Very low	35.5	Very low	138 Å²	138	141.1 Å²	141.1	84%	0.836	74%	0.743	S	S	*	*			trans	-146.7	153.7	-146.1	162.6	0	0	0	0	109.6
156	P	46.4	Very low	34.7	Very low	91 Å²	91	133.7 Å²	133.7	59%	0.591	73%	0.734	S	S	*	*			trans	-97.8	-179.6	-157.7	42.3	-38.9	0	0	0	114.5	E2	E2-P156 WeakPolarHBondContact OE1-CB 3.39Å
157	P	39	Very low	34.1	Very low	101 Å²	101	136 Å²	136	66%	0.656	74%	0.738	S	S	*	*				-156.4	-163.4	93.1	45.4	-26	0	0	0	114.4	E2	E2-P157 VanDerWaalsContact CD-C 3.4Å; E2-P157 WeakPolarHBondContact OE1-CA 3.43Å
158	L	31.5	Very low	33.2	Very low	117 Å²	117	135.5 Å²	135.5	61%	0.613	73%	0.729	S	S	*	*			cis	-148.2	154.7	2.9	-90.4	-178.4	0	0	0	112.2	M1 E2	M1-L158 CarbonylContact C-O 3.55Å; M1-L158 PolarHBondContact N-O 3.15Å; E2-L158 VanDerWaalsContact CD-N 3.32Å; E2-L158 VanDerWaalsContact CG-C 3.46Å; E2-L158 VanDerWaalsContact OE2-CA 3.24Å; E2-L158 WeakPolarHBondContact OE2-CA 3.31Å; E2-L158 PolarHBondContact OE2-N 2.91Å
159	D	28.7	Very low	33	Very low	81 Å²	81	134.2 Å²	134.2	43%	0.433	72%	0.72	S	S	.	*			trans	92.5	151.1	131.6	-108.7	-21.1	0	0	0	130.4	M1 E2	M1-D159 CarbonylContact C-O 3.57Å; M1-D159 WeakPolarHBondContact CA-O 3.36Å; M1-D159 PolarHBondContact N-O 3.39Å; E2-D159 PolarHBondContact N-O 3.42Å
160	L	35.6	Very low	32.5	Very low	100 Å²	100	131.1 Å²	131.1	52%	0.524	70%	0.703	S	S	.	*			trans	52.5	111.2	144.2	-113.4	64.2	0	0	0	125.7
161	E	30.2	Very low	32.3	Very low	145 Å²	145	129.9 Å²	129.9	68%	0.678	70%	0.699	S	S	*	*				43	156.8	115.7	-54	-163.7	104.6	0	0	125.7	E3	E3-E161 WeakPolarHBondContact OE2-CG 3.34Å; E3-E161 PolarHBondContact OE2-N 2.89Å
162	G	27.3	Very low	32.3	Very low	70 Å²	70	129.5 Å²	129.5	72%	0.722	70%	0.698	S	S	*	*			trans	153.6	103.8	155.5	0	0	0	0	0	115.8
163	C	33.3	Very low	32.4	Very low	125 Å²	125	132 Å²	132	85%	0.845	71%	0.707	S	S	*	*			trans	-162.3	121.2	175.3	-176.6	0	0	0	0	116.1
164	P	42.8	Very low	32.5	Very low	116 Å²	116	136.4 Å²	136.4	75%	0.753	72%	0.717	S	S	*	*			trans	-141	168.7	153.6	32.6	-14.5	0	0	0	114.7
165	K	29	Very low	32.6	Very low	198 Å²	198	135 Å²	135	86%	0.861	71%	0.712	S	S	*	*			cis	-169.7	-171.9	-16.3	-91.4	-90.5	179.7	176	0	107.6
166	A	27	Very low	32.7	Very low	89 Å²	89	138.2 Å²	138.2	74%	0.736	72%	0.715	S	S	*	*			trans	76.5	132.3	178.1	0	0	0	0	0	115.6
167	R	29.7	Very low	31.9	Very low	229 Å²	229	138.6 Å²	138.6	86%	0.864	73%	0.726	S	S	*	*			cis	82.7	142.8	42.4	-69.6	-171.6	179.9	-155.4	5.4	112.9
168	D	27.5	Very low	31.5	Very low	115 Å²	115	141.5 Å²	141.5	62%	0.615	74%	0.735	S	S	*	*			cis	-148.9	-167.2	20.4	-138	-60.1	0	0	0	114.8
169	K	33.3	Very low	31.2	Very low	167 Å²	167	144.7 Å²	144.7	73%	0.726	74%	0.744	S	S	*	*			trans	-33.3	146.1	178.4	-80.5	158	-171.4	174.4	0	120.9
170	E	27.6	Very low	31.2	Very low	124 Å²	124	144.4 Å²	144.4	58%	0.579	75%	0.753	S	S	*	*				69.1	123.9	82.7	-140.7	-152.5	146.9	0	0	113.6	R172	E170-R172 IonicContact OE1-CZ 2.67Å; E170-R172 IonicContact OE1-NE 2.79Å; E170-R172 PolarHBondContact OE1-NE 3.42Å; E170-R172 IonicContact OE1-NH2 2.67Å; E170-R172 PolarHBondContact OE1-NH2 3.03Å
171	S	36	Very low	30.9	Very low	87 Å²	87	145.5 Å²	145.5	61%	0.608	76%	0.755	S	S	*	*				175.6	146.2	75.6	-65.2	0	0	0	0	115.8
172	R	35.8	Very low	30.7	Very low	204 Å²	204	146 Å²	146	77%	0.77	76%	0.758	S	S	*	*			trans	39	142.2	130.3	-45.4	172	-159.8	-150.8	4.1	119.8	E170	E170-R172 IonicContact OE1-CZ 2.67Å; E170-R172 IonicContact OE1-NE 2.79Å; E170-R172 PolarHBondContact OE1-NE 3.42Å; E170-R172 IonicContact OE1-NH2 2.67Å; E170-R172 PolarHBondContact OE1-NH2 3.03Å
173	K	35.1	Very low	30.7	Very low	195 Å²	195	149.7 Å²	149.7	85%	0.848	76%	0.761	S	S	*	*				-162.6	153.1	59.3	-68.2	164.8	-171.9	172.8	0	109.2
174	R	31.2	Very low	30.4	Very low	252 Å²	252	149.4 Å²	149.4	95%	0.951	76%	0.755	S	S	*	*				52.5	141.2	69.5	-74.1	-169.6	-179.2	-171	1.9	114.8
175	A	28.9	Very low	29.8	Very low	91 Å²	91	152.5 Å²	152.5	75%	0.752	76%	0.759	S	S	*	*			cis	-147.8	157.1	9.7	0	0	0	0	0	110.3
176	K	31.1	Very low	29.9	Very low	206 Å²	206	153.1 Å²	153.1	90%	0.896	76%	0.762	S	S	*	*				67.1	115.3	68.3	-123.1	-165.8	-171.7	-165.1	0	116.7
177	A	28.9	Very low	29.9	Very low	99 Å²	99	157.5 Å²	157.5	82%	0.818	77%	0.767	S	S	*	*			trans	-156.1	169.1	165.9	0	0	0	0	0	111
178	L	30.2	Very low	29.9	Very low	161 Å²	161	154 Å²	154	84%	0.843	76%	0.76	S	S	*	*			trans	-155.4	159.7	-168.9	-85.3	171	0	0	0	114.5
179	K	26.4	Very low	29.9	Very low	185 Å²	185	155.1 Å²	155.1	80%	0.804	77%	0.767	S	S	*	*			trans	69.5	159.9	169.2	-66.9	-164.3	169.9	-154.8	0	116.1
180	A	27.8	Very low	29.6	Very low	75 Å²	75	150.3 Å²	150.3	62%	0.62	76%	0.764	S	S	*	*			cis	-147.8	163.7	9.1	0	0	0	0	0	112.8
181	Q	28.9	Very low	29.9	Very low	123 Å²	123	151.7 Å²	151.7	58%	0.575	77%	0.774	S	S	*	*				29.8	146.7	111.6	-56.4	170.1	-111.9	0	0	118.7
182	E	26.4	Very low	29.8	Very low	156 Å²	156	155.2 Å²	155.2	73%	0.729	78%	0.781	S	S	*	*			cis	-175.1	163.5	3.5	-102.5	146.8	-162.8	0	0	106.5
183	D	27.1	Very low	29.6	Very low	147 Å²	147	150.8 Å²	150.8	79%	0.786	77%	0.772	S	S	*	*			cis	-173.4	-174.2	-17.7	-165.9	13.9	0	0	0	110.8
184	V	28.5	Very low	29.5	Very low	119 Å²	119	151.3 Å²	151.3	72%	0.721	78%	0.775	S	S	*	*			trans	92.6	139.1	159.4	176.5	0	0	0	0	122.4
185	E	28.7	Very low	29.7	Very low	181 Å²	181	145.3 Å²	145.3	85%	0.846	76%	0.762	S	S	*	*			trans	-54.1	168.4	-179.9	-52.1	163.3	148.7	0	0	119.2
186	K	31.9	Very low	30.2	Very low	210 Å²	210	148.2 Å²	148.2	91%	0.913	77%	0.77	S	S	*	*			trans	-157.4	138.7	147.3	-137.6	174.8	-175	-178.4	0	114.9
187	E	26.7	Very low	30.3	Very low	182 Å²	182	146.8 Å²	146.8	85%	0.85	76%	0.764	S	S	*	*			trans	-107.1	-178.8	175.7	-92.9	-162.3	125.9	0	0	113.5
188	E	29.5	Very low	30.5	Very low	154 Å²	154	148.1 Å²	148.1	72%	0.72	76%	0.762	S	S	*	*			trans	78	100.4	156.6	-70.3	-122.6	87.9	0	0	121.2
189	N	27.9	Very low	30.8	Very low	140 Å²	140	147.6 Å²	147.6	75%	0.749	76%	0.757	S	S	*	*				60.8	143.9	101.1	-62.1	-26.9	0	0	0	123.1
190	G	27.9	Very low	31	Very low	65 Å²	65	146.6 Å²	146.6	67%	0.67	76%	0.757	S	S	*	*			trans	144.8	84.8	176.9	0	0	0	0	0	109.9
191	I	32.9	Very low	32	Very low	154 Å²	154	152.8 Å²	152.8	79%	0.79	77%	0.772	S	S	*	*				59.3	118.7	73.4	-51.4	174.7	0	0	0	109.2
192	E	33.5	Very low	32.2	Very low	160 Å²	160	149.5 Å²	149.5	75%	0.748	77%	0.772	S	S	*	*			cis	-150.8	142.4	46.9	-158.4	172.8	172.8	0	0	117.6
193	N	31.8	Very low	33.2	Very low	111 Å²	111	151.6 Å²	151.6	59%	0.594	78%	0.782	S	S	*	*			trans	15.1	137.6	152	-49.2	-33.7	0	0	0	123
194	K	34.4	Very low	33.7	Very low	207 Å²	207	150.7 Å²	150.7	90%	0.9	78%	0.781	S	S	*	*				-152.4	146.4	109.2	-110.5	162.6	-170.5	169.6	0	112.8
195	D	35.3	Very low	34.4	Very low	126 Å²	126	151 Å²	151	67%	0.674	78%	0.777	S	S	*	*			trans	-88.6	148.7	-156.5	-55.8	-102.6	0	0	0	116
196	T	37.6	Very low	35.3	Very low	151 Å²	151	149.7 Å²	149.7	93%	0.926	78%	0.775	S	S	*	*				-156	99.5	128.3	-3.7	0	0	0	0	110.1
197	K	34.8	Very low	35.7	Very low	176 Å²	176	145.9 Å²	145.9	77%	0.765	77%	0.765	S	S	*	*			trans	-97.1	114.6	-174.1	174.8	-173.8	175.6	179.5	0	111.7
198	V	31.9	Very low	36.6	Very low	128 Å²	128	141.9 Å²	141.9	78%	0.776	76%	0.757	S	S	*	*			trans	-137.5	112.3	147.5	-165.4	0	0	0	0	108.7
199	M	37.4	Very low	37.5	Very low	149 Å²	149	139.9 Å²	139.9	73%	0.734	76%	0.755	S	S	*	*			trans	-83.3	130.3	168.2	-68.3	170.1	64.3	0	0	108.9
200	M	31.4	Very low	38.7	Very low	165 Å²	165	142.3 Å²	142.3	81%	0.813	76%	0.762	S	S	*	*			trans	-138.9	107.4	157.7	-76.6	-62	172.7	0	0	109.3	G202	M200-G202 PolarHBondContact O-N 3.11Å
201	H	47.4	Very low	40	Very low	204 Å²	204	142.4 Å²	142.4	94%	0.944	76%	0.757	S	S	*	*			trans	-70.6	88.1	155.4	-102.2	-90.5	0	0	0	106.9
202	G	34.1	Very low	41.6	Very low	55 Å²	55	143 Å²	143	57%	0.567	76%	0.761	S	S	*	*			trans	-126.1	101.9	-170.4	0	0	0	0	0	112.6	M200 V204	M200-G202 PolarHBondContact O-N 3.11Å; G202-V204 PolarHBondContact O-N 3.43Å; G202-V204 VanDerWaalsContact O-N 3.12Å
203	Q	47.4	Very low	43.8	Very low	200 Å²	200	139.1 Å²	139.1	94%	0.935	75%	0.752	S	S	*	*			trans	-68.9	95.4	164.6	174	-165.8	0.5	0	0	109.3
204	V	36.8	Very low	46.3	Very low	128 Å²	128	135 Å²	135	78%	0.776	73%	0.731	S	S	*	*			trans	-172.2	130.6	-179.3	118.9	0	0	0	0	107.5	G202	G202-V204 PolarHBondContact O-N 3.43Å; G202-V204 VanDerWaalsContact O-N 3.12Å
205	I	42.9	Very low	48.8	Very low	124 Å²	124	134.1 Å²	134.1	64%	0.636	73%	0.731	S	S	*	*			cis	-130.7	151.9	-6.6	-76.4	174.6	0	0	0	109.1	N207	I205-N207 VanDerWaalsContact C-N 3.26Å; I205-N207 WeakPolarHBondContact CG2-OD1 3.3Å; I205-N207 PolarHBondContact O-N 3.35Å
206	L	47.8	Very low	50.8	Low	154 Å²	154	134.8 Å²	134.8	81%	0.806	73%	0.73	S	S	*	*			trans	-70.1	84.4	164.2	-149.1	170	0	0	0	107.9	S208	L206-S208 PolarHBondContact O-N 2.78Å
207	N	40.8	Very low	53.2	Low	131 Å²	131	128.4 Å²	128.4	70%	0.701	69%	0.691	S	S	*	*			trans	-71.1	76.7	-177.9	-87.2	7	0	0	0	110.6	I205 V209	I205-N207 VanDerWaalsContact C-N 3.26Å; I205-N207 WeakPolarHBondContact CG2-OD1 3.3Å; I205-N207 PolarHBondContact O-N 3.35Å; N207-V209 PolarHBondContact O-N 3.11Å
208	S	45.1	Very low	55.5	Low	97 Å²	97	123.1 Å²	123.1	68%	0.678	69%	0.686	S	S	*	*			trans	-68.2	67.6	163.4	57.3	0	0	0	0	109.9	L206 E210	L206-S208 PolarHBondContact O-N 2.78Å; S208-E210 PolarHBondContact O-N 3.08Å
209	V	48	Very low	58	Low	113 Å²	113	119.3 Å²	119.3	69%	0.685	67%	0.673	S	S	*	*			trans	-72	105.2	151.1	-176.1	0	0	0	0	104.8	N207 A211	N207-V209 PolarHBondContact O-N 3.11Å; V209-A211 HydrophobicContact CG1-CB 4.04Å; V209-A211 PolarHBondContact O-N 3.47Å
210	E	53.2	Low	60.3	Low	191 Å²	191	116.1 Å²	116.1	89%	0.893	67%	0.665	S	S	*	*			trans	-72.7	55.8	170.6	-65.8	179.9	124.8	0	0	110.1	S208	S208-E210 PolarHBondContact O-N 3.08Å
211	A	56.5	Low	62.9	Low	67 Å²	67	109.7 Å²	109.7	55%	0.554	64%	0.641	S	S	*	*	S	Bend	trans	-78.7	131.1	156.9	0	0	0	0	0	106.8	V209 S213	V209-A211 HydrophobicContact CG1-CB 4.04Å; V209-A211 PolarHBondContact O-N 3.47Å; A211-S213 PolarHBondContact O-N 2.71Å
212	D	66.6	Low	64.9	Low	165 Å²	165	102.5 Å²	102.5	88%	0.882	61%	0.613	S	S	*	*			trans	-48.4	94.1	-170	-69.8	-74.9	0	0	0	113.2	C214	D212-C214 PolarHBondContact O-N 3.08Å
213	S	79.3	Confident	67.6	Low	80 Å²	80	100.8 Å²	100.8	56%	0.559	59%	0.593	S	S	*	*			trans	-66.6	109.6	-176.2	67.2	0	0	0	0	108.2	A211 Q215	A211-S213 PolarHBondContact O-N 2.71Å; S213-Q215 PolarHBondContact O-N 3.17Å
214	C	84	Confident	69.5	Low	23 Å²	23	95.3 Å²	95.3	16%	0.155	58%	0.576	C	S	.	*			trans	-50.2	116	-167.4	168	0	0	0	0	111.3	D212 H216 C217 G218 C263	D212-C214 PolarHBondContact O-N 3.08Å; C214-H216 PolarHBondContact O-N 3.11Å; C214-C217 PolarHBondContact O-N 2.62Å; C214-G218 PolarHBondContact O-N 2.86Å; C214-C263 WeakPolarHBondContact CB-SG 3.36Å; C214-C263 PolarHBondContact SG-SG 3.17Å
215	Q	85.7	Confident	72	Confident	189 Å²	189	89.3 Å²	89.3	88%	0.883	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-15.7	-170.4	-62.7	-174.7	-0	0	0	113.3	S213	S213-Q215 PolarHBondContact O-N 3.17Å
216	H	78.6	Confident	74.1	Confident	141 Å²	141	86.5 Å²	86.5	65%	0.653	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-14.8	178.8	-65.2	17.9	0	0	0	113.8	C214 S262	C214-H216 PolarHBondContact O-N 3.11Å; H216-S262 PolarHBondContact CD2-OG 3.29Å
217	C	87.3	Confident	75.8	Confident	17 Å²	17	83.5 Å²	83.5	12%	0.115	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.3	2.5	176.9	69.5	0	0	0	0	115	C214 G219 S220 G221 C222 C260 C263	C214-C217 PolarHBondContact O-N 2.62Å; C217-G219 PolarHBondContact O-N 2.84Å; C217-S220 WeakPolarHBondContact O-CB 3.24Å; C217-S220 PolarHBondContact O-N 3.33Å; C217-S220 VanDerWaalsContact O-N 3.08Å; C217-S220 PolarHBondContact O-OG 2.97Å; C217-G221 PolarHBondContact SG-N 3.28Å; C217-G221 VanDerWaalsContact SG-N 3.36Å; C217-C222 VanDerWaalsContact CB-O 3.23Å; C217-C222 WeakPolarHBondContact CB-O 3.23Å; C217-C260 HydrophobicContact CB-CB 3.73Å; C217-C263 VanDerWaalsContact SG-SG 3.64Å
218	G	84.3	Confident	77.9	Confident	64 Å²	64	77.3 Å²	77.3	66%	0.66	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	32.3	-177.2	0	0	0	0	0	113.2	C214 S220	C214-G218 PolarHBondContact O-N 2.86Å; G218-S220 VanDerWaalsContact C-N 3.27Å; G218-S220 PolarHBondContact O-N 3.27Å
219	G	84.1	Confident	79.9	Confident	49 Å²	49	80.1 Å²	80.1	51%	0.505	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	-1.3	-174.9	0	0	0	0	0	116	C217 G221	C217-G219 PolarHBondContact O-N 2.84Å; G219-G221 VanDerWaalsContact C-N 3.28Å; G219-G221 PolarHBondContact O-N 3.48Å
220	S	85.5	Confident	81.6	Confident	82 Å²	82	76.2 Å²	76.2	57%	0.573	47%	0.466	S	S	*	.	S	Bend	trans	-73.9	-10.6	-177.7	67.8	0	0	0	0	115.4	C217 G218 C222	C217-S220 WeakPolarHBondContact O-CB 3.24Å; C217-S220 PolarHBondContact O-N 3.33Å; C217-S220 VanDerWaalsContact O-N 3.08Å; C217-S220 PolarHBondContact O-OG 2.97Å; G218-S220 VanDerWaalsContact C-N 3.27Å; G218-S220 PolarHBondContact O-N 3.27Å; S220-C222 PolarHBondContact O-N 3.37Å; S220-C222 VanDerWaalsContact O-N 3.07Å; S220-C222 PolarHBondContact OG-O 3.23Å
221	G	86.6	Confident	83	Confident	29 Å²	29	69.8 Å²	69.8	30%	0.299	44%	0.443	S	S	.	.	S	Bend	trans	71.4	-9.2	-177	0	0	0	0	0	115.4	C217 G219 C260	C217-G221 PolarHBondContact SG-N 3.28Å; C217-G221 VanDerWaalsContact SG-N 3.36Å; G219-G221 VanDerWaalsContact C-N 3.28Å; G219-G221 PolarHBondContact O-N 3.48Å; G221-C260 PolarHBondContact O-N 3.3Å
222	C	88.8	Confident	84.4	Confident	53 Å²	53	70.5 Å²	70.5	36%	0.358	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	151.4	-176	-70.2	0	0	0	0	111.8	C217 S220 L257 E258	C217-C222 VanDerWaalsContact CB-O 3.23Å; C217-C222 WeakPolarHBondContact CB-O 3.23Å; S220-C222 PolarHBondContact O-N 3.37Å; S220-C222 VanDerWaalsContact O-N 3.07Å; S220-C222 PolarHBondContact OG-O 3.23Å; C222-L257 HydrophobicContact CB-CB 4.37Å; C222-L257 HydrophobicContact CB-CD1 4.1Å; C222-E258 CarbonylContact C-O 3.56Å; C222-E258 WeakPolarHBondContact CA-O 3.23Å
223	A	89.4	Confident	85.1	Confident	19 Å²	19	65.4 Å²	65.4	16%	0.157	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	153.9	176	0	0	0	0	0	110	C225 L257 E258 C260	A223-C225 PolarHBondContact O-N 2.68Å; A223-L257 CarbonylContact O-C 3.56Å; A223-L257 VanDerWaalsContact O-CA 3.23Å; A223-L257 WeakPolarHBondContact O-CA 3.41Å; A223-E258 PolarHBondContact N-O 3.31Å; A223-E258 PolarHBondContact O-N 3.36Å; A223-C260 HydrophobicContact CB-CB 4.49Å
224	P	89.3	Confident	84.9	Confident	86 Å²	86	62.4 Å²	62.4	56%	0.558	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.2	130.3	169.6	27.3	-34.2	0	0	0	109.6	S226	P224-S226 PolarHBondContact O-N 3.46Å
225	C	88.9	Confident	83.9	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.007	41%	0.407	C	S	.	.			trans	-60.2	134.6	-169.8	168.1	0	0	0	0	113.1	A223 L227 C228 H229 C252 G256 E258	A223-C225 PolarHBondContact O-N 2.68Å; C225-L227 PolarHBondContact O-N 3.1Å; C225-L227 VanDerWaalsContact O-N 3.16Å; C225-L227 PolarHBondContact SG-N 2.77Å; C225-L227 VanDerWaalsContact SG-N 3.4Å; C225-C228 PolarHBondContact O-N 3.33Å; C225-H229 VanDerWaalsContact O-CA 3.23Å; C225-H229 WeakPolarHBondContact O-CA 3.46Å; C225-H229 PolarHBondContact O-N 2.97Å; C225-C252 HydrophobicContact CB-CB 3.39Å; C225-G256 WeakPolarHBondContact CB-O 3.43Å; C225-G256 PolarHBondContact N-O 2.85Å; C225-E258 VanDerWaalsContact CA-OE2 3.23Å; C225-E258 WeakPolarHBondContact CA-OE2 3.04Å; C225-E258 HydrophobicContact CB-CB 4.25Å; C225-E258 HydrophobicContact CB-CG 4.35Å; C225-E258 PolarHBondContact SG-OE2 2.88Å
226	S	85.8	Confident	82.6	Confident	66 Å²	66	64 Å²	64	46%	0.462	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-34.8	177.2	53.9	0	0	0	0	114.8	P224 H229 E258	P224-S226 PolarHBondContact O-N 3.46Å; S226-H229 PolarHBondContact O-CE1 3.16Å; S226-H229 PolarHBondContact O-ND1 3.4Å; S226-E258 WeakPolarHBondContact CB-OE2 3.49Å; S226-E258 PolarHBondContact N-OE2 2.83Å; S226-E258 PolarHBondContact OG-OE1 3.29Å; S226-E258 PolarHBondContact OG-OE2 2.74Å
227	L	84.2	Confident	81.5	Confident	90 Å²	90	58 Å²	58	47%	0.471	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-24.8	-177.4	-57.5	-172.9	0	0	0	114.8	C225 A251	C225-L227 PolarHBondContact O-N 3.1Å; C225-L227 VanDerWaalsContact O-N 3.16Å; C225-L227 PolarHBondContact SG-N 2.77Å; C225-L227 VanDerWaalsContact SG-N 3.4Å; L227-A251 HydrophobicContact CD1-CB 3.82Å
228	C	84.5	Confident	79.9	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.014	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118	-9.7	-175	78.9	0	0	0	0	113.7	C225 G230 S231 C249 C252	C225-C228 PolarHBondContact O-N 3.33Å; C228-G230 PolarHBondContact O-N 3.14Å; C228-G230 VanDerWaalsContact O-N 3.17Å; C228-S231 VanDerWaalsContact O-CB 3.24Å; C228-S231 WeakPolarHBondContact O-CB 3.43Å; C228-S231 PolarHBondContact O-N 3.38Å; C228-S231 PolarHBondContact O-OG 3.23Å; C228-C249 HydrophobicContact CB-CB 3.65Å; C228-C252 HydrophobicContact CB-CB 4.38Å; C228-C252 WeakPolarHBondContact CB-SG 3.48Å; C228-C252 WeakPolarHBondContact SG-CB 3.23Å; C228-C252 CovalentContact SG-SG 2.06Å; C228-C252 PolarHBondContact SG-SG 3.14Å
229	H	86.9	Confident	78.6	Confident	156 Å²	156	67.6 Å²	67.6	72%	0.722	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.3	39	-174.3	-51.9	-41.7	0	0	0	113.3	C225 S226 S231	C225-H229 VanDerWaalsContact O-CA 3.23Å; C225-H229 WeakPolarHBondContact O-CA 3.46Å; C225-H229 PolarHBondContact O-N 2.97Å; S226-H229 PolarHBondContact O-CE1 3.16Å; S226-H229 PolarHBondContact O-ND1 3.4Å; H229-S231 PolarHBondContact O-N 3.37Å
230	G	84.3	Confident	76.8	Confident	30 Å²	30	72.5 Å²	72.5	31%	0.309	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.1	-10.5	-175.3	0	0	0	0	0	115.9	C228 K232 G256	C228-G230 PolarHBondContact O-N 3.14Å; C228-G230 VanDerWaalsContact O-N 3.17Å; G230-K232 WeakPolarHBondContact O-CG 3.13Å; G230-K232 PolarHBondContact O-N 2.86Å; G230-K232 VanDerWaalsContact O-N 3.16Å; G230-G256 WeakPolarHBondContact CA-O 3.41Å
231	S	82.3	Confident	75.2	Confident	57 Å²	57	75 Å²	75	40%	0.399	41%	0.405	S	S	.	.			trans	-66.1	-16.3	-177.8	69.9	0	0	0	0	114.9	C228 H229 L233	C228-S231 VanDerWaalsContact O-CB 3.24Å; C228-S231 WeakPolarHBondContact O-CB 3.43Å; C228-S231 PolarHBondContact O-N 3.38Å; C228-S231 PolarHBondContact O-OG 3.23Å; H229-S231 PolarHBondContact O-N 3.37Å; S231-L233 PolarHBondContact O-N 2.84Å; S231-L233 PolarHBondContact OG-N 2.06Å
232	K	86.2	Confident	73.7	Confident	81 Å²	81	82.3 Å²	82.3	35%	0.352	43%	0.431	S	S	.	.			trans	63.5	-6.4	-175.4	-46.2	-172.5	176.6	-149.1	0	115.4	G230 R248 C249 P254 D255	G230-K232 WeakPolarHBondContact O-CG 3.13Å; G230-K232 PolarHBondContact O-N 2.86Å; G230-K232 VanDerWaalsContact O-N 3.16Å; K232-R248 CarbonylContact O-C 3.52Å; K232-R248 WeakPolarHBondContact O-CA 3.45Å; K232-C249 PolarHBondContact O-N 3.17Å; K232-P254 WeakPolarHBondContact CD-O 3.43Å; K232-P254 WeakPolarHBondContact CE-O 3.36Å; K232-P254 PolarHBondContact NZ-O 2.76Å; K232-D255 VanDerWaalsContact CE-C 3.41Å; K232-D255 WeakPolarHBondContact CE-O 3.45Å; K232-D255 PolarHBondContact NZ-O 2.97Å
233	L	80.9	Confident	71.9	Confident	59 Å²	59	84.9 Å²	84.9	31%	0.309	45%	0.45	S	S	.	.	B	Isolated β-bridge	trans	-88.5	153	176.8	-60.8	-176.6	0	0	0	111.8	S231 A237 S245 C249	S231-L233 PolarHBondContact O-N 2.84Å; S231-L233 PolarHBondContact OG-N 2.06Å; L233-A237 HydrophobicContact CB-CB 4.28Å; L233-S245 WeakPolarHBondContact CD2-O 3.23Å; L233-C249 WeakPolarHBondContact O-CB 3.47Å
234	S	75.1	Confident	70.4	Confident	16 Å²	16	87.1 Å²	87.1	11%	0.112	46%	0.458	C	S	.	.			trans	-71.9	154.9	172.4	67.6	0	0	0	0	112.1	L236 A237 N238 L247	S234-L236 PolarHBondContact O-N 2.85Å; S234-L236 VanDerWaalsContact O-N 3.08Å; S234-A237 PolarHBondContact O-N 3.44Å; S234-A237 VanDerWaalsContact O-N 3.11Å; S234-A237 PolarHBondContact OG-N 3.16Å; S234-N238 PolarHBondContact O-N 2.96Å; S234-N238 VanDerWaalsContact O-N 3.17Å; S234-L247 WeakPolarHBondContact CB-O 3.5Å; S234-L247 PolarHBondContact N-O 2.93Å; S234-L247 WeakPolarHBondContact OG-CB 3.14Å; S234-L247 PolarHBondContact OG-O 3Å
235	M	63.5	Low	68.9	Low	129 Å²	129	86.5 Å²	86.5	64%	0.635	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-19.5	173.7	-64.5	-157.9	-63	0	0	113.8	R239	M235-R239 VanDerWaalsContact O-CG 3.3Å; M235-R239 WeakPolarHBondContact O-CG 3.15Å
236	L	58.7	Low	67.7	Low	118 Å²	118	92.6 Å²	92.6	62%	0.618	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-42.9	175	-64.1	174.5	0	0	0	111.5	S234 N238 R239 F240	S234-L236 PolarHBondContact O-N 2.85Å; S234-L236 VanDerWaalsContact O-N 3.08Å; L236-N238 VanDerWaalsContact C-N 3.27Å; L236-N238 PolarHBondContact O-N 2.97Å; L236-R239 PolarHBondContact O-N 2.97Å; L236-R239 VanDerWaalsContact O-N 3.11Å; L236-F240 PolarHBondContact O-N 3.26Å
237	A	55.8	Low	67.3	Low	15 Å²	15	93.7 Å²	93.7	12%	0.124	49%	0.489	C	S	.	.	G	3₁₀ helix	trans	-61.4	-37.8	173.4	0	0	0	0	0	111.3	L233 S234 R239 I244	L233-A237 HydrophobicContact CB-CB 4.28Å; S234-A237 PolarHBondContact O-N 3.44Å; S234-A237 VanDerWaalsContact O-N 3.11Å; S234-A237 PolarHBondContact OG-N 3.16Å; A237-R239 PolarHBondContact O-N 3.26Å; A237-I244 WeakPolarHBondContact CB-O 3.47Å
238	N	53.3	Low	67.2	Low	90 Å²	90	95.6 Å²	95.6	48%	0.481	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-67.6	-0.1	175.3	-63.4	-15.7	0	0	0	114.6	S234 L236	S234-N238 PolarHBondContact O-N 2.96Å; S234-N238 VanDerWaalsContact O-N 3.17Å; L236-N238 VanDerWaalsContact C-N 3.27Å; L236-N238 PolarHBondContact O-N 2.97Å
239	R	56	Low	67.1	Low	192 Å²	192	96 Å²	96	73%	0.725	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-127.1	-4.7	-174.8	-71.5	-76	178.4	152	-4.9	114.5	M235 L236 A237	M235-R239 VanDerWaalsContact O-CG 3.3Å; M235-R239 WeakPolarHBondContact O-CG 3.15Å; L236-R239 PolarHBondContact O-N 2.97Å; L236-R239 VanDerWaalsContact O-N 3.11Å; A237-R239 PolarHBondContact O-N 3.26Å
240	F	47.3	Very low	67	Low	151 Å²	151	97.9 Å²	97.9	66%	0.662	50%	0.501	S	S	*	.	S	Bend	trans	-127.4	166.8	179.2	-89.5	-94	0	0	0	111.6	L236 I244	L236-F240 PolarHBondContact O-N 3.26Å; F240-I244 HydrophobicContact CB-CD1 4.06Å; F240-I244 HydrophobicContact CG-CD1 4.34Å
241	N	52.4	Low	66.8	Low	136 Å²	136	99.6 Å²	99.6	73%	0.727	51%	0.513	S	S	*	.			trans	-58.3	155.9	173.9	-83	3.6	0	0	0	111.7	S243 I244	N241-S243 PolarHBondContact O-N 3.39Å; N241-S243 PolarHBondContact O-OG 3.14Å; N241-S243 VanDerWaalsContact O-OG 3.11Å; N241-I244 PolarHBondContact O-N 3.23Å
242	E	54.7	Low	66.9	Low	182 Å²	182	97.1 Å²	97.1	85%	0.85	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-43	-21.1	-177.6	-63.9	160	-178.9	0	0	116.2	I244 S245	E242-I244 PolarHBondContact O-N 3.19Å; E242-S245 WeakPolarHBondContact O-CB 3.33Å; E242-S245 PolarHBondContact O-N 3.36Å; E242-S245 PolarHBondContact O-OG 3.49Å
243	S	50.3	Low	66.5	Low	107 Å²	107	100 Å²	100	75%	0.748	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-55.6	-5.2	172.8	47.3	0	0	0	0	117.1	N241	N241-S243 PolarHBondContact O-N 3.39Å; N241-S243 PolarHBondContact O-OG 3.14Å; N241-S243 VanDerWaalsContact O-OG 3.11Å
244	I	58.6	Low	66.5	Low	66 Å²	66	100.4 Å²	100.4	34%	0.338	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-130.2	32.3	179.3	-35.1	-177.1	0	0	0	111.4	A237 F240 N241 E242 D246 L247	A237-I244 WeakPolarHBondContact CB-O 3.47Å; F240-I244 HydrophobicContact CB-CD1 4.06Å; F240-I244 HydrophobicContact CG-CD1 4.34Å; N241-I244 PolarHBondContact O-N 3.23Å; E242-I244 PolarHBondContact O-N 3.19Å; I244-D246 VanDerWaalsContact C-N 3.27Å; I244-D246 PolarHBondContact O-N 3.22Å; I244-L247 HydrophobicContact CG2-CD1 3.49Å; I244-L247 VanDerWaalsContact CG2-CD1 3.49Å
245	S	57.1	Low	66.8	Low	72 Å²	72	104.8 Å²	104.8	50%	0.503	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-24.6	179.4	52.3	0	0	0	0	114.7	L233 E242 L247	L233-S245 WeakPolarHBondContact CD2-O 3.23Å; E242-S245 WeakPolarHBondContact O-CB 3.33Å; E242-S245 PolarHBondContact O-N 3.36Å; E242-S245 PolarHBondContact O-OG 3.49Å; S245-L247 PolarHBondContact O-N 2.85Å
246	D	64.9	Low	67.8	Low	130 Å²	130	98.7 Å²	98.7	70%	0.695	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-11.3	-177.4	-89.6	-39.4	0	0	0	115.3	I244 R248	I244-D246 VanDerWaalsContact C-N 3.27Å; I244-D246 PolarHBondContact O-N 3.22Å; D246-R248 PolarHBondContact O-N 3.23Å
247	L	76	Confident	69.2	Low	89 Å²	89	97.1 Å²	97.1	47%	0.466	50%	0.495	S	S	.	.			trans	-76.7	89.4	173.7	-95	103.4	0	0	0	111.1	S234 I244 S245	S234-L247 WeakPolarHBondContact CB-O 3.5Å; S234-L247 PolarHBondContact N-O 2.93Å; S234-L247 WeakPolarHBondContact OG-CB 3.14Å; S234-L247 PolarHBondContact OG-O 3Å; I244-L247 HydrophobicContact CG2-CD1 3.49Å; I244-L247 VanDerWaalsContact CG2-CD1 3.49Å; S245-L247 PolarHBondContact O-N 2.85Å
248	R	82.9	Confident	70.8	Confident	130 Å²	130	98.5 Å²	98.5	49%	0.491	50%	0.499	S	S	.	.	B	Isolated β-bridge	trans	-68.5	154.3	173	-57.2	178.6	-173.4	-107	-1.8	111.8	K232 D246 Q250 Y253	K232-R248 CarbonylContact O-C 3.52Å; K232-R248 WeakPolarHBondContact O-CA 3.45Å; D246-R248 PolarHBondContact O-N 3.23Å; R248-Q250 PolarHBondContact O-N 2.88Å; R248-Y253 HydrophobicContact CB-CD2 4.21Å; R248-Y253 HydrophobicContact CG-CD2 4.42Å
249	C	82.5	Confident	72.5	Confident	11 Å²	11	103.7 Å²	103.7	7%	0.074	51%	0.512	C	S	.	.			trans	-75.6	116	175.6	177.9	0	0	0	0	111	C228 K232 L233 A251 C252 Y253	C228-C249 HydrophobicContact CB-CB 3.65Å; K232-C249 PolarHBondContact O-N 3.17Å; L233-C249 WeakPolarHBondContact O-CB 3.47Å; C249-A251 PolarHBondContact O-N 2.83Å; C249-C252 WeakPolarHBondContact CB-SG 3.35Å; C249-C252 PolarHBondContact O-N 2.85Å; C249-Y253 WeakPolarHBondContact O-CB 3.47Å; C249-Y253 PolarHBondContact O-N 3.21Å; C249-Y253 VanDerWaalsContact O-N 3.13Å
250	Q	83.5	Confident	74.1	Confident	195 Å²	195	94.7 Å²	94.7	91%	0.911	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-22.5	-177.6	-65.9	176.5	-10	0	0	114.1	R248	R248-Q250 PolarHBondContact O-N 2.88Å
251	A	81.5	Confident	76	Confident	66 Å²	66	93.3 Å²	93.3	55%	0.545	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-18.4	178.5	0	0	0	0	0	114.2	L227 C249	L227-A251 HydrophobicContact CD1-CB 3.82Å; C249-A251 PolarHBondContact O-N 2.83Å
252	C	84.4	Confident	77.5	Confident	5 Å²	5	89.5 Å²	89.5	3%	0.034	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.9	9.8	-173.8	84.6	0	0	0	0	113.9	C225 C228 C249 P254 D255 G256	C225-C252 HydrophobicContact CB-CB 3.39Å; C228-C252 HydrophobicContact CB-CB 4.38Å; C228-C252 WeakPolarHBondContact CB-SG 3.48Å; C228-C252 WeakPolarHBondContact SG-CB 3.23Å; C228-C252 CovalentContact SG-SG 2.06Å; C228-C252 PolarHBondContact SG-SG 3.14Å; C249-C252 WeakPolarHBondContact CB-SG 3.35Å; C249-C252 PolarHBondContact O-N 2.85Å; C252-P254 CarbonylContact O-C 3.59Å; C252-D255 PolarHBondContact O-N 3.13Å; C252-D255 VanDerWaalsContact O-N 3.14Å; C252-G256 WeakPolarHBondContact O-CA 3.34Å; C252-G256 PolarHBondContact O-N 2.77Å
253	Y	77.8	Confident	78.9	Confident	141 Å²	141	84 Å²	84	55%	0.553	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	131.9	178.9	-177.6	-103.3	0	0	0	111.1	R248 C249	R248-Y253 HydrophobicContact CB-CD2 4.21Å; R248-Y253 HydrophobicContact CG-CD2 4.42Å; C249-Y253 WeakPolarHBondContact O-CB 3.47Å; C249-Y253 PolarHBondContact O-N 3.21Å; C249-Y253 VanDerWaalsContact O-N 3.13Å
254	P	79.8	Confident	80.1	Confident	67 Å²	67	82.1 Å²	82.1	44%	0.435	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	cis	-93.1	-12.6	7	35.6	-33.7	0	0	0	115.8	K232 C252	K232-P254 WeakPolarHBondContact CD-O 3.43Å; K232-P254 WeakPolarHBondContact CE-O 3.36Å; K232-P254 PolarHBondContact NZ-O 2.76Å; C252-P254 CarbonylContact O-C 3.59Å
255	D	82.5	Confident	80.1	Confident	108 Å²	108	86.5 Å²	86.5	58%	0.578	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-20.5	-158.1	-59.6	-57.2	0	0	0	115.9	K232 C252	K232-D255 VanDerWaalsContact CE-C 3.41Å; K232-D255 WeakPolarHBondContact CE-O 3.45Å; K232-D255 PolarHBondContact NZ-O 2.97Å; C252-D255 PolarHBondContact O-N 3.13Å; C252-D255 VanDerWaalsContact O-N 3.14Å
256	G	84.3	Confident	81.3	Confident	1 Å²	1	87.3 Å²	87.3	1%	0.01	46%	0.46	C	S	.	.	S	Bend	trans	83.3	-2.5	-173.5	0	0	0	0	0	114	C225 G230 C252	C225-G256 WeakPolarHBondContact CB-O 3.43Å; C225-G256 PolarHBondContact N-O 2.85Å; G230-G256 WeakPolarHBondContact CA-O 3.41Å; C252-G256 WeakPolarHBondContact O-CA 3.34Å; C252-G256 PolarHBondContact O-N 2.77Å
257	L	88.6	Confident	82.2	Confident	86 Å²	86	85 Å²	85	45%	0.45	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	154.8	-172.5	-57	176.8	0	0	0	111.4	C222 A223	C222-L257 HydrophobicContact CB-CB 4.37Å; C222-L257 HydrophobicContact CB-CD1 4.1Å; A223-L257 CarbonylContact O-C 3.56Å; A223-L257 VanDerWaalsContact O-CA 3.23Å; A223-L257 WeakPolarHBondContact O-CA 3.41Å
258	E	88.3	Confident	82.5	Confident	44 Å²	44	84.8 Å²	84.8	21%	0.206	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	170.4	164.1	68.8	-171	-140.9	0	0	109.4	C222 A223 C225 S226 Q261	C222-E258 CarbonylContact C-O 3.56Å; C222-E258 WeakPolarHBondContact CA-O 3.23Å; A223-E258 PolarHBondContact N-O 3.31Å; A223-E258 PolarHBondContact O-N 3.36Å; C225-E258 VanDerWaalsContact CA-OE2 3.23Å; C225-E258 WeakPolarHBondContact CA-OE2 3.04Å; C225-E258 HydrophobicContact CB-CB 4.25Å; C225-E258 HydrophobicContact CB-CG 4.35Å; C225-E258 PolarHBondContact SG-OE2 2.88Å; S226-E258 WeakPolarHBondContact CB-OE2 3.49Å; S226-E258 PolarHBondContact N-OE2 2.83Å; S226-E258 PolarHBondContact OG-OE1 3.29Å; S226-E258 PolarHBondContact OG-OE2 2.74Å; E258-Q261 PolarHBondContact OE1-NE2 3.07Å
259	R	88.8	Confident	82.5	Confident	198 Å²	198	82.1 Å²	82.1	75%	0.747	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.2	140.8	173.2	-72.4	-177.5	178.3	161.2	0.1	109.8	Q261	R259-Q261 PolarHBondContact O-N 3.35Å; R259-Q261 VanDerWaalsContact O-N 3.17Å
260	C	90.3	Very high	82.5	Confident	3 Å²	3	86.6 Å²	86.6	2%	0.02	47%	0.468	C	S	.	.			trans	-63.3	119	173.1	-176.3	0	0	0	0	109.1	C217 G221 A223 S262 C263 S264	C217-C260 HydrophobicContact CB-CB 3.73Å; G221-C260 PolarHBondContact O-N 3.3Å; A223-C260 HydrophobicContact CB-CB 4.49Å; C260-S262 PolarHBondContact O-N 3.08Å; C260-C263 HydrophobicContact CB-CB 4.1Å; C260-C263 CarbonylContact O-C 3.51Å; C260-C263 WeakPolarHBondContact O-CA 3.36Å; C260-C263 WeakPolarHBondContact O-CB 3.49Å; C260-C263 PolarHBondContact O-N 2.81Å; C260-S264 PolarHBondContact O-N 2.84Å; C260-S264 PolarHBondContact O-OG 2.95Å
261	Q	86.4	Confident	82.4	Confident	123 Å²	123	79.3 Å²	79.3	58%	0.575	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-57.3	-38.2	-176.3	-58.1	-63.5	-22.2	0	0	111.6	E258 R259 C263 S264 S265	E258-Q261 PolarHBondContact OE1-NE2 3.07Å; R259-Q261 PolarHBondContact O-N 3.35Å; R259-Q261 VanDerWaalsContact O-N 3.17Å; Q261-C263 PolarHBondContact O-N 2.69Å; Q261-S264 WeakPolarHBondContact CA-OG 3.35Å; Q261-S264 PolarHBondContact O-N 2.77Å; Q261-S264 VanDerWaalsContact O-N 3.14Å; Q261-S264 PolarHBondContact O-OG 3.12Å; Q261-S265 PolarHBondContact O-N 2.99Å
262	S	84.5	Confident	82.5	Confident	55 Å²	55	80.3 Å²	80.3	39%	0.385	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-72.2	2.2	174.7	-46	0	0	0	0	114.9	H216 C260	H216-S262 PolarHBondContact CD2-OG 3.29Å; C260-S262 PolarHBondContact O-N 3.08Å
263	C	84.7	Confident	82.3	Confident	68 Å²	68	86.1 Å²	86.1	46%	0.459	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-119.3	-2.1	170.8	-60.6	0	0	0	0	112.6	C214 C217 C260 Q261	C214-C263 WeakPolarHBondContact CB-SG 3.36Å; C214-C263 PolarHBondContact SG-SG 3.17Å; C217-C263 VanDerWaalsContact SG-SG 3.64Å; C260-C263 HydrophobicContact CB-CB 4.1Å; C260-C263 CarbonylContact O-C 3.51Å; C260-C263 WeakPolarHBondContact O-CA 3.36Å; C260-C263 WeakPolarHBondContact O-CB 3.49Å; C260-C263 PolarHBondContact O-N 2.81Å; Q261-C263 PolarHBondContact O-N 2.69Å
264	S	74	Confident	82.7	Confident	67 Å²	67	81.5 Å²	81.5	47%	0.469	45%	0.453	S	S	.	.			trans	-117.7	7.8	177.8	58.6	0	0	0	0	113.3	C260 Q261	C260-S264 PolarHBondContact O-N 2.84Å; C260-S264 PolarHBondContact O-OG 2.95Å; Q261-S264 WeakPolarHBondContact CA-OG 3.35Å; Q261-S264 PolarHBondContact O-N 2.77Å; Q261-S264 VanDerWaalsContact O-N 3.14Å; Q261-S264 PolarHBondContact O-OG 3.12Å
265	S	60.7	Low	83	Confident	158 Å²	158	82.8 Å²	82.8	100%	1.105	46%	0.455	S	S	*	.			trans	-89.3	0	171.5	58.8	0	0	0	0	111.3	Q261	Q261-S265 PolarHBondContact O-N 2.99Å

Retrieved 265 of 265 residues in 188.9 ms (Link to these results)

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