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Oxytocin-neurophysin 1

Neurophysin 1 specifically binds oxytocin. Oxytocin causes contraction of the smooth muscle of the uterus and of the mammary gland. Acts by binding to oxytocin receptor (OXTR).

AlphaFold DB (F7AXI7), UniProt , Accession A0A096NV92, Species PAPAN (Papio anubis, Olive baboon), Gene OXT, Length 125 aa.

						>A0A096NV92_PAPAN|A0A096NV92|OXT
MAGPSLACCLLGLLALTSACYIQNCPLGGKRAAPDLDVRKCLPCGPGGKGRCFGPNICCAEELGCFVGTAEALRCQEENYLPSPCQSGQKACGSGGRCAVFGLCCSPDGCHADPACDMEATFSQH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.4	Very low	64.7	Low	239 Å²	239	97.8 Å²	97.8	100%	1.177	61%	0.608	S	S	*	*				0	70.2	0	-71.1	133.2	72.4	0	0	110.4
2	A	55.3	Low	65	Low	64 Å²	64	92.4 Å²	92.4	53%	0.529	59%	0.585	S	S	.	*			trans	-111.2	3	-177.7	0	0	0	0	0	113.9	L6	A2-L6 PolarHBondContact O-N 3.46Å
3	G	60.8	Low	65.2	Low	52 Å²	52	93.7 Å²	93.7	54%	0.536	58%	0.584	S	S	.	*	H	α-helix	trans	-68.2	-44.7	-174.2	0	0	0	0	0	115.6	A7	G3-A7 WeakPolarHBondContact O-CB 3.45Å; G3-A7 PolarHBondContact O-N 3.14Å; G3-A7 VanDerWaalsContact O-N 3.14Å
4	P	62.2	Low	65.3	Low	93 Å²	93	95.3 Å²	95.3	60%	0.604	59%	0.586	S	S	*	*	H	α-helix	trans	-68.4	-40.2	-175.7	-18.5	30.3	0	0	0	112.5	A7 C8	P4-A7 PolarHBondContact O-N 3.31Å; P4-C8 PolarHBondContact O-N 3.45Å; P4-C8 PolarHBondContact O-SG 3.01Å; P4-C8 VanDerWaalsContact O-SG 3.39Å
5	S	65.4	Low	65.4	Low	82 Å²	82	92.7 Å²	92.7	57%	0.573	58%	0.578	S	S	*	*	H	α-helix	trans	-67.9	-39.9	-178.7	-54.4	0	0	0	0	112.2	C9	S5-C9 PolarHBondContact O-N 3.41Å; S5-C9 PolarHBondContact O-SG 3.05Å
6	L	68.3	Low	65.1	Low	108 Å²	108	95.2 Å²	95.2	57%	0.565	59%	0.585	S	S	*	*	H	α-helix	trans	-68	-40.7	176.1	-109.4	136.2	0	0	0	112.1	A2 C9 L10	A2-L6 PolarHBondContact O-N 3.46Å; L6-C9 PolarHBondContact O-N 3.04Å; L6-L10 WeakPolarHBondContact O-CG 3.43Å; L6-L10 PolarHBondContact O-N 3.39Å
7	A	71.5	Confident	65	Low	48 Å²	48	95.8 Å²	95.8	40%	0.397	59%	0.589	S	S	.	*	H	α-helix	trans	-63.4	-43.4	176.5	0	0	0	0	0	112	G3 P4 L10 L11	G3-A7 WeakPolarHBondContact O-CB 3.45Å; G3-A7 PolarHBondContact O-N 3.14Å; G3-A7 VanDerWaalsContact O-N 3.14Å; P4-A7 PolarHBondContact O-N 3.31Å; A7-L10 PolarHBondContact O-N 3.01Å; A7-L11 WeakPolarHBondContact O-CB 3.33Å; A7-L11 WeakPolarHBondContact O-CG 3.4Å; A7-L11 PolarHBondContact O-N 2.78Å
8	C	67.4	Low	64.6	Low	88 Å²	88	95.8 Å²	95.8	60%	0.595	59%	0.593	S	S	*	*	H	α-helix	trans	-63.3	-39.8	174.8	-73.5	0	0	0	0	112.5	P4 G12	P4-C8 PolarHBondContact O-N 3.45Å; P4-C8 PolarHBondContact O-SG 3.01Å; P4-C8 VanDerWaalsContact O-SG 3.39Å; C8-G12 PolarHBondContact O-N 3.06Å
9	C	71.2	Confident	64.2	Low	83 Å²	83	94.4 Å²	94.4	56%	0.561	59%	0.592	S	S	*	*	H	α-helix	trans	-64.7	-42.6	176.9	-72.3	0	0	0	0	112.5	S5 L6 G12 L13	S5-C9 PolarHBondContact O-N 3.41Å; S5-C9 PolarHBondContact O-SG 3.05Å; L6-C9 PolarHBondContact O-N 3.04Å; C9-G12 PolarHBondContact O-N 3.32Å; C9-L13 WeakPolarHBondContact O-CG 3.44Å; C9-L13 PolarHBondContact O-N 2.75Å; C9-L13 VanDerWaalsContact O-N 3.08Å
10	L	71.6	Confident	64	Low	99 Å²	99	95.5 Å²	95.5	52%	0.518	60%	0.602	S	S	.	*	H	α-helix	trans	-65.9	-43.7	178.3	-69.6	169.3	0	0	0	111.5	L6 A7 G12 L13 L14	L6-L10 WeakPolarHBondContact O-CG 3.43Å; L6-L10 PolarHBondContact O-N 3.39Å; A7-L10 PolarHBondContact O-N 3.01Å; L10-G12 VanDerWaalsContact C-N 3.33Å; L10-G12 PolarHBondContact O-N 3.03Å; L10-L13 PolarHBondContact O-N 3.45Å; L10-L14 WeakPolarHBondContact O-CD1 3.37Å; L10-L14 PolarHBondContact O-N 2.85Å
11	L	69.7	Low	63.8	Low	120 Å²	120	99.5 Å²	99.5	63%	0.628	61%	0.607	S	S	*	*	H	α-helix	trans	-61.8	-39.4	175.8	-76.8	163.7	0	0	0	112.5	A7 L14 A15	A7-L11 WeakPolarHBondContact O-CB 3.33Å; A7-L11 WeakPolarHBondContact O-CG 3.4Å; A7-L11 PolarHBondContact O-N 2.78Å; L11-L14 PolarHBondContact O-N 3.25Å; L11-A15 PolarHBondContact O-N 3.42Å; L11-A15 VanDerWaalsContact O-N 3.16Å
12	G	68.8	Low	64.3	Low	33 Å²	33	94 Å²	94	34%	0.34	58%	0.581	S	S	.	*	H	α-helix	trans	-63	-45.4	175.1	0	0	0	0	0	112.7	C8 C9 L10 L14 A15 L16	C8-G12 PolarHBondContact O-N 3.06Å; C9-G12 PolarHBondContact O-N 3.32Å; L10-G12 VanDerWaalsContact C-N 3.33Å; L10-G12 PolarHBondContact O-N 3.03Å; G12-L14 PolarHBondContact O-N 3.17Å; G12-A15 PolarHBondContact O-N 3.24Å; G12-L16 WeakPolarHBondContact O-CD1 3.48Å; G12-L16 PolarHBondContact O-N 3.09Å; G12-L16 VanDerWaalsContact O-N 3.1Å
13	L	67.6	Low	64.3	Low	109 Å²	109	97.5 Å²	97.5	57%	0.571	59%	0.586	S	S	*	*	H	α-helix	trans	-63.2	-40.3	178.2	-72.5	164.9	0	0	0	112.3	C9 L10 L16 T17	C9-L13 WeakPolarHBondContact O-CG 3.44Å; C9-L13 PolarHBondContact O-N 2.75Å; C9-L13 VanDerWaalsContact O-N 3.08Å; L10-L13 PolarHBondContact O-N 3.45Å; L13-L16 PolarHBondContact O-N 3.46Å; L13-T17 WeakPolarHBondContact O-CG2 3.35Å; L13-T17 PolarHBondContact O-N 3.1Å; L13-T17 VanDerWaalsContact O-N 3.09Å
14	L	66.7	Low	64	Low	116 Å²	116	102 Å²	102	61%	0.607	60%	0.598	S	S	*	*	H	α-helix	trans	-61.6	-43.9	175.1	-92.1	136.3	0	0	0	112.2	L10 L11 G12 L16 T17 S18	L10-L14 WeakPolarHBondContact O-CD1 3.37Å; L10-L14 PolarHBondContact O-N 2.85Å; L11-L14 PolarHBondContact O-N 3.25Å; G12-L14 PolarHBondContact O-N 3.17Å; L14-L16 PolarHBondContact O-N 3.34Å; L14-T17 PolarHBondContact O-N 3.16Å; L14-T17 PolarHBondContact O-OG1 3.5Å; L14-S18 PolarHBondContact O-N 3.49Å
15	A	65.5	Low	64.1	Low	57 Å²	57	102.5 Å²	102.5	47%	0.471	60%	0.602	S	S	.	*	H	α-helix	trans	-62.7	-41.1	176.8	0	0	0	0	0	112.1	L11 G12 T17 S18	L11-A15 PolarHBondContact O-N 3.42Å; L11-A15 VanDerWaalsContact O-N 3.16Å; G12-A15 PolarHBondContact O-N 3.24Å; A15-T17 VanDerWaalsContact C-N 3.33Å; A15-T17 PolarHBondContact O-N 3.32Å; A15-S18 PolarHBondContact O-N 3.08Å; A15-S18 PolarHBondContact O-OG 3.41Å
16	L	62	Low	63.7	Low	132 Å²	132	104 Å²	104	69%	0.691	61%	0.61	S	S	*	*	H	α-helix	trans	-62.7	-36.1	175.7	-78.3	149.3	0	0	0	112.6	G12 L13 L14	G12-L16 WeakPolarHBondContact O-CD1 3.48Å; G12-L16 PolarHBondContact O-N 3.09Å; G12-L16 VanDerWaalsContact O-N 3.1Å; L13-L16 PolarHBondContact O-N 3.46Å; L14-L16 PolarHBondContact O-N 3.34Å
17	T	62.2	Low	63.4	Low	106 Å²	106	107.1 Å²	107.1	65%	0.65	63%	0.627	S	S	*	*	H	α-helix	trans	-73.1	-26.8	176.6	59.6	0	0	0	0	113.9	L13 L14 A15 A19	L13-T17 WeakPolarHBondContact O-CG2 3.35Å; L13-T17 PolarHBondContact O-N 3.1Å; L13-T17 VanDerWaalsContact O-N 3.09Å; L14-T17 PolarHBondContact O-N 3.16Å; L14-T17 PolarHBondContact O-OG1 3.5Å; A15-T17 VanDerWaalsContact C-N 3.33Å; A15-T17 PolarHBondContact O-N 3.32Å; T17-A19 VanDerWaalsContact C-N 3.34Å
18	S	57.7	Low	62.7	Low	95 Å²	95	108.1 Å²	108.1	66%	0.664	64%	0.642	S	S	*	*	H	α-helix	trans	-76.7	-16.5	178.6	64.7	0	0	0	0	114.6	L14 A15	L14-S18 PolarHBondContact O-N 3.49Å; A15-S18 PolarHBondContact O-N 3.08Å; A15-S18 PolarHBondContact O-OG 3.41Å
19	A	57	Low	62.6	Low	69 Å²	69	106.5 Å²	106.5	57%	0.57	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-8.9	-167.8	0	0	0	0	0	115.2	T17	T17-A19 VanDerWaalsContact C-N 3.34Å
20	C	60.8	Low	61.8	Low	116 Å²	116	113.3 Å²	113.3	78%	0.784	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.5	52.2	-176.9	-73.4	0	0	0	0	113.6
21	Y	59.3	Low	61.2	Low	181 Å²	181	119.9 Å²	119.9	71%	0.71	68%	0.678	S	S	*	*			trans	-110	57	159.7	-157.2	-103.9	0	0	0	110.6	Q23	Y21-Q23 HydrophobicContact CD1-CG 3.61Å; Y21-Q23 HydrophobicContact CE1-CG 3.24Å; Y21-Q23 HydrophobicContact CG-CG 4.44Å; Y21-Q23 PolarHBondContact O-N 3.26Å; Y21-Q23 PolarHBondContact OH-NE2 3.19Å
22	I	58.4	Low	60.6	Low	122 Å²	122	117.5 Å²	117.5	63%	0.626	68%	0.675	S	S	*	*			trans	-78.9	102.5	166.1	-70.9	169	0	0	0	106.7	N24	I22-N24 VanDerWaalsContact C-N 3.27Å; I22-N24 WeakPolarHBondContact CG2-O 3.41Å
23	Q	55.8	Low	60.1	Low	139 Å²	139	119 Å²	119	65%	0.65	69%	0.685	S	S	*	*	S	Bend	trans	-78.6	-14.2	170.7	-65.3	-126.3	-58.5	0	0	112.7	Y21	Y21-Q23 HydrophobicContact CD1-CG 3.61Å; Y21-Q23 HydrophobicContact CE1-CG 3.24Å; Y21-Q23 HydrophobicContact CG-CG 4.44Å; Y21-Q23 PolarHBondContact O-N 3.26Å; Y21-Q23 PolarHBondContact OH-NE2 3.19Å
24	N	54.8	Low	59.5	Low	147 Å²	147	119.6 Å²	119.6	79%	0.786	70%	0.695	S	S	*	*			trans	-110.4	67.4	-179.4	-74.2	-64.9	0	0	0	110.3	I22 P26	I22-N24 VanDerWaalsContact C-N 3.27Å; I22-N24 WeakPolarHBondContact CG2-O 3.41Å; N24-P26 WeakPolarHBondContact O-CD 3.48Å
25	C	64.6	Low	58.8	Low	102 Å²	102	121.3 Å²	121.3	69%	0.689	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-71.3	122.9	168.5	-100	0	0	0	0	108.6
26	P	57.7	Low	58.5	Low	115 Å²	115	124.9 Å²	124.9	75%	0.747	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-60.8	142.2	173.3	25.5	-32.7	0	0	0	109.7	N24 G28	N24-P26 WeakPolarHBondContact O-CD 3.48Å; P26-G28 PolarHBondContact O-N 3.22Å
27	L	61.5	Low	58.8	Low	173 Å²	173	126.3 Å²	126.3	91%	0.906	72%	0.724	S	S	*	*	S	Bend	trans	-59.3	121.3	174.5	-92.2	87	0	0	0	109.6
28	G	56.5	Low	59.8	Low	69 Å²	69	124 Å²	124	71%	0.711	71%	0.709	S	S	*	*			trans	128.1	97.7	168.5	0	0	0	0	0	114.5	P26	P26-G28 PolarHBondContact O-N 3.22Å
29	G	64.5	Low	61.5	Low	54 Å²	54	122.6 Å²	122.6	56%	0.557	69%	0.689	S	S	*	*			trans	-121	168.7	159.3	0	0	0	0	0	109.8	R31 A32	G29-R31 PolarHBondContact O-N 3.19Å; G29-A32 PolarHBondContact O-N 3.19Å
30	K	54.3	Low	63.3	Low	225 Å²	225	125.9 Å²	125.9	98%	0.978	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	0.1	179	-60.9	-175	-179.8	-177.3	0	115.1
31	R	59.3	Low	65	Low	238 Å²	238	120.9 Å²	120.9	90%	0.898	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.6	12.4	-179.2	-57	-178.6	-178.3	-133.5	0.9	112.6	G29 A33	G29-R31 PolarHBondContact O-N 3.19Å; R31-A33 PolarHBondContact O-N 3.2Å
32	A	58.4	Low	66.8	Low	70 Å²	70	113.7 Å²	113.7	58%	0.579	63%	0.631	S	S	*	*			trans	-58.5	109.2	170.8	0	0	0	0	0	106.8	G29	G29-A32 PolarHBondContact O-N 3.19Å
33	A	56.5	Low	68.7	Low	65 Å²	65	109.5 Å²	109.5	54%	0.537	61%	0.611	S	S	.	*			trans	-57.3	133.5	-172.9	0	0	0	0	0	108.8	R31 D35 L36	R31-A33 PolarHBondContact O-N 3.2Å; A33-D35 PolarHBondContact O-N 3.19Å; A33-L36 HydrophobicContact CB-CD1 4.1Å
34	P	55.2	Low	70.7	Confident	121 Å²	121	103 Å²	103	79%	0.786	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	128.9	172.6	29.7	-31.2	0	0	0	107.7	L36	P34-L36 PolarHBondContact O-N 3.01Å
35	D	53.7	Low	72.7	Confident	152 Å²	152	97 Å²	97	81%	0.813	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	52.8	52.4	157.6	-145.6	37.4	0	0	0	115.6	A33 D37	A33-D35 PolarHBondContact O-N 3.19Å; D35-D37 PolarHBondContact O-N 3.34Å
36	L	57.6	Low	74.1	Confident	132 Å²	132	95.3 Å²	95.3	69%	0.691	54%	0.542	S	S	*	.			trans	-59.2	128.1	150	-87.8	144.8	0	0	0	106.7	A33 P34 V38	A33-L36 HydrophobicContact CB-CD1 4.1Å; P34-L36 PolarHBondContact O-N 3.01Å; L36-V38 VanDerWaalsContact C-N 3.31Å; L36-V38 WeakPolarHBondContact O-CA 3.44Å; L36-V38 WeakPolarHBondContact O-CG2 3.47Å; L36-V38 PolarHBondContact O-N 3.26Å
37	D	68.9	Low	75.8	Confident	162 Å²	162	93.7 Å²	93.7	87%	0.866	55%	0.546	S	S	*	.			trans	-39.9	92.6	172.5	-174.5	22.2	0	0	0	110.5	D35 R39	D35-D37 PolarHBondContact O-N 3.34Å; D37-R39 PolarHBondContact O-N 3.31Å
38	V	84.3	Confident	77.4	Confident	57 Å²	57	86.9 Å²	86.9	35%	0.345	52%	0.517	S	S	.	.			trans	-75.2	114.7	-171.6	-179.1	0	0	0	0	105.9	L36 C85 Q86	L36-V38 VanDerWaalsContact C-N 3.31Å; L36-V38 WeakPolarHBondContact O-CA 3.44Å; L36-V38 WeakPolarHBondContact O-CG2 3.47Å; L36-V38 PolarHBondContact O-N 3.26Å; V38-C85 VanDerWaalsContact CG1-C 3.47Å; V38-Q86 HydrophobicContact CG1-CB 3.8Å
39	R	93.1	Very high	79.2	Confident	65 Å²	65	90.2 Å²	90.2	25%	0.245	51%	0.512	C	S	.	.	B	Isolated β-bridge	trans	-55.5	148.6	-178.6	61.8	167.9	-177.6	92.1	4.9	110.7	D37 E78 L81 S83 P84 C85 Q86	D37-R39 PolarHBondContact O-N 3.31Å; R39-E78 IonicContact CZ-OE1 3.33Å; R39-E78 IonicContact CZ-OE2 3.8Å; R39-E78 IonicContact NH1-OE1 3.15Å; R39-E78 PolarHBondContact NH1-OE1 3.11Å; R39-E78 IonicContact NH1-OE2 2.65Å; R39-E78 PolarHBondContact NH1-OE2 3.11Å; R39-E78 VanDerWaalsContact NH1-OE2 3.15Å; R39-E78 IonicContact NH2-OE1 3.98Å; R39-E78 IonicContact NH2-OE2 3.73Å; R39-E78 PolarHBondContact NH2-OE2 3.15Å; R39-L81 VanDerWaalsContact NH2-CB 3.28Å; R39-L81 VanDerWaalsContact NH2-CD1 3.34Å; R39-S83 PolarHBondContact NE-O 3.21Å; R39-S83 PolarHBondContact NE-OG 3.29Å; R39-S83 PolarHBondContact NH2-O 3.24Å; R39-P84 VanDerWaalsContact CG-O 3.26Å; R39-P84 WeakPolarHBondContact CG-O 3.22Å; R39-C85 HydrophobicContact CG-CB 3.91Å; R39-C85 CarbonylContact O-C 3.44Å; R39-C85 WeakPolarHBondContact O-CA 3.48Å; R39-C85 WeakPolarHBondContact O-CB 3.41Å; R39-Q86 PolarHBondContact O-N 3.14Å
40	K	93.8	Very high	80.8	Confident	139 Å²	139	87.7 Å²	87.7	60%	0.604	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-64.5	139.8	167.3	-65.2	-176.8	-176.6	178.9	0	109.3	Q86	K40-Q86 WeakPolarHBondContact CA-O 3.49Å
41	C	96.9	Very high	82.9	Confident	10 Å²	10	81.4 Å²	81.4	7%	0.068	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-63.6	164.3	175.8	-56.9	0	0	0	0	111.4	R51 C52 E78 C85 Q86 S87	C41-R51 VanDerWaalsContact O-CD 3.24Å; C41-R51 WeakPolarHBondContact O-CD 3.37Å; C41-R51 PolarHBondContact O-NH1 2.79Å; C41-C52 HydrophobicContact CB-CB 4.06Å; C41-C52 WeakPolarHBondContact CB-O 3.08Å; C41-E78 WeakPolarHBondContact CA-OE1 3.48Å; C41-E78 HydrophobicContact CB-CG 4.48Å; C41-E78 WeakPolarHBondContact CB-OE1 3.5Å; C41-C85 VanDerWaalsContact CA-SG 3.51Å; C41-C85 HydrophobicContact CB-CB 3.87Å; C41-C85 WeakPolarHBondContact CB-SG 3.4Å; C41-C85 WeakPolarHBondContact SG-CB 3.45Å; C41-C85 CovalentContact SG-SG 2.05Å; C41-C85 PolarHBondContact SG-SG 3.1Å; C41-Q86 PolarHBondContact SG-N 3.28Å; C41-Q86 VanDerWaalsContact SG-N 3.39Å; C41-S87 WeakPolarHBondContact CB-OG 3.27Å
42	L	97.6	Very high	84.7	Confident	31 Å²	31	70.2 Å²	70.2	16%	0.162	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-52.2	143.2	-176.3	-74.8	173.6	0	0	0	111.6	C52 E77 E78 L81	L42-C52 PolarHBondContact O-N 3.2Å; L42-C52 VanDerWaalsContact O-N 3.17Å; L42-C52 PolarHBondContact O-SG 2.99Å; L42-C52 VanDerWaalsContact O-SG 3.39Å; L42-E77 HydrophobicContact CD1-CB 3.62Å; L42-E78 HydrophobicContact CB-CG 4.36Å; L42-E78 HydrophobicContact CD1-CG 4.12Å; L42-E78 HydrophobicContact CG-CG 4.24Å; L42-E78 WeakPolarHBondContact CG-OE1 3.01Å; L42-E78 PolarHBondContact N-OE1 2.85Å; L42-L81 HydrophobicContact CD1-CD1 4.03Å; L42-L81 HydrophobicContact CD2-CD1 4.35Å; L42-L81 HydrophobicContact CG-CD1 4.12Å
43	P	97.8	Very high	86.5	Confident	33 Å²	33	68.2 Å²	68.2	21%	0.214	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	142.8	171.8	29.2	-30.3	0	0	0	110.7	G48 G50 R74	P43-G48 WeakPolarHBondContact CB-O 3.33Å; P43-G50 CarbonylContact C-O 3.52Å; P43-G50 VanDerWaalsContact CA-O 3.23Å; P43-G50 WeakPolarHBondContact CA-O 3.41Å; P43-R74 WeakPolarHBondContact O-CD 3.3Å; P43-R74 PolarHBondContact O-NH1 2.74Å; P43-R74 VanDerWaalsContact O-NH1 3.1Å
44	C	97.9	Very high	88.4	Confident	3 Å²	3	65.6 Å²	65.6	2%	0.02	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	176.1	-175.4	62.3	0	0	0	0	111.8	G48 G50 R51 C58	C44-G48 CarbonylContact O-C 3.57Å; C44-G48 WeakPolarHBondContact O-CA 3.38Å; C44-G50 PolarHBondContact N-O 3.28Å; C44-G50 WeakPolarHBondContact O-CA 2.94Å; C44-G50 PolarHBondContact O-N 3.22Å; C44-G50 VanDerWaalsContact SG-C 3.55Å; C44-R51 PolarHBondContact SG-N 3.43Å; C44-R51 VanDerWaalsContact SG-N 3.41Å; C44-R51 PolarHBondContact SG-O 3.1Å; C44-R51 VanDerWaalsContact SG-O 3.42Å; C44-C58 HydrophobicContact CB-CB 3.82Å; C44-C58 WeakPolarHBondContact CB-SG 3.49Å; C44-C58 WeakPolarHBondContact SG-CA 3.01Å; C44-C58 WeakPolarHBondContact SG-CB 3.23Å; C44-C58 CovalentContact SG-SG 2.02Å; C44-C58 PolarHBondContact SG-SG 3.14Å
45	G	96.4	Very high	90.4	Very high	21 Å²	21	61.8 Å²	61.8	22%	0.216	35%	0.348	C	S	.	.	S	Bend	trans	68.1	-172.7	178.7	0	0	0	0	0	115.4	G47 G48 C58 E71	G45-G47 PolarHBondContact O-N 3.42Å; G45-G48 PolarHBondContact O-N 2.98Å; G45-C58 PolarHBondContact N-SG 3.39Å; G45-C58 VanDerWaalsContact N-SG 3.39Å; G45-E71 PolarHBondContact N-O 2.91Å; G45-E71 VanDerWaalsContact N-O 3.14Å
46	P	94.6	Very high	92.5	Very high	66 Å²	66	58 Å²	58	43%	0.429	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-58	121.6	-173.8	-25.5	35.3	0	0	0	112.3	G48 K49 L63 E71	P46-G48 PolarHBondContact O-N 2.71Å; P46-K49 PolarHBondContact O-N 3.41Å; P46-L63 HydrophobicContact CB-CD1 4.24Å; P46-L63 HydrophobicContact CG-CD1 4.03Å; P46-E71 HydrophobicContact CG-CG 4.45Å
47	G	93.5	Very high	94.4	Very high	81 Å²	81	52 Å²	52	84%	0.835	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	65.6	14.3	-178.4	0	0	0	0	0	114.8	G45 K49	G45-G47 PolarHBondContact O-N 3.42Å; G47-K49 PolarHBondContact O-N 2.02Å
48	G	94.8	Very high	95.8	Very high	30 Å²	30	44.2 Å²	44.2	31%	0.309	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	65.8	21.4	-178.6	0	0	0	0	0	113.9	P43 C44 G45 P46 G50	P43-G48 WeakPolarHBondContact CB-O 3.33Å; C44-G48 CarbonylContact O-C 3.57Å; C44-G48 WeakPolarHBondContact O-CA 3.38Å; G45-G48 PolarHBondContact O-N 2.98Å; P46-G48 PolarHBondContact O-N 2.71Å; G48-G50 VanDerWaalsContact C-N 3.31Å
49	K	95.2	Very high	96.4	Very high	139 Å²	139	41.7 Å²	41.7	60%	0.604	24%	0.239	S	C	*	.			trans	-73.9	-21.5	-178.9	-68.2	-175	171.5	-167.2	0	113.3	P46 G47 E62	P46-K49 PolarHBondContact O-N 3.41Å; G47-K49 PolarHBondContact O-N 2.02Å; K49-E62 IonicContact NZ-OE2 2.79Å
50	G	96.7	Very high	96.5	Very high	1 Å²	1	39 Å²	39	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	173.3	179	0	0	0	0	0	113.4	P43 C44 G48 C59	P43-G50 CarbonylContact C-O 3.52Å; P43-G50 VanDerWaalsContact CA-O 3.23Å; P43-G50 WeakPolarHBondContact CA-O 3.41Å; C44-G50 PolarHBondContact N-O 3.28Å; C44-G50 WeakPolarHBondContact O-CA 2.94Å; C44-G50 PolarHBondContact O-N 3.22Å; C44-G50 VanDerWaalsContact SG-C 3.55Å; G48-G50 VanDerWaalsContact C-N 3.31Å; G50-C59 CarbonylContact C-O 3.59Å; G50-C59 WeakPolarHBondContact CA-O 2.98Å
51	R	97.8	Very high	96.3	Very high	94 Å²	94	40.1 Å²	40.1	36%	0.355	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	148.2	172.6	-65.9	-69.4	172.6	173.2	-2.8	110.7	C41 C44 F53 C59	C41-R51 VanDerWaalsContact O-CD 3.24Å; C41-R51 WeakPolarHBondContact O-CD 3.37Å; C41-R51 PolarHBondContact O-NH1 2.79Å; C44-R51 PolarHBondContact SG-N 3.43Å; C44-R51 VanDerWaalsContact SG-N 3.41Å; C44-R51 PolarHBondContact SG-O 3.1Å; C44-R51 VanDerWaalsContact SG-O 3.42Å; R51-F53 HydrophobicContact CB-CE2 4.33Å; R51-F53 VanDerWaalsContact O-CD2 3.3Å; R51-F53 WeakPolarHBondContact O-CD2 3.15Å; R51-C59 PolarHBondContact N-O 2.89Å; R51-C59 PolarHBondContact O-N 2.04Å
52	C	98.1	Very high	96	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.02	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	132.4	177.3	-61.4	0	0	0	0	111.2	C41 L42 I57 C75 E78 S87	C41-C52 HydrophobicContact CB-CB 4.06Å; C41-C52 WeakPolarHBondContact CB-O 3.08Å; L42-C52 PolarHBondContact O-N 3.2Å; L42-C52 VanDerWaalsContact O-N 3.17Å; L42-C52 PolarHBondContact O-SG 2.99Å; L42-C52 VanDerWaalsContact O-SG 3.39Å; C52-I57 WeakPolarHBondContact CA-O 3.49Å; C52-C75 WeakPolarHBondContact CA-SG 3.04Å; C52-C75 HydrophobicContact CB-CB 3.61Å; C52-C75 WeakPolarHBondContact CB-SG 3.18Å; C52-C75 WeakPolarHBondContact SG-CA 3.39Å; C52-C75 WeakPolarHBondContact SG-CB 3.35Å; C52-C75 CovalentContact SG-SG 2.04Å; C52-C75 PolarHBondContact SG-SG 2.96Å; C52-E78 HydrophobicContact CB-CG 4.43Å; C52-S87 WeakPolarHBondContact O-CB 3.37Å; C52-S87 PolarHBondContact O-OG 3.39Å
53	F	97.4	Very high	95.6	Very high	27 Å²	27	49.5 Å²	49.5	12%	0.118	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	-9.9	172.5	-77.5	-101.3	0	0	0	112.4	R51 I57 C59 S87 R97 A99 C105 P107	R51-F53 HydrophobicContact CB-CE2 4.33Å; R51-F53 VanDerWaalsContact O-CD2 3.3Å; R51-F53 WeakPolarHBondContact O-CD2 3.15Å; F53-I57 HydrophobicContact CB-CB 4.4Å; F53-I57 HydrophobicContact CB-CG2 3.91Å; F53-I57 PolarHBondContact N-O 2.55Å; F53-C59 HydrophobicContact CD2-CB 3.71Å; F53-C59 HydrophobicContact CE2-CB 3.71Å; F53-S87 WeakPolarHBondContact CE1-O 3Å; F53-S87 VanDerWaalsContact CZ-CB 3.47Å; F53-R97 HydrophobicContact CE1-CB 4.3Å; F53-A99 HydrophobicContact CD1-CB 3.92Å; F53-A99 HydrophobicContact CD2-CB 4.12Å; F53-A99 HydrophobicContact CE1-CB 3.6Å; F53-A99 HydrophobicContact CE2-CB 3.85Å; F53-A99 HydrophobicContact CG-CB 4.18Å; F53-A99 VanDerWaalsContact CZ-CA 3.47Å; F53-A99 HydrophobicContact CZ-CB 3.58Å; F53-C105 HydrophobicContact CB-CB 4.08Å; F53-C105 HydrophobicContact CD1-CB 4.04Å; F53-C105 HydrophobicContact CG-CB 4.23Å; F53-P107 WeakPolarHBondContact O-CA 3.5Å
54	G	96.3	Very high	95.5	Very high	11 Å²	11	49 Å²	49	11%	0.113	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.7	173.5	176.8	0	0	0	0	0	109.9	N56 I57 C75	G54-N56 PolarHBondContact O-N 2.65Å; G54-N56 VanDerWaalsContact O-N 3.1Å; G54-I57 PolarHBondContact O-N 2.78Å; G54-C75 WeakPolarHBondContact O-CB 3.07Å
55	P	96.2	Very high	95.5	Very high	40 Å²	40	50.6 Å²	50.6	26%	0.26	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-25.1	-175.6	24.5	-34.5	0	0	0	113.3	C75 Q76	P55-C75 CarbonylContact O-C 3.55Å; P55-Q76 VanDerWaalsContact O-CG 3.27Å; P55-Q76 WeakPolarHBondContact O-CG 3.41Å; P55-Q76 PolarHBondContact O-N 2.96Å
56	N	97.3	Very high	95.5	Very high	73 Å²	73	51.8 Å²	51.8	39%	0.39	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.4	27	178.2	-58.2	-55.9	0	0	0	112.2	G54 V67 G68 Q76	G54-N56 PolarHBondContact O-N 2.65Å; G54-N56 VanDerWaalsContact O-N 3.1Å; N56-V67 WeakPolarHBondContact O-CA 3.12Å; N56-G68 PolarHBondContact O-N 3.18Å; N56-Q76 PolarHBondContact OD1-NE2 3.18Å; N56-Q76 VanDerWaalsContact OD1-NE2 3.1Å
57	I	98.1	Very high	95.6	Very high	5 Å²	5	52.5 Å²	52.5	3%	0.026	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	116.6	-176.7	-55.8	171.7	0	0	0	109.7	C52 F53 G54 V67 S106	C52-I57 WeakPolarHBondContact CA-O 3.49Å; F53-I57 HydrophobicContact CB-CB 4.4Å; F53-I57 HydrophobicContact CB-CG2 3.91Å; F53-I57 PolarHBondContact N-O 2.55Å; G54-I57 PolarHBondContact O-N 2.78Å; I57-V67 HydrophobicContact CG1-CG1 4.27Å; I57-V67 HydrophobicContact CG1-CG2 4.42Å; I57-V67 HydrophobicContact CG2-CG2 4.34Å; I57-S106 WeakPolarHBondContact CD1-O 3.19Å
58	C	98.2	Very high	95.8	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	127.2	174.5	177.3	0	0	0	0	110.2	C44 G45 C65 F66 A72	C44-C58 HydrophobicContact CB-CB 3.82Å; C44-C58 WeakPolarHBondContact CB-SG 3.49Å; C44-C58 WeakPolarHBondContact SG-CA 3.01Å; C44-C58 WeakPolarHBondContact SG-CB 3.23Å; C44-C58 CovalentContact SG-SG 2.02Å; C44-C58 PolarHBondContact SG-SG 3.14Å; G45-C58 PolarHBondContact N-SG 3.39Å; G45-C58 VanDerWaalsContact N-SG 3.39Å; C58-C65 CarbonylContact O-C 3.46Å; C58-C65 WeakPolarHBondContact O-CA 3.46Å; C58-F66 HydrophobicContact CB-CB 4.28Å; C58-F66 PolarHBondContact N-O 3.17Å; C58-F66 WeakPolarHBondContact O-CB 3.42Å; C58-F66 PolarHBondContact O-N 2.86Å; C58-A72 HydrophobicContact CB-CB 3.83Å
59	C	97.9	Very high	95.9	Very high	4 Å²	4	52.9 Å²	52.9	3%	0.027	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	137.9	178.8	-61.5	0	0	0	0	111.6	G50 R51 F53 G64 C65 A99 V100	G50-C59 CarbonylContact C-O 3.59Å; G50-C59 WeakPolarHBondContact CA-O 2.98Å; R51-C59 PolarHBondContact N-O 2.89Å; R51-C59 PolarHBondContact O-N 2.04Å; F53-C59 HydrophobicContact CD2-CB 3.71Å; F53-C59 HydrophobicContact CE2-CB 3.71Å; C59-G64 CarbonylContact C-O 3.48Å; C59-G64 WeakPolarHBondContact CA-O 3.37Å; C59-C65 HydrophobicContact CB-CB 4.14Å; C59-C65 WeakPolarHBondContact CB-SG 3.45Å; C59-C65 WeakPolarHBondContact SG-CB 3.21Å; C59-C65 CovalentContact SG-SG 2.03Å; C59-C65 PolarHBondContact SG-SG 3.25Å; C59-A99 HydrophobicContact CB-CB 3.74Å; C59-A99 VanDerWaalsContact SG-CB 3.53Å; C59-V100 HydrophobicContact CB-CG1 4.35Å
60	A	94.9	Very high	96	Very high	8 Å²	8	49.7 Å²	49.7	7%	0.066	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	132.7	173.9	0	0	0	0	0	109.2	E62 L63 G64 V100	A60-E62 PolarHBondContact O-N 3.29Å; A60-E62 VanDerWaalsContact O-N 3.11Å; A60-L63 HydrophobicContact CB-CB 4.09Å; A60-L63 HydrophobicContact CB-CD1 4.23Å; A60-L63 HydrophobicContact CB-CG 4.31Å; A60-L63 PolarHBondContact O-N 3.32Å; A60-G64 PolarHBondContact N-O 3.09Å; A60-G64 PolarHBondContact O-N 3.38Å; A60-V100 WeakPolarHBondContact O-CG1 3.29Å
61	E	89.4	Confident	96	Very high	162 Å²	162	52.9 Å²	52.9	76%	0.757	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-38.1	-172	-165	154.4	-167.5	0	0	113.7
62	E	89.1	Confident	96	Very high	158 Å²	158	48.5 Å²	48.5	74%	0.738	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-16.5	178.9	-60.3	179.8	161.4	0	0	114.5	K49 A60	K49-E62 IonicContact NZ-OE2 2.79Å; A60-E62 PolarHBondContact O-N 3.29Å; A60-E62 VanDerWaalsContact O-N 3.11Å
63	L	90.8	Very high	95.9	Very high	81 Å²	81	53.2 Å²	53.2	42%	0.424	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-8	-172.3	-54.3	173.2	0	0	0	113.6	P46 A60 F66	P46-L63 HydrophobicContact CB-CD1 4.24Å; P46-L63 HydrophobicContact CG-CD1 4.03Å; A60-L63 HydrophobicContact CB-CB 4.09Å; A60-L63 HydrophobicContact CB-CD1 4.23Å; A60-L63 HydrophobicContact CB-CG 4.31Å; A60-L63 PolarHBondContact O-N 3.32Å; L63-F66 HydrophobicContact CB-CE2 3.81Å; L63-F66 HydrophobicContact CB-CZ 3.99Å; L63-F66 HydrophobicContact CD1-CE2 4.34Å
64	G	94.7	Very high	95.9	Very high	23 Å²	23	57.2 Å²	57.2	24%	0.237	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	80.1	-153.1	-173.4	0	0	0	0	0	112.7	C59 A60	C59-G64 CarbonylContact C-O 3.48Å; C59-G64 WeakPolarHBondContact CA-O 3.37Å; A60-G64 PolarHBondContact N-O 3.09Å; A60-G64 PolarHBondContact O-N 3.38Å
65	C	97.4	Very high	96	Very high	35 Å²	35	56.7 Å²	56.7	24%	0.236	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.2	-178.8	-70.1	0	0	0	0	112.1	C58 C59 L103 C105	C58-C65 CarbonylContact O-C 3.46Å; C58-C65 WeakPolarHBondContact O-CA 3.46Å; C59-C65 HydrophobicContact CB-CB 4.14Å; C59-C65 WeakPolarHBondContact CB-SG 3.45Å; C59-C65 WeakPolarHBondContact SG-CB 3.21Å; C59-C65 CovalentContact SG-SG 2.03Å; C59-C65 PolarHBondContact SG-SG 3.25Å; C65-L103 HydrophobicContact CB-CD2 3.85Å; C65-L103 VanDerWaalsContact SG-CD2 3.55Å; C65-C105 VanDerWaalsContact SG-SG 3.69Å
66	F	97.3	Very high	96	Very high	47 Å²	47	58.6 Å²	58.6	21%	0.206	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	108.5	178.2	-64.4	-76.9	0	0	0	108.3	C58 L63 T69 E71	C58-F66 HydrophobicContact CB-CB 4.28Å; C58-F66 PolarHBondContact N-O 3.17Å; C58-F66 WeakPolarHBondContact O-CB 3.42Å; C58-F66 PolarHBondContact O-N 2.86Å; L63-F66 HydrophobicContact CB-CE2 3.81Å; L63-F66 HydrophobicContact CB-CZ 3.99Å; L63-F66 HydrophobicContact CD1-CE2 4.34Å; F66-T69 WeakPolarHBondContact CB-OG1 3.24Å; F66-E71 HydrophobicContact CB-CB 3.9Å; F66-E71 HydrophobicContact CD1-CB 4.14Å; F66-E71 HydrophobicContact CD1-CG 3.88Å; F66-E71 HydrophobicContact CD2-CB 4.1Å; F66-E71 HydrophobicContact CD2-CG 4.32Å; F66-E71 HydrophobicContact CE1-CG 4.09Å; F66-E71 HydrophobicContact CG-CB 3.79Å; F66-E71 HydrophobicContact CG-CG 4.01Å; F66-E71 HydrophobicContact CZ-CG 4.41Å
67	V	97.3	Very high	96	Very high	81 Å²	81	59.7 Å²	59.7	49%	0.491	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	117.9	-176.2	-177	0	0	0	0	109.5	N56 I57 T69	N56-V67 WeakPolarHBondContact O-CA 3.12Å; I57-V67 HydrophobicContact CG1-CG1 4.27Å; I57-V67 HydrophobicContact CG1-CG2 4.42Å; I57-V67 HydrophobicContact CG2-CG2 4.34Å; V67-T69 PolarHBondContact O-N 3.1Å
68	G	96.3	Very high	95.9	Very high	62 Å²	62	60.7 Å²	60.7	64%	0.639	33%	0.333	S	S	*	.	S	Bend	trans	68.2	18.3	-180	0	0	0	0	0	114.6	N56	N56-G68 PolarHBondContact O-N 3.18Å
69	T	97	Very high	95.7	Very high	57 Å²	57	66 Å²	66	35%	0.35	36%	0.361	S	S	.	.	S	Bend	trans	-104.7	174.5	179.3	70.6	0	0	0	0	111.9	F66 V67 E71 A72	F66-T69 WeakPolarHBondContact CB-OG1 3.24Å; V67-T69 PolarHBondContact O-N 3.1Å; T69-E71 WeakPolarHBondContact CB-OE2 3.38Å; T69-E71 PolarHBondContact O-N 2.81Å; T69-E71 PolarHBondContact OG1-OE2 3.17Å; T69-A72 PolarHBondContact O-N 3.39Å
70	A	97	Very high	95.6	Very high	72 Å²	72	74.9 Å²	74.9	60%	0.595	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-61.5	-32.2	-177.1	0	0	0	0	0	112.8	A72 L73	A70-A72 PolarHBondContact O-N 2.84Å; A70-L73 HydrophobicContact CB-CD1 4.26Å; A70-L73 WeakPolarHBondContact O-CB 3.26Å; A70-L73 WeakPolarHBondContact O-CG 3.06Å; A70-L73 PolarHBondContact O-N 2.86Å
71	E	97.5	Very high	95.5	Very high	68 Å²	68	78 Å²	78	32%	0.318	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-61.5	-26.3	179.6	-65.8	74.8	-159.4	0	0	112.8	G45 P46 F66 T69	G45-E71 PolarHBondContact N-O 2.91Å; G45-E71 VanDerWaalsContact N-O 3.14Å; P46-E71 HydrophobicContact CG-CG 4.45Å; F66-E71 HydrophobicContact CB-CB 3.9Å; F66-E71 HydrophobicContact CD1-CB 4.14Å; F66-E71 HydrophobicContact CD1-CG 3.88Å; F66-E71 HydrophobicContact CD2-CB 4.1Å; F66-E71 HydrophobicContact CD2-CG 4.32Å; F66-E71 HydrophobicContact CE1-CG 4.09Å; F66-E71 HydrophobicContact CG-CB 3.79Å; F66-E71 HydrophobicContact CG-CG 4.01Å; F66-E71 HydrophobicContact CZ-CG 4.41Å; T69-E71 WeakPolarHBondContact CB-OE2 3.38Å; T69-E71 PolarHBondContact O-N 2.81Å; T69-E71 PolarHBondContact OG1-OE2 3.17Å
72	A	97.8	Very high	95.5	Very high	1 Å²	1	76.7 Å²	76.7	1%	0.008	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-96.2	-4.5	-179.1	0	0	0	0	0	114	C58 T69 A70 R74 C75	C58-A72 HydrophobicContact CB-CB 3.83Å; T69-A72 PolarHBondContact O-N 3.39Å; A70-A72 PolarHBondContact O-N 2.84Å; A72-R74 PolarHBondContact O-N 2.85Å; A72-C75 WeakPolarHBondContact O-CB 3.38Å; A72-C75 PolarHBondContact O-N 2.03Å
73	L	96.8	Very high	95.5	Very high	103 Å²	103	71.8 Å²	71.8	54%	0.539	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-57.1	-37.5	-177.4	-73.7	172.2	0	0	0	112.8	A70 C75 Q76	A70-L73 HydrophobicContact CB-CD1 4.26Å; A70-L73 WeakPolarHBondContact O-CB 3.26Å; A70-L73 WeakPolarHBondContact O-CG 3.06Å; A70-L73 PolarHBondContact O-N 2.86Å; L73-C75 PolarHBondContact O-N 3.15Å; L73-Q76 WeakPolarHBondContact O-CB 3.43Å; L73-Q76 PolarHBondContact O-N 3.4Å
74	R	96.8	Very high	95.5	Very high	111 Å²	111	72 Å²	72	42%	0.419	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-62	-24.8	176.8	-168.2	176.6	175.9	-169.4	4.8	112.8	P43 A72 Q76 E77	P43-R74 WeakPolarHBondContact O-CD 3.3Å; P43-R74 PolarHBondContact O-NH1 2.74Å; P43-R74 VanDerWaalsContact O-NH1 3.1Å; A72-R74 PolarHBondContact O-N 2.85Å; R74-Q76 PolarHBondContact O-N 2.94Å; R74-E77 HydrophobicContact CG-CG 4.48Å; R74-E77 WeakPolarHBondContact CG-OE2 3.43Å; R74-E77 IonicContact NE-OE2 3.62Å; R74-E77 WeakPolarHBondContact O-CB 3.46Å; R74-E77 WeakPolarHBondContact O-CG 3.34Å; R74-E77 PolarHBondContact O-N 3.06Å
75	C	97.8	Very high	95.5	Very high	0 Å²	0	72.7 Å²	72.7	0%	0	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-67.7	-16.3	179.5	-60.3	0	0	0	0	113.5	C52 G54 P55 A72 L73 E77 E78	C52-C75 WeakPolarHBondContact CA-SG 3.04Å; C52-C75 HydrophobicContact CB-CB 3.61Å; C52-C75 WeakPolarHBondContact CB-SG 3.18Å; C52-C75 WeakPolarHBondContact SG-CA 3.39Å; C52-C75 WeakPolarHBondContact SG-CB 3.35Å; C52-C75 CovalentContact SG-SG 2.04Å; C52-C75 PolarHBondContact SG-SG 2.96Å; G54-C75 WeakPolarHBondContact O-CB 3.07Å; P55-C75 CarbonylContact O-C 3.55Å; A72-C75 WeakPolarHBondContact O-CB 3.38Å; A72-C75 PolarHBondContact O-N 2.03Å; L73-C75 PolarHBondContact O-N 3.15Å; C75-E77 PolarHBondContact O-N 3.43Å; C75-E78 WeakPolarHBondContact O-CB 3.11Å; C75-E78 PolarHBondContact O-N 2.94Å
76	Q	97.1	Very high	95.3	Very high	79 Å²	79	75.3 Å²	75.3	37%	0.369	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-65.9	-24.6	170.7	-62.1	-178.5	17.5	0	0	112.2	P55 N56 L73 R74 E78 N79	P55-Q76 VanDerWaalsContact O-CG 3.27Å; P55-Q76 WeakPolarHBondContact O-CG 3.41Å; P55-Q76 PolarHBondContact O-N 2.96Å; N56-Q76 PolarHBondContact OD1-NE2 3.18Å; N56-Q76 VanDerWaalsContact OD1-NE2 3.1Å; L73-Q76 WeakPolarHBondContact O-CB 3.43Å; L73-Q76 PolarHBondContact O-N 3.4Å; R74-Q76 PolarHBondContact O-N 2.94Å; Q76-E78 PolarHBondContact O-N 2.74Å; Q76-N79 WeakPolarHBondContact O-CB 3.41Å; Q76-N79 PolarHBondContact O-N 3.39Å; Q76-N79 VanDerWaalsContact O-N 3.14Å; Q76-N79 PolarHBondContact O-ND2 2.05Å
77	E	96.6	Very high	95.1	Very high	96 Å²	96	73.6 Å²	73.6	45%	0.449	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-61.6	-27.6	176.3	-64.8	175.7	-176.3	0	0	112.1	L42 R74 C75 N79 Y80	L42-E77 HydrophobicContact CD1-CB 3.62Å; R74-E77 HydrophobicContact CG-CG 4.48Å; R74-E77 WeakPolarHBondContact CG-OE2 3.43Å; R74-E77 IonicContact NE-OE2 3.62Å; R74-E77 WeakPolarHBondContact O-CB 3.46Å; R74-E77 WeakPolarHBondContact O-CG 3.34Å; R74-E77 PolarHBondContact O-N 3.06Å; C75-E77 PolarHBondContact O-N 3.43Å; E77-N79 PolarHBondContact O-N 3.18Å; E77-Y80 PolarHBondContact O-N 2.71Å; E77-Y80 VanDerWaalsContact O-N 3.11Å
78	E	96.7	Very high	94.8	Very high	26 Å²	26	70.8 Å²	70.8	12%	0.121	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-58.5	-31.8	175.8	-79.7	-68	175.3	0	0	112.7	R39 C41 L42 C52 C75 Q76 Y80 L81 C85	R39-E78 IonicContact CZ-OE1 3.33Å; R39-E78 IonicContact CZ-OE2 3.8Å; R39-E78 IonicContact NH1-OE1 3.15Å; R39-E78 PolarHBondContact NH1-OE1 3.11Å; R39-E78 IonicContact NH1-OE2 2.65Å; R39-E78 PolarHBondContact NH1-OE2 3.11Å; R39-E78 VanDerWaalsContact NH1-OE2 3.15Å; R39-E78 IonicContact NH2-OE1 3.98Å; R39-E78 IonicContact NH2-OE2 3.73Å; R39-E78 PolarHBondContact NH2-OE2 3.15Å; C41-E78 WeakPolarHBondContact CA-OE1 3.48Å; C41-E78 HydrophobicContact CB-CG 4.48Å; C41-E78 WeakPolarHBondContact CB-OE1 3.5Å; L42-E78 HydrophobicContact CB-CG 4.36Å; L42-E78 HydrophobicContact CD1-CG 4.12Å; L42-E78 HydrophobicContact CG-CG 4.24Å; L42-E78 WeakPolarHBondContact CG-OE1 3.01Å; L42-E78 PolarHBondContact N-OE1 2.85Å; C52-E78 HydrophobicContact CB-CG 4.43Å; C75-E78 WeakPolarHBondContact O-CB 3.11Å; C75-E78 PolarHBondContact O-N 2.94Å; Q76-E78 PolarHBondContact O-N 2.74Å; E78-Y80 PolarHBondContact O-N 3.25Å; E78-Y80 VanDerWaalsContact O-N 3.15Å; E78-L81 PolarHBondContact O-N 2.04Å; E78-L81 VanDerWaalsContact O-N 3.09Å; E78-C85 PolarHBondContact OE1-SG 2.95Å; E78-C85 VanDerWaalsContact OE1-SG 3.39Å; E78-C85 PolarHBondContact OE2-SG 3.19Å; E78-C85 VanDerWaalsContact OE2-SG 3.38Å
79	N	94.2	Very high	94.3	Very high	111 Å²	111	75.7 Å²	75.7	59%	0.594	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-65.5	-19.4	-179.9	-62.9	-41.7	0	0	0	113.2	Q76 E77	Q76-N79 WeakPolarHBondContact O-CB 3.41Å; Q76-N79 PolarHBondContact O-N 3.39Å; Q76-N79 VanDerWaalsContact O-N 3.14Å; Q76-N79 PolarHBondContact O-ND2 2.05Å; E77-N79 PolarHBondContact O-N 3.18Å
80	Y	95.3	Very high	94	Very high	192 Å²	192	77.4 Å²	77.4	75%	0.753	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-97.3	-6.7	179.3	-53.8	-71.1	0	0	0	112.6	E77 E78	E77-Y80 PolarHBondContact O-N 2.71Å; E77-Y80 VanDerWaalsContact O-N 3.11Å; E78-Y80 PolarHBondContact O-N 3.25Å; E78-Y80 VanDerWaalsContact O-N 3.15Å
81	L	92.3	Very high	93.9	Very high	72 Å²	72	77.3 Å²	77.3	38%	0.377	40%	0.404	S	S	.	.			trans	-88.1	121.7	179.1	-64.5	-179.7	0	0	0	110	R39 L42 E78 S83	R39-L81 VanDerWaalsContact NH2-CB 3.28Å; R39-L81 VanDerWaalsContact NH2-CD1 3.34Å; L42-L81 HydrophobicContact CD1-CD1 4.03Å; L42-L81 HydrophobicContact CD2-CD1 4.35Å; L42-L81 HydrophobicContact CG-CD1 4.12Å; E78-L81 PolarHBondContact O-N 2.04Å; E78-L81 VanDerWaalsContact O-N 3.09Å; L81-S83 PolarHBondContact O-N 2.85Å
82	P	89.9	Confident	93.8	Very high	136 Å²	136	74.5 Å²	74.5	88%	0.883	39%	0.393	S	S	*	.	S	Bend	trans	-74.5	-14.1	-177.3	29.9	-35.9	0	0	0	113.3
83	S	89	Confident	93.5	Very high	55 Å²	55	77.2 Å²	77.2	39%	0.385	42%	0.42	S	S	.	.	S	Bend	trans	-89.1	132	178.9	51	0	0	0	0	110.5	R39 L81	R39-S83 PolarHBondContact NE-O 3.21Å; R39-S83 PolarHBondContact NE-OG 3.29Å; R39-S83 PolarHBondContact NH2-O 3.24Å; L81-S83 PolarHBondContact O-N 2.85Å
84	P	90.5	Very high	93.1	Very high	85 Å²	85	78.1 Å²	78.1	55%	0.552	44%	0.435	S	S	*	.			trans	-65.4	149.2	177.7	29.3	-35.1	0	0	0	110.5	R39	R39-P84 VanDerWaalsContact CG-O 3.26Å; R39-P84 WeakPolarHBondContact CG-O 3.22Å
85	C	94	Very high	92.7	Very high	37 Å²	37	76.3 Å²	76.3	25%	0.25	45%	0.451	C	S	.	.	B	Isolated β-bridge	trans	-132.8	160	175.3	79.3	0	0	0	0	111.4	V38 R39 C41 E78	V38-C85 VanDerWaalsContact CG1-C 3.47Å; R39-C85 HydrophobicContact CG-CB 3.91Å; R39-C85 CarbonylContact O-C 3.44Å; R39-C85 WeakPolarHBondContact O-CA 3.48Å; R39-C85 WeakPolarHBondContact O-CB 3.41Å; C41-C85 VanDerWaalsContact CA-SG 3.51Å; C41-C85 HydrophobicContact CB-CB 3.87Å; C41-C85 WeakPolarHBondContact CB-SG 3.4Å; C41-C85 WeakPolarHBondContact SG-CB 3.45Å; C41-C85 CovalentContact SG-SG 2.05Å; C41-C85 PolarHBondContact SG-SG 3.1Å; E78-C85 PolarHBondContact OE1-SG 2.95Å; E78-C85 VanDerWaalsContact OE1-SG 3.39Å; E78-C85 PolarHBondContact OE2-SG 3.19Å; E78-C85 VanDerWaalsContact OE2-SG 3.38Å
86	Q	93.7	Very high	92.5	Very high	91 Å²	91	76.5 Å²	76.5	43%	0.425	45%	0.453	S	S	.	.			trans	-147.5	139.5	174	-171.6	168.9	72.6	0	0	111.5	V38 R39 K40 C41 R97	V38-Q86 HydrophobicContact CG1-CB 3.8Å; R39-Q86 PolarHBondContact O-N 3.14Å; K40-Q86 WeakPolarHBondContact CA-O 3.49Å; C41-Q86 PolarHBondContact SG-N 3.28Å; C41-Q86 VanDerWaalsContact SG-N 3.39Å; Q86-R97 VanDerWaalsContact CD-CD 3.45Å; Q86-R97 VanDerWaalsContact CD-NH1 3.31Å; Q86-R97 VanDerWaalsContact CG-CD 3.41Å; Q86-R97 VanDerWaalsContact OE1-NH1 3.14Å
87	S	94.3	Very high	92.5	Very high	10 Å²	10	75.1 Å²	75.1	7%	0.07	44%	0.444	C	S	.	.			trans	-116.9	154.3	174.4	-60.8	0	0	0	0	110.4	C41 C52 F53 R97	C41-S87 WeakPolarHBondContact CB-OG 3.27Å; C52-S87 WeakPolarHBondContact O-CB 3.37Å; C52-S87 PolarHBondContact O-OG 3.39Å; F53-S87 WeakPolarHBondContact CE1-O 3Å; F53-S87 VanDerWaalsContact CZ-CB 3.47Å; S87-R97 WeakPolarHBondContact O-CD 3.16Å; S87-R97 PolarHBondContact O-NE 2.96Å
88	G	91.2	Very high	92.5	Very high	23 Å²	23	71.5 Å²	71.5	24%	0.237	43%	0.429	C	S	.	.			trans	78	144.1	-176.6	0	0	0	0	0	113.2	R97	G88-R97 VanDerWaalsContact O-CZ 3.25Å; G88-R97 PolarHBondContact O-NE 3.13Å; G88-R97 PolarHBondContact O-NH2 3.24Å
89	Q	83.9	Confident	92.4	Very high	165 Å²	165	71 Å²	71	77%	0.771	43%	0.43	S	S	*	.	S	Bend	trans	-95.1	-38.7	-176.8	-66.9	-64.2	-53.1	0	0	112.7	R97	Q89-R97 VanDerWaalsContact C-NH2 3.35Å; Q89-R97 PolarHBondContact O-NH2 3Å
90	K	92.1	Very high	92.4	Very high	93 Å²	93	66.7 Å²	66.7	40%	0.404	41%	0.407	S	S	.	.	S	Bend	trans	-94.6	126.2	-176.8	-170.5	176	-174.8	178.6	0	110.1	R97 C98 A115	K90-R97 CarbonylContact O-C 3.58Å; K90-R97 VanDerWaalsContact O-CA 3.31Å; K90-R97 WeakPolarHBondContact O-CA 3.5Å; K90-C98 HydrophobicContact CB-CB 4.2Å; K90-C98 PolarHBondContact O-N 2.88Å; K90-A115 WeakPolarHBondContact CD-O 3.06Å; K90-A115 WeakPolarHBondContact CE-O 3.05Å; K90-A115 PolarHBondContact NZ-O 3.36Å
91	A	94.3	Very high	92.3	Very high	69 Å²	69	64 Å²	64	57%	0.57	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	148.5	171	0	0	0	0	0	110.5
92	C	95.3	Very high	92.4	Very high	10 Å²	10	61.2 Å²	61.2	7%	0.068	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	158.9	179.7	56.2	0	0	0	0	110.4	G96 R97 C98 C104 D113	C92-G96 PolarHBondContact N-O 3.28Å; C92-G96 CarbonylContact O-C 3.32Å; C92-G96 VanDerWaalsContact O-CA 3.31Å; C92-G96 WeakPolarHBondContact O-CA 3.26Å; C92-G96 PolarHBondContact O-N 3.47Å; C92-G96 VanDerWaalsContact SG-C 3.52Å; C92-R97 WeakPolarHBondContact SG-CA 3.12Å; C92-R97 PolarHBondContact SG-N 3.16Å; C92-R97 VanDerWaalsContact SG-N 3.36Å; C92-C98 PolarHBondContact SG-N 3.12Å; C92-C98 VanDerWaalsContact SG-N 3.36Å; C92-C104 HydrophobicContact CB-CB 3.78Å; C92-C104 WeakPolarHBondContact CB-SG 3.22Å; C92-C104 PolarHBondContact O-SG 2.87Å; C92-C104 WeakPolarHBondContact SG-CA 3.42Å; C92-C104 WeakPolarHBondContact SG-CB 3.31Å; C92-C104 CovalentContact SG-SG 2.02Å; C92-C104 PolarHBondContact SG-SG 2.84Å; C92-D113 WeakPolarHBondContact CB-OD2 3.42Å
93	G	91.4	Very high	92.6	Very high	57 Å²	57	56.8 Å²	56.8	59%	0.588	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	-146	-178.7	0	0	0	0	0	114.9	G95	G93-G95 PolarHBondContact O-N 3.4Å
94	S	88.2	Confident	93	Very high	123 Å²	123	54.2 Å²	54.2	86%	0.86	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	79.5	177.9	58.2	0	0	0	0	111.5
95	G	88.9	Confident	93.3	Very high	72 Å²	72	50.3 Å²	50.3	74%	0.742	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	15.1	177.9	0	0	0	0	0	114.7	G93	G93-G95 PolarHBondContact O-N 3.4Å
96	G	94.8	Very high	93.3	Very high	4 Å²	4	49.8 Å²	49.8	4%	0.041	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	171.2	171.8	0	0	0	0	0	112.4	C92 C105	C92-G96 PolarHBondContact N-O 3.28Å; C92-G96 CarbonylContact O-C 3.32Å; C92-G96 VanDerWaalsContact O-CA 3.31Å; C92-G96 WeakPolarHBondContact O-CA 3.26Å; C92-G96 PolarHBondContact O-N 3.47Å; C92-G96 VanDerWaalsContact SG-C 3.52Å; G96-C105 CarbonylContact C-O 3.59Å; G96-C105 WeakPolarHBondContact CA-O 3.05Å
97	R	95.6	Very high	93.3	Very high	50 Å²	50	49 Å²	49	19%	0.189	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	146.5	174.5	-58.5	-175.8	72.7	92.9	-2.1	110.1	F53 Q86 S87 G88 Q89 K90 C92 A99 C105	F53-R97 HydrophobicContact CE1-CB 4.3Å; Q86-R97 VanDerWaalsContact CD-CD 3.45Å; Q86-R97 VanDerWaalsContact CD-NH1 3.31Å; Q86-R97 VanDerWaalsContact CG-CD 3.41Å; Q86-R97 VanDerWaalsContact OE1-NH1 3.14Å; S87-R97 WeakPolarHBondContact O-CD 3.16Å; S87-R97 PolarHBondContact O-NE 2.96Å; G88-R97 VanDerWaalsContact O-CZ 3.25Å; G88-R97 PolarHBondContact O-NE 3.13Å; G88-R97 PolarHBondContact O-NH2 3.24Å; Q89-R97 VanDerWaalsContact C-NH2 3.35Å; Q89-R97 PolarHBondContact O-NH2 3Å; K90-R97 CarbonylContact O-C 3.58Å; K90-R97 VanDerWaalsContact O-CA 3.31Å; K90-R97 WeakPolarHBondContact O-CA 3.5Å; C92-R97 WeakPolarHBondContact SG-CA 3.12Å; C92-R97 PolarHBondContact SG-N 3.16Å; C92-R97 VanDerWaalsContact SG-N 3.36Å; R97-A99 PolarHBondContact O-N 2.86Å; R97-A99 VanDerWaalsContact O-N 3.12Å; R97-C105 PolarHBondContact N-O 3.36Å; R97-C105 PolarHBondContact O-N 3.36Å
98	C	96.1	Very high	93.1	Very high	20 Å²	20	56 Å²	56	14%	0.135	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	115.6	178.9	-62.3	0	0	0	0	108.9	K90 C92 C116	K90-C98 HydrophobicContact CB-CB 4.2Å; K90-C98 PolarHBondContact O-N 2.88Å; C92-C98 PolarHBondContact SG-N 3.12Å; C92-C98 VanDerWaalsContact SG-N 3.36Å; C98-C116 WeakPolarHBondContact CA-SG 3Å; C98-C116 HydrophobicContact CB-CB 3.61Å; C98-C116 WeakPolarHBondContact CB-SG 3.34Å; C98-C116 WeakPolarHBondContact SG-CA 3.02Å; C98-C116 WeakPolarHBondContact SG-CB 3.34Å; C98-C116 CovalentContact SG-SG 2.04Å; C98-C116 PolarHBondContact SG-SG 3.16Å
99	A	95.6	Very high	93.3	Very high	16 Å²	16	56 Å²	56	13%	0.132	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-41.4	-174	0	0	0	0	0	111.8	F53 C59 R97 L103 C105	F53-A99 HydrophobicContact CD1-CB 3.92Å; F53-A99 HydrophobicContact CD2-CB 4.12Å; F53-A99 HydrophobicContact CE1-CB 3.6Å; F53-A99 HydrophobicContact CE2-CB 3.85Å; F53-A99 HydrophobicContact CG-CB 4.18Å; F53-A99 VanDerWaalsContact CZ-CA 3.47Å; F53-A99 HydrophobicContact CZ-CB 3.58Å; C59-A99 HydrophobicContact CB-CB 3.74Å; C59-A99 VanDerWaalsContact SG-CB 3.53Å; R97-A99 PolarHBondContact O-N 2.86Å; R97-A99 VanDerWaalsContact O-N 3.12Å; A99-L103 PolarHBondContact N-O 2.86Å; A99-C105 HydrophobicContact CB-CB 3.92Å; A99-C105 WeakPolarHBondContact CB-SG 3.31Å
100	V	94.4	Very high	93.9	Very high	20 Å²	20	50.1 Å²	50.1	12%	0.121	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	177	172.1	-60.9	0	0	0	0	108.5	C59 A60 G102 L103	C59-V100 HydrophobicContact CB-CG1 4.35Å; A60-V100 WeakPolarHBondContact O-CG1 3.29Å; V100-G102 PolarHBondContact O-N 2.88Å; V100-L103 HydrophobicContact CG2-CB 3.62Å; V100-L103 HydrophobicContact CG2-CD2 4.05Å; V100-L103 HydrophobicContact CG2-CG 4.49Å; V100-L103 PolarHBondContact O-N 2.79Å; V100-L103 VanDerWaalsContact O-N 3.13Å
101	F	92.9	Very high	94	Very high	137 Å²	137	50 Å²	50	60%	0.601	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	124.7	177.8	-179.2	-99.4	0	0	0	112.2	L103 D117 M118	F101-L103 PolarHBondContact O-N 3.35Å; F101-L103 VanDerWaalsContact O-N 3.16Å; F101-D117 HydrophobicContact CE2-CB 3.86Å; F101-D117 HydrophobicContact CZ-CB 4.03Å; F101-D117 WeakPolarHBondContact CZ-OD1 3.3Å; F101-M118 HydrophobicContact CD2-CB 4.49Å; F101-M118 HydrophobicContact CD2-CG 3.47Å; F101-M118 VanDerWaalsContact CD2-CG 3.47Å; F101-M118 HydrophobicContact CD2-SD 4.39Å; F101-M118 HydrophobicContact CE2-CB 4.33Å; F101-M118 HydrophobicContact CE2-CG 3.7Å
102	G	93.5	Very high	94.1	Very high	13 Å²	13	50.7 Å²	50.7	13%	0.134	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	11.1	176.7	0	0	0	0	0	115.5	V100 A112 D113 C116 D117	V100-G102 PolarHBondContact O-N 2.88Å; G102-A112 CarbonylContact O-C 3.51Å; G102-A112 VanDerWaalsContact O-CA 3.3Å; G102-A112 WeakPolarHBondContact O-CA 2.91Å; G102-D113 CarbonylContact C-O 3.46Å; G102-D113 PolarHBondContact O-N 2.88Å; G102-C116 PolarHBondContact N-O 2.91Å; G102-C116 VanDerWaalsContact N-O 3.12Å; G102-D117 WeakPolarHBondContact CA-OD1 3.04Å; G102-D117 PolarHBondContact N-OD1 2.91Å
103	L	95.2	Very high	94.1	Very high	43 Å²	43	51.5 Å²	51.5	23%	0.225	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	118.7	-177	-151.6	79.5	0	0	0	112.4	C65 A99 V100 F101 C110 H111	C65-L103 HydrophobicContact CB-CD2 3.85Å; C65-L103 VanDerWaalsContact SG-CD2 3.55Å; A99-L103 PolarHBondContact N-O 2.86Å; V100-L103 HydrophobicContact CG2-CB 3.62Å; V100-L103 HydrophobicContact CG2-CD2 4.05Å; V100-L103 HydrophobicContact CG2-CG 4.49Å; V100-L103 PolarHBondContact O-N 2.79Å; V100-L103 VanDerWaalsContact O-N 3.13Å; F101-L103 PolarHBondContact O-N 3.35Å; F101-L103 VanDerWaalsContact O-N 3.16Å; L103-C110 HydrophobicContact CD2-CB 3.85Å; L103-C110 HydrophobicContact CG-CB 4.13Å; L103-H111 WeakPolarHBondContact CD1-O 3.43Å
104	C	96.8	Very high	94.1	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.8	173.5	-174.1	0	0	0	0	110.4	C92 C110 H111 D113	C92-C104 HydrophobicContact CB-CB 3.78Å; C92-C104 WeakPolarHBondContact CB-SG 3.22Å; C92-C104 PolarHBondContact O-SG 2.87Å; C92-C104 WeakPolarHBondContact SG-CA 3.42Å; C92-C104 WeakPolarHBondContact SG-CB 3.31Å; C92-C104 CovalentContact SG-SG 2.02Å; C92-C104 PolarHBondContact SG-SG 2.84Å; C104-C110 CarbonylContact O-C 3.56Å; C104-C110 VanDerWaalsContact O-CA 3.26Å; C104-C110 WeakPolarHBondContact O-CA 3.48Å; C104-H111 PolarHBondContact N-O 3.37Å; C104-H111 PolarHBondContact O-N 3.02Å; C104-H111 PolarHBondContact O-ND1 2.04Å; C104-D113 HydrophobicContact CB-CB 3.52Å
105	C	97.4	Very high	94.2	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.02	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136.5	178.2	-63.1	0	0	0	0	112	F53 C65 G96 R97 A99 G109 C110	F53-C105 HydrophobicContact CB-CB 4.08Å; F53-C105 HydrophobicContact CD1-CB 4.04Å; F53-C105 HydrophobicContact CG-CB 4.23Å; C65-C105 VanDerWaalsContact SG-SG 3.69Å; G96-C105 CarbonylContact C-O 3.59Å; G96-C105 WeakPolarHBondContact CA-O 3.05Å; R97-C105 PolarHBondContact N-O 3.36Å; R97-C105 PolarHBondContact O-N 3.36Å; A99-C105 HydrophobicContact CB-CB 3.92Å; A99-C105 WeakPolarHBondContact CB-SG 3.31Å; C105-G109 WeakPolarHBondContact CA-O 3.45Å; C105-C110 HydrophobicContact CB-CB 4.11Å; C105-C110 WeakPolarHBondContact CB-SG 3.36Å; C105-C110 WeakPolarHBondContact SG-CB 3.39Å; C105-C110 CovalentContact SG-SG 2.04Å; C105-C110 PolarHBondContact SG-SG 3.46Å
106	S	94.9	Very high	94.4	Very high	27 Å²	27	46.9 Å²	46.9	19%	0.189	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	172.3	164.2	71.1	0	0	0	0	109.2	I57 D108 G109	I57-S106 WeakPolarHBondContact CD1-O 3.19Å; S106-D108 PolarHBondContact O-N 2.02Å; S106-D108 PolarHBondContact OG-N 2.98Å; S106-G109 PolarHBondContact N-O 2.78Å; S106-G109 PolarHBondContact O-N 2.94Å; S106-G109 VanDerWaalsContact O-O 3.14Å; S106-G109 PolarHBondContact OG-O 3.4Å
107	P	92.7	Very high	94.2	Very high	75 Å²	75	49.7 Å²	49.7	49%	0.487	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-22.9	175.2	-27.2	36.7	0	0	0	114.4	F53	F53-P107 WeakPolarHBondContact O-CA 3.5Å
108	D	90.4	Very high	92.9	Very high	157 Å²	157	54 Å²	54	84%	0.84	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-19.5	-176.5	-54.1	-48.6	0	0	0	113.3	S106	S106-D108 PolarHBondContact O-N 2.02Å; S106-D108 PolarHBondContact OG-N 2.98Å
109	G	94.4	Very high	90.9	Very high	22 Å²	22	61.3 Å²	61.3	23%	0.227	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165	178.4	-179	0	0	0	0	0	114.3	C105 S106	C105-G109 WeakPolarHBondContact CA-O 3.45Å; S106-G109 PolarHBondContact N-O 2.78Å; S106-G109 PolarHBondContact O-N 2.94Å; S106-G109 VanDerWaalsContact O-O 3.14Å; S106-G109 PolarHBondContact OG-O 3.4Å
110	C	96.3	Very high	88.8	Confident	41 Å²	41	64.5 Å²	64.5	28%	0.277	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	146.6	177.2	-59.3	0	0	0	0	110.7	L103 C104 C105	L103-C110 HydrophobicContact CD2-CB 3.85Å; L103-C110 HydrophobicContact CG-CB 4.13Å; C104-C110 CarbonylContact O-C 3.56Å; C104-C110 VanDerWaalsContact O-CA 3.26Å; C104-C110 WeakPolarHBondContact O-CA 3.48Å; C105-C110 HydrophobicContact CB-CB 4.11Å; C105-C110 WeakPolarHBondContact CB-SG 3.36Å; C105-C110 WeakPolarHBondContact SG-CB 3.39Å; C105-C110 CovalentContact SG-SG 2.04Å; C105-C110 PolarHBondContact SG-SG 3.46Å
111	H	95.9	Very high	86.6	Confident	90 Å²	90	69.6 Å²	69.6	42%	0.417	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	155.4	173.7	61.8	-75.6	0	0	0	110.1	L103 C104 D113	L103-H111 WeakPolarHBondContact CD1-O 3.43Å; C104-H111 PolarHBondContact N-O 3.37Å; C104-H111 PolarHBondContact O-N 3.02Å; C104-H111 PolarHBondContact O-ND1 2.04Å; H111-D113 IonicContact NE2-OD2 3.58Å; H111-D113 PolarHBondContact O-N 3.42Å
112	A	95.4	Very high	84.6	Confident	85 Å²	85	73 Å²	73	70%	0.702	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66	128.2	171.1	0	0	0	0	0	109.2	G102	G102-A112 CarbonylContact O-C 3.51Å; G102-A112 VanDerWaalsContact O-CA 3.3Å; G102-A112 WeakPolarHBondContact O-CA 2.91Å
113	D	94.9	Very high	82.5	Confident	27 Å²	27	77.9 Å²	77.9	14%	0.144	46%	0.459	C	S	.	.			trans	-140.6	114.3	178	-170.4	-19.9	0	0	0	109	C92 G102 C104 H111 A115 C116	C92-D113 WeakPolarHBondContact CB-OD2 3.42Å; G102-D113 CarbonylContact C-O 3.46Å; G102-D113 PolarHBondContact O-N 2.88Å; C104-D113 HydrophobicContact CB-CB 3.52Å; H111-D113 IonicContact NE2-OD2 3.58Å; H111-D113 PolarHBondContact O-N 3.42Å; D113-A115 PolarHBondContact O-N 2.84Å; D113-A115 VanDerWaalsContact O-N 3.16Å; D113-A115 WeakPolarHBondContact OD1-CB 3.37Å; D113-A115 PolarHBondContact OD1-N 3.12Å; D113-C116 WeakPolarHBondContact O-CB 3.13Å; D113-C116 PolarHBondContact O-N 3.04Å
114	P	91.6	Very high	80.3	Confident	101 Å²	101	84.9 Å²	84.9	66%	0.656	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-64.9	-16.7	178.9	28.8	-35.9	0	0	0	112.6	C116 D117	P114-C116 PolarHBondContact O-N 3.16Å; P114-C116 VanDerWaalsContact O-N 3.16Å; P114-D117 WeakPolarHBondContact CA-OD2 3.49Å; P114-D117 WeakPolarHBondContact O-CB 3.04Å; P114-D117 PolarHBondContact O-N 2.86Å
115	A	91.5	Very high	77.6	Confident	43 Å²	43	97.8 Å²	97.8	36%	0.355	55%	0.55	S	S	.	*	G	3₁₀ helix	trans	-61.9	-19.5	169.8	0	0	0	0	0	112	K90 D113	K90-A115 WeakPolarHBondContact CD-O 3.06Å; K90-A115 WeakPolarHBondContact CE-O 3.05Å; K90-A115 PolarHBondContact NZ-O 3.36Å; D113-A115 PolarHBondContact O-N 2.84Å; D113-A115 VanDerWaalsContact O-N 3.16Å; D113-A115 WeakPolarHBondContact OD1-CB 3.37Å; D113-A115 PolarHBondContact OD1-N 3.12Å
116	C	93.1	Very high	76.6	Confident	10 Å²	10	102.6 Å²	102.6	7%	0.068	58%	0.577	C	S	.	*	G	3₁₀ helix	trans	-93.2	3.2	175.4	-62.8	0	0	0	0	114.1	C98 G102 D113 P114	C98-C116 WeakPolarHBondContact CA-SG 3Å; C98-C116 HydrophobicContact CB-CB 3.61Å; C98-C116 WeakPolarHBondContact CB-SG 3.34Å; C98-C116 WeakPolarHBondContact SG-CA 3.02Å; C98-C116 WeakPolarHBondContact SG-CB 3.34Å; C98-C116 CovalentContact SG-SG 2.04Å; C98-C116 PolarHBondContact SG-SG 3.16Å; G102-C116 PolarHBondContact N-O 2.91Å; G102-C116 VanDerWaalsContact N-O 3.12Å; D113-C116 WeakPolarHBondContact O-CB 3.13Å; D113-C116 PolarHBondContact O-N 3.04Å; P114-C116 PolarHBondContact O-N 3.16Å; P114-C116 VanDerWaalsContact O-N 3.16Å
117	D	90.4	Very high	75.7	Confident	63 Å²	63	106.5 Å²	106.5	34%	0.337	60%	0.597	S	S	.	*	S	Bend	trans	-71.2	147.4	168.7	-62.8	-26.8	0	0	0	109.7	F101 G102 P114 E119	F101-D117 HydrophobicContact CE2-CB 3.86Å; F101-D117 HydrophobicContact CZ-CB 4.03Å; F101-D117 WeakPolarHBondContact CZ-OD1 3.3Å; G102-D117 WeakPolarHBondContact CA-OD1 3.04Å; G102-D117 PolarHBondContact N-OD1 2.91Å; P114-D117 WeakPolarHBondContact CA-OD2 3.49Å; P114-D117 WeakPolarHBondContact O-CB 3.04Å; P114-D117 PolarHBondContact O-N 2.86Å; D117-E119 PolarHBondContact O-N 2.66Å
118	M	67.1	Low	74.7	Confident	140 Å²	140	108.3 Å²	108.3	69%	0.69	60%	0.603	S	S	*	*	S	Bend	trans	-66.4	91.1	-176.6	-43.6	-171.1	86.7	0	0	111.4	F101	F101-M118 HydrophobicContact CD2-CB 4.49Å; F101-M118 HydrophobicContact CD2-CG 3.47Å; F101-M118 VanDerWaalsContact CD2-CG 3.47Å; F101-M118 HydrophobicContact CD2-SD 4.39Å; F101-M118 HydrophobicContact CE2-CB 4.33Å; F101-M118 HydrophobicContact CE2-CG 3.7Å
119	E	54.4	Low	73.8	Confident	174 Å²	174	105.4 Å²	105.4	81%	0.813	59%	0.59	S	S	*	*			trans	-111.9	75.6	143.1	-88.2	-117.9	107.8	0	0	107.5	D117	D117-E119 PolarHBondContact O-N 2.66Å
120	A	50.7	Low	72.5	Confident	84 Å²	84	110.6 Å²	110.6	69%	0.694	61%	0.612	S	S	*	*			trans	-160.3	53.2	171.1	0	0	0	0	0	112.9
121	T	49.6	Very low	70.9	Confident	126 Å²	126	115.3 Å²	115.3	77%	0.773	64%	0.635	S	S	*	*			trans	-151.3	65.4	146	-45.4	0	0	0	0	110.3
122	F	50.1	Low	69.2	Low	209 Å²	209	117.1 Å²	117.1	92%	0.917	65%	0.65	S	S	*	*			trans	-133.8	75.9	152.7	-90.6	-80.1	0	0	0	108.4
123	S	50.5	Low	67.1	Low	116 Å²	116	119.5 Å²	119.5	81%	0.811	65%	0.646	S	S	*	*			trans	-161.7	75.9	154.6	-149.3	0	0	0	0	110.7
124	Q	48.7	Very low	64.8	Low	190 Å²	190	127.3 Å²	127.3	89%	0.888	69%	0.688	S	S	*	*			trans	-163.6	88.1	139	-152.2	156.4	95.1	0	0	110.6
125	H	40.4	Very low	62.4	Low	271 Å²	271	129.6 Å²	129.6	100%	1.255	69%	0.691	S	S	*	*			trans	-144	0	144.6	-112.6	72.9	0	0	0	107.7

Retrieved 125 of 125 residues in 421 ms (Link to these results)

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