A0A077CY02_HUMAN Loading...

Bone morphogenetic protein 7

AlphaFold DB , UniProt , Accession A0A077CY02, Species HUMAN (Homo sapiens, Human), Gene BMP7, Length 139 aa.

						>A0A077CY02_HUMAN|A0A077CY02|BMP7
STGSKQRSQNRSKTPKNQEALRMANVAENSSSDQRQACKKHELYVSFRDLGWQDWIIAPEGYAAYYCEGECAFPLNSYMNATNHAIVQTLVHFINPETVPKPCCAPTQLNAISVLYFDDSSNVILKKYRNMVVRACGCH
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	S	35.1	Very low	34.3	Very low	161 Å²	161	164.5 Å²	164.5	100%	1.126	87%	0.87	S	S	*	*				0	133.3	0	-62.6	0	0	0	0	110.2
2	T	31.3	Very low	34.5	Very low	148 Å²	148	159.5 Å²	159.5	91%	0.908	86%	0.858	S	S	*	*			trans	59.8	126.9	161	58.7	0	0	0	0	117.3
3	G	29.9	Very low	35	Very low	75 Å²	75	163.1 Å²	163.1	77%	0.773	86%	0.861	S	S	*	*			cis	154.8	139.9	15.2	0	0	0	0	0	107.6
4	S	33.7	Very low	35.6	Very low	121 Å²	121	160.8 Å²	160.8	85%	0.846	86%	0.857	S	S	*	*			trans	-61.2	154.5	-170.3	-35.6	0	0	0	0	116.5
5	K	34.5	Very low	36.2	Very low	213 Å²	213	156.2 Å²	156.2	93%	0.926	84%	0.839	S	S	*	*			trans	-168.3	120.3	133	-106.9	168.4	-173.3	-178.6	0	113.1
6	Q	37.8	Very low	36.9	Very low	195 Å²	195	159.3 Å²	159.3	91%	0.911	84%	0.843	S	S	*	*			trans	-65.8	150.2	171.7	-71.4	159.6	-48.1	0	0	112.2
7	R	33.5	Very low	37.8	Very low	232 Å²	232	156.4 Å²	156.4	88%	0.875	83%	0.828	S	S	*	*			trans	-145.6	111	151.5	-161.4	168.2	168.1	-175.1	-5	111.2
8	S	33.4	Very low	38.6	Very low	92 Å²	92	155.3 Å²	155.3	64%	0.643	82%	0.818	S	S	*	*			trans	-65.4	140.7	175.7	170.4	0	0	0	0	112.4
9	Q	42.7	Very low	39.1	Very low	181 Å²	181	155 Å²	155	85%	0.846	81%	0.811	S	S	*	*			trans	-138	86.3	156.2	-74.9	-168.5	-6.9	0	0	110.2	R11	Q9-R11 PolarHBondContact O-N 3.07Å
10	N	31.3	Very low	39.8	Very low	148 Å²	148	150.3 Å²	150.3	79%	0.791	80%	0.795	S	S	*	*			trans	-65	110.5	161	-95.9	-14.8	0	0	0	109.3	S12	N10-S12 PolarHBondContact O-N 2.83Å
11	R	34.4	Very low	40.3	Very low	244 Å²	244	147.8 Å²	147.8	92%	0.921	78%	0.782	S	S	*	*			trans	-94.8	88.1	168.5	-166.7	174.2	-179.6	-178	0.3	109.1	Q9 K13	Q9-R11 PolarHBondContact O-N 3.07Å; R11-K13 PolarHBondContact O-N 3.18Å
12	S	36.6	Very low	40.9	Very low	104 Å²	104	149 Å²	149	73%	0.727	76%	0.762	S	S	*	*			trans	-57.5	119.1	175.3	-43.3	0	0	0	0	110.5	N10 T14	N10-S12 PolarHBondContact O-N 2.83Å; S12-T14 PolarHBondContact O-N 3.21Å
13	K	40.5	Very low	41.8	Very low	206 Å²	206	149 Å²	149	90%	0.896	75%	0.754	S	S	*	*			trans	-79.7	111	170.5	-74.2	179.9	177	177.3	0	108.8	R11	R11-K13 PolarHBondContact O-N 3.18Å
14	T	44.1	Very low	42.8	Very low	131 Å²	131	148.3 Å²	148.3	80%	0.804	74%	0.74	S	S	*	*			trans	-76.8	131.8	173.6	-8.2	0	0	0	0	110.3	S12 K16	S12-T14 PolarHBondContact O-N 3.21Å; T14-K16 PolarHBondContact O-N 3.32Å
15	P	43.7	Very low	43.4	Very low	92 Å²	92	147.8 Å²	147.8	60%	0.597	73%	0.728	S	S	*	*			trans	-86.1	113.2	-178.8	31.7	-29.1	0	0	0	110.8	N17	P15-N17 PolarHBondContact O-N 3.41Å
16	K	48.2	Very low	44.1	Very low	206 Å²	206	143.1 Å²	143.1	90%	0.896	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	14.2	173.7	-72.7	-175.2	171.6	-174.3	0	114.6	T14	T14-K16 PolarHBondContact O-N 3.32Å
17	N	51.8	Low	44.8	Very low	110 Å²	110	137.5 Å²	137.5	59%	0.588	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	-2.1	-167.5	-143.2	11.7	0	0	0	114.1	P15 L21	P15-N17 PolarHBondContact O-N 3.41Å; N17-L21 WeakPolarHBondContact O-CD1 3.31Å
18	Q	52.3	Low	45.6	Very low	137 Å²	137	134.3 Å²	134.3	64%	0.64	70%	0.699	S	S	*	*	H	α-helix	trans	-86.8	-20.5	-177.7	-78.2	-176.7	-22.1	0	0	114.2	R22	Q18-R22 WeakPolarHBondContact O-CG 3.38Å
19	E	48.7	Very low	46.1	Very low	149 Å²	149	136.9 Å²	136.9	70%	0.696	71%	0.706	S	S	*	*	H	α-helix	trans	-82.5	-37.8	179.2	-67.2	-173.6	134.1	0	0	112.4	L21 R22 M23	E19-L21 PolarHBondContact O-N 2.97Å; E19-R22 PolarHBondContact O-N 3.3Å; E19-M23 PolarHBondContact O-N 2.85Å
20	A	51.8	Low	46.4	Very low	60 Å²	60	132.4 Å²	132.4	50%	0.496	69%	0.694	S	S	.	*	H	α-helix	trans	-65.2	-38.1	177.6	0	0	0	0	0	112.5	R22 M23 A24	A20-R22 VanDerWaalsContact C-N 3.33Å; A20-R22 PolarHBondContact O-N 3.05Å; A20-M23 PolarHBondContact O-N 2.88Å; A20-A24 PolarHBondContact O-N 3.43Å
21	L	50.8	Low	47.2	Very low	99 Å²	99	131.4 Å²	131.4	52%	0.518	70%	0.699	S	S	.	*	H	α-helix	trans	-71.2	-27.4	177	-70	168.3	0	0	0	112.4	N17 E19 N25	N17-L21 WeakPolarHBondContact O-CD1 3.31Å; E19-L21 PolarHBondContact O-N 2.97Å; L21-N25 PolarHBondContact O-N 2.92Å; L21-N25 PolarHBondContact O-ND2 3.38Å
22	R	47.7	Very low	47.9	Very low	187 Å²	187	123.9 Å²	123.9	71%	0.706	68%	0.683	S	S	*	*	H	α-helix	trans	-70.7	-35.7	174	-76.5	177.7	177.4	-162.6	-0.6	111.9	Q18 E19 A20 V26	Q18-R22 WeakPolarHBondContact O-CG 3.38Å; E19-R22 PolarHBondContact O-N 3.3Å; A20-R22 VanDerWaalsContact C-N 3.33Å; A20-R22 PolarHBondContact O-N 3.05Å; R22-V26 WeakPolarHBondContact O-CG2 3.37Å; R22-V26 PolarHBondContact O-N 2.9Å
23	M	51	Low	48.4	Very low	148 Å²	148	124 Å²	124	73%	0.729	68%	0.676	S	S	*	*	H	α-helix	trans	-69.8	-35.1	175.7	-63.7	-179.9	-167	0	0	112.4	E19 A20	E19-M23 PolarHBondContact O-N 2.85Å; A20-M23 PolarHBondContact O-N 2.88Å
24	A	50.5	Low	48.9	Very low	59 Å²	59	123.7 Å²	123.7	49%	0.488	68%	0.678	S	S	.	*	H	α-helix	trans	-69.1	-35.8	176.3	0	0	0	0	0	112.9	A20	A20-A24 PolarHBondContact O-N 3.43Å
25	N	45.4	Very low	49.8	Very low	110 Å²	110	125.1 Å²	125.1	59%	0.588	67%	0.668	S	S	*	*	H	α-helix	trans	-84.9	-7.1	-176.5	-75.9	-65.6	0	0	0	114.8	L21	L21-N25 PolarHBondContact O-N 2.92Å; L21-N25 PolarHBondContact O-ND2 3.38Å
26	V	50.6	Low	51.6	Low	115 Å²	115	126.3 Å²	126.3	70%	0.697	67%	0.666	S	S	*	*	H	α-helix	trans	-87.5	-16.7	172.7	175.5	0	0	0	0	111.5	R22 E28	R22-V26 WeakPolarHBondContact O-CG2 3.37Å; R22-V26 PolarHBondContact O-N 2.9Å; V26-E28 VanDerWaalsContact C-N 3.27Å; V26-E28 PolarHBondContact O-N 2.82Å
27	A	52.8	Low	53.5	Low	78 Å²	78	118.8 Å²	118.8	65%	0.645	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-11.8	179	0	0	0	0	0	114.2
28	E	49.4	Very low	55.5	Low	165 Å²	165	114 Å²	114	77%	0.771	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	4.3	-174.1	-74.6	-166.8	146	0	0	115.2	V26	V26-E28 VanDerWaalsContact C-N 3.27Å; V26-E28 PolarHBondContact O-N 2.82Å
29	N	44.6	Very low	57.4	Low	146 Å²	146	111.8 Å²	111.8	78%	0.781	61%	0.606	S	S	*	*			trans	-131.6	35.7	-175.9	-151.4	27.4	0	0	0	116.4
30	S	47.5	Very low	59.6	Low	87 Å²	87	109 Å²	109	61%	0.608	59%	0.591	S	S	*	*			trans	-114.8	83.1	165.8	58.3	0	0	0	0	110.5	S32	S30-S32 PolarHBondContact O-N 3.29Å
31	S	49.3	Very low	61.7	Low	126 Å²	126	107.9 Å²	107.9	88%	0.881	58%	0.576	S	S	*	*			trans	-72.7	48	167.3	62.6	0	0	0	0	112
32	S	47.7	Very low	64	Low	86 Å²	86	111.5 Å²	111.5	60%	0.601	59%	0.59	S	S	*	*	S	Bend	trans	-115.5	92	174.4	57	0	0	0	0	108	S30	S30-S32 PolarHBondContact O-N 3.29Å
33	D	47.1	Very low	66.4	Low	108 Å²	108	106.1 Å²	106.1	58%	0.578	58%	0.575	S	S	*	*			trans	57.2	100.7	171.1	-140.4	11.7	0	0	0	113	R35	D33-R35 HydrophobicContact CB-CG 4.22Å; D33-R35 PolarHBondContact O-N 3.08Å; D33-R35 IonicContact OD2-CZ 3.42Å; D33-R35 IonicContact OD2-NE 2.81Å; D33-R35 PolarHBondContact OD2-NE 3.17Å; D33-R35 IonicContact OD2-NH2 3.15Å; D33-R35 PolarHBondContact OD2-NH2 2.9Å; D33-R35 VanDerWaalsContact OD2-NH2 3.15Å
34	Q	51.8	Low	68.6	Low	198 Å²	198	105.7 Å²	105.7	93%	0.925	57%	0.566	S	S	*	*			trans	-68.4	59.4	175.4	-72.1	-173	-2.3	0	0	111.2	Q36	Q34-Q36 PolarHBondContact O-N 2.8Å; Q34-Q36 VanDerWaalsContact O-N 3.08Å
35	R	62.7	Low	70.9	Confident	161 Å²	161	104.2 Å²	104.2	61%	0.608	55%	0.551	S	S	*	*			trans	-66	112.6	172.2	-70.2	-176.7	-175	-165.5	0.1	106.6	D33 E70	D33-R35 HydrophobicContact CB-CG 4.22Å; D33-R35 PolarHBondContact O-N 3.08Å; D33-R35 IonicContact OD2-CZ 3.42Å; D33-R35 IonicContact OD2-NE 2.81Å; D33-R35 PolarHBondContact OD2-NE 3.17Å; D33-R35 IonicContact OD2-NH2 3.15Å; D33-R35 PolarHBondContact OD2-NH2 2.9Å; D33-R35 VanDerWaalsContact OD2-NH2 3.15Å; R35-E70 HydrophobicContact CB-CG 3.66Å
36	Q	81.8	Confident	73.4	Confident	117 Å²	117	99.7 Å²	99.7	55%	0.547	53%	0.528	S	S	.	.			trans	-59	152.4	-177.9	-65.6	174.1	-0.1	0	0	109.8	Q34 G69 E70	Q34-Q36 PolarHBondContact O-N 2.8Å; Q34-Q36 VanDerWaalsContact O-N 3.08Å; Q36-G69 CarbonylContact O-C 3.6Å; Q36-G69 WeakPolarHBondContact O-CA 3.21Å; Q36-E70 PolarHBondContact O-N 2.84Å
37	A	88.3	Confident	75.6	Confident	48 Å²	48	94.5 Å²	94.5	40%	0.397	50%	0.496	S	S	.	.	B	Isolated β-bridge	trans	-47.7	144.8	172.2	0	0	0	0	0	111.9	K39 M79	A37-K39 PolarHBondContact O-N 2.8Å; A37-K39 VanDerWaalsContact O-N 3.11Å; A37-M79 HydrophobicContact CB-CE 3.33Å
38	C	93	Very high	77.7	Confident	11 Å²	11	99 Å²	99	7%	0.074	50%	0.497	C	S	.	.	S	Bend	trans	-45.8	118	176.2	174.1	0	0	0	0	111.8	E70 M79 C104	C38-E70 PolarHBondContact N-O 2.87Å; C38-M79 HydrophobicContact CB-CG 4.38Å; C38-C104 WeakPolarHBondContact CA-SG 3.26Å; C38-C104 HydrophobicContact CB-CB 3.67Å; C38-C104 WeakPolarHBondContact CB-SG 3.44Å; C38-C104 VanDerWaalsContact SG-CA 3.53Å; C38-C104 WeakPolarHBondContact SG-CB 3.46Å; C38-C104 CovalentContact SG-SG 2.03Å; C38-C104 PolarHBondContact SG-SG 2.92Å
39	K	92.3	Very high	80	Confident	89 Å²	89	97.1 Å²	97.1	39%	0.387	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	171.9	-178.7	68.9	177.2	-178.5	171.5	0	112.2	A37 H41 C67 E68 C136	A37-K39 PolarHBondContact O-N 2.8Å; A37-K39 VanDerWaalsContact O-N 3.11Å; K39-H41 WeakPolarHBondContact CE-CE1 3.44Å; K39-H41 WeakPolarHBondContact CG-NE2 3.33Å; K39-H41 PolarHBondContact O-CD2 2.96Å; K39-C67 WeakPolarHBondContact O-CA 3.47Å; K39-E68 PolarHBondContact N-O 2.65Å; K39-E68 PolarHBondContact O-N 3.08Å; K39-E68 VanDerWaalsContact O-N 3.13Å; K39-C136 VanDerWaalsContact C-SG 3.56Å; K39-C136 PolarHBondContact O-SG 2.82Å
40	K	95	Very high	82.5	Confident	90 Å²	90	94.4 Å²	94.4	39%	0.391	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	133.2	173	-170.1	-176	70	160.9	0	110	Y65 Y66 V133 C136	K40-Y65 HydrophobicContact CD-CD1 3.94Å; K40-Y65 HydrophobicContact CD-CG 3.86Å; K40-Y65 HydrophobicContact CG-CD1 4.19Å; K40-Y65 HydrophobicContact CG-CG 4.2Å; K40-Y66 CarbonylContact C-O 3.35Å; K40-Y66 WeakPolarHBondContact CA-O 3.27Å; K40-V133 HydrophobicContact CD-CG1 4.3Å; K40-V133 WeakPolarHBondContact CD-O 3.47Å; K40-V133 HydrophobicContact CG-CG1 4.17Å; K40-C136 WeakPolarHBondContact CA-SG 3.49Å; K40-C136 PolarHBondContact N-SG 2.83Å
41	H	96.6	Very high	84.8	Confident	38 Å²	38	92.2 Å²	92.2	18%	0.176	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	154.4	175.8	-61.3	-93.8	0	0	0	110.5	K39 Y65 Y66 E68	K39-H41 WeakPolarHBondContact CE-CE1 3.44Å; K39-H41 WeakPolarHBondContact CG-NE2 3.33Å; K39-H41 PolarHBondContact O-CD2 2.96Å; H41-Y65 WeakPolarHBondContact O-CA 2.94Å; H41-Y65 VanDerWaalsContact O-CB 3.23Å; H41-Y65 WeakPolarHBondContact O-CB 3.45Å; H41-Y65 WeakPolarHBondContact O-CD1 3.49Å; H41-Y66 HydrophobicContact CB-CD1 3.8Å; H41-Y66 HydrophobicContact CB-CE1 3.36Å; H41-Y66 HydrophobicContact CB-CE2 4.31Å; H41-Y66 HydrophobicContact CB-CG 4.46Å; H41-Y66 PolarHBondContact N-O 2.92Å; H41-Y66 PolarHBondContact O-N 2.95Å; H41-E68 PolarHBondContact NE2-O 3.47Å
42	E	98.1	Very high	87.1	Confident	174 Å²	174	90.9 Å²	90.9	81%	0.813	44%	0.444	S	S	*	.			trans	-70.9	134.8	178.7	-63.7	-173.3	162.6	0	0	110.7	Y65	E42-Y65 HydrophobicContact CG-CD1 4.45Å; E42-Y65 HydrophobicContact CG-CE1 4.26Å
43	L	98.1	Very high	89.2	Confident	75 Å²	75	91 Å²	91	39%	0.393	43%	0.434	S	S	.	.			trans	-148.6	124.1	170.9	168.6	68.3	0	0	0	107.4	V45 A63 A64 Y65 Y66	L43-V45 HydrophobicContact CD2-CG2 4.37Å; L43-V45 HydrophobicContact CG-CG2 4.3Å; L43-A63 CarbonylContact O-C 3.46Å; L43-A63 WeakPolarHBondContact O-CA 3.31Å; L43-A64 HydrophobicContact CD2-CB 4.21Å; L43-A64 HydrophobicContact CG-CB 4.37Å; L43-A64 PolarHBondContact O-N 3.3Å; L43-Y65 PolarHBondContact O-N 2.81Å; L43-Y66 HydrophobicContact CB-CD1 3.76Å; L43-Y66 HydrophobicContact CB-CE1 4.46Å; L43-Y66 HydrophobicContact CD2-CD1 4.47Å
44	Y	98.5	Very high	91.3	Very high	139 Å²	139	92 Å²	92	55%	0.545	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.8	170.5	-173.6	-97	0	0	0	109	G61	Y44-G61 VanDerWaalsContact OH-CA 3.31Å; Y44-G61 WeakPolarHBondContact OH-CA 3.44Å
45	V	98.2	Very high	93.4	Very high	28 Å²	28	87 Å²	87	17%	0.17	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	112.3	174.4	174.3	0	0	0	0	107.6	L43 F47 L50 G61 Y62 A64	L43-V45 HydrophobicContact CD2-CG2 4.37Å; L43-V45 HydrophobicContact CG-CG2 4.3Å; V45-F47 HydrophobicContact CG1-CD1 4.39Å; V45-F47 HydrophobicContact CG1-CE1 4.42Å; V45-L50 HydrophobicContact CG1-CD1 3.62Å; V45-L50 HydrophobicContact CG1-CG 4.42Å; V45-G61 CarbonylContact O-C 3.39Å; V45-G61 WeakPolarHBondContact O-CA 3.46Å; V45-Y62 HydrophobicContact CB-CD1 4.15Å; V45-Y62 HydrophobicContact CB-CE1 3.77Å; V45-Y62 HydrophobicContact CG1-CD1 4.48Å; V45-Y62 HydrophobicContact CG1-CE1 3.9Å; V45-Y62 HydrophobicContact CG2-CE1 4.4Å; V45-Y62 PolarHBondContact N-O 3.13Å; V45-Y62 PolarHBondContact O-N 2.89Å; V45-A64 HydrophobicContact CB-CB 4.48Å; V45-A64 HydrophobicContact CG2-CB 3.63Å
46	S	98.2	Very high	95	Very high	15 Å²	15	80.1 Å²	80.1	11%	0.105	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	121.8	170.2	167.2	0	0	0	0	108.6	R48 D49 L50	S46-R48 PolarHBondContact O-N 2.94Å; S46-R48 PolarHBondContact OG-N 2.82Å; S46-D49 WeakPolarHBondContact CB-OD1 3.34Å; S46-D49 VanDerWaalsContact CB-OD2 3.27Å; S46-D49 WeakPolarHBondContact CB-OD2 3.47Å; S46-D49 PolarHBondContact O-N 3.39Å; S46-D49 PolarHBondContact OG-N 3.34Å; S46-D49 PolarHBondContact OG-OD1 2.9Å; S46-L50 PolarHBondContact O-N 3.17Å
47	F	97.5	Very high	95.8	Very high	5 Å²	5	77.9 Å²	77.9	2%	0.022	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-24.6	175	-68	-39.3	0	0	0	112	V45 L50 G51 W52 I56 P59 E60 Y62 I112 V114	V45-F47 HydrophobicContact CG1-CD1 4.39Å; V45-F47 HydrophobicContact CG1-CE1 4.42Å; F47-L50 HydrophobicContact CD1-CD1 4.35Å; F47-L50 PolarHBondContact O-N 3.04Å; F47-G51 PolarHBondContact O-N 3.38Å; F47-W52 HydrophobicContact CB-CB 4.17Å; F47-W52 AromaticContact CD1-CE3 3.54Å; F47-W52 HydrophobicContact CD1-CE3 3.54Å; F47-W52 HydrophobicContact CD1-CZ3 4Å; F47-W52 AromaticContact CE1-CE3 3.91Å; F47-W52 HydrophobicContact CE1-CE3 3.91Å; F47-W52 AromaticContact CE1-CZ3 3.95Å; F47-W52 HydrophobicContact CE1-CZ3 3.95Å; F47-W52 HydrophobicContact CG-CE3 4.4Å; F47-W52 WeakPolarHBondContact O-CA 3.25Å; F47-W52 WeakPolarHBondContact O-CB 3.19Å; F47-W52 PolarHBondContact O-N 3.07Å; F47-I56 HydrophobicContact CB-CD1 4.08Å; F47-I56 HydrophobicContact CD1-CD1 3.82Å; F47-I56 HydrophobicContact CD2-CB 4.4Å; F47-I56 HydrophobicContact CD2-CD1 3.58Å; F47-I56 HydrophobicContact CD2-CG2 3.72Å; F47-I56 HydrophobicContact CE1-CD1 4.08Å; F47-I56 HydrophobicContact CE2-CD1 3.85Å; F47-I56 HydrophobicContact CE2-CG2 4.11Å; F47-I56 HydrophobicContact CG-CD1 3.57Å; F47-I56 HydrophobicContact CZ-CD1 4.09Å; F47-P59 WeakPolarHBondContact CD2-O 3.27Å; F47-P59 HydrophobicContact CE2-CG 4.09Å; F47-E60 PolarHBondContact N-O 2.78Å; F47-Y62 AromaticContact CE1-CD1 3.97Å; F47-Y62 HydrophobicContact CE1-CD1 3.97Å; F47-Y62 AromaticContact CE1-CE1 3.76Å; F47-Y62 HydrophobicContact CE1-CE1 3.76Å; F47-Y62 HydrophobicContact CE2-CD1 4.39Å; F47-Y62 AromaticContact CZ-CD1 3.66Å; F47-Y62 HydrophobicContact CZ-CD1 3.66Å; F47-Y62 AromaticContact CZ-CE1 3.82Å; F47-Y62 HydrophobicContact CZ-CE1 3.82Å; F47-I112 HydrophobicContact CZ-CD1 4.23Å; F47-V114 HydrophobicContact CZ-CG2 4.43Å
48	R	96.7	Very high	96.3	Very high	174 Å²	174	77.4 Å²	77.4	66%	0.657	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-41.2	171.1	-176	177.4	64.6	-161.3	-1.8	112.1	S46 L50 G51 Q53	S46-R48 PolarHBondContact O-N 2.94Å; S46-R48 PolarHBondContact OG-N 2.82Å; R48-L50 PolarHBondContact O-N 2.72Å; R48-G51 PolarHBondContact O-N 3.28Å; R48-Q53 HydrophobicContact CB-CB 4.43Å; R48-Q53 HydrophobicContact CG-CG 4.5Å; R48-Q53 PolarHBondContact O-OE1 2.82Å
49	D	97.4	Very high	96.5	Very high	124 Å²	124	79.2 Å²	79.2	66%	0.663	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-22	-178.1	-57.5	4.3	0	0	0	111.1	S46	S46-D49 WeakPolarHBondContact CB-OD1 3.34Å; S46-D49 VanDerWaalsContact CB-OD2 3.27Å; S46-D49 WeakPolarHBondContact CB-OD2 3.47Å; S46-D49 PolarHBondContact O-N 3.39Å; S46-D49 PolarHBondContact OG-N 3.34Å; S46-D49 PolarHBondContact OG-OD1 2.9Å
50	L	96.5	Very high	96.7	Very high	89 Å²	89	82.7 Å²	82.7	47%	0.466	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-4.5	171.3	-61	-179.2	0	0	0	113.6	V45 S46 F47 R48 W52	V45-L50 HydrophobicContact CG1-CD1 3.62Å; V45-L50 HydrophobicContact CG1-CG 4.42Å; S46-L50 PolarHBondContact O-N 3.17Å; F47-L50 HydrophobicContact CD1-CD1 4.35Å; F47-L50 PolarHBondContact O-N 3.04Å; R48-L50 PolarHBondContact O-N 2.72Å; L50-W52 HydrophobicContact CB-CD2 3.91Å; L50-W52 HydrophobicContact CB-CE3 4.44Å; L50-W52 HydrophobicContact CB-CG 4.01Å; L50-W52 HydrophobicContact CD1-CD2 4.17Å; L50-W52 HydrophobicContact CD1-CE3 3.93Å; L50-W52 HydrophobicContact CD1-CH2 3.91Å; L50-W52 HydrophobicContact CD1-CZ2 4.15Å; L50-W52 HydrophobicContact CD1-CZ3 3.8Å; L50-W52 PolarHBondContact O-NE1 3.5Å
51	G	96.6	Very high	96.9	Very high	41 Å²	41	78.9 Å²	78.9	42%	0.423	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	26.5	-176.2	0	0	0	0	0	113.8	F47 R48 Q53	F47-G51 PolarHBondContact O-N 3.38Å; R48-G51 PolarHBondContact O-N 3.28Å; G51-Q53 VanDerWaalsContact CA-OE1 3.27Å
52	W	96.3	Very high	97	Very high	99 Å²	99	78.6 Å²	78.6	38%	0.375	39%	0.388	S	S	.	.			trans	-102.6	1.5	-176.1	-62.8	-4.5	0	0	0	113.9	F47 L50 D54 W55 I56	F47-W52 HydrophobicContact CB-CB 4.17Å; F47-W52 AromaticContact CD1-CE3 3.54Å; F47-W52 HydrophobicContact CD1-CE3 3.54Å; F47-W52 HydrophobicContact CD1-CZ3 4Å; F47-W52 AromaticContact CE1-CE3 3.91Å; F47-W52 HydrophobicContact CE1-CE3 3.91Å; F47-W52 AromaticContact CE1-CZ3 3.95Å; F47-W52 HydrophobicContact CE1-CZ3 3.95Å; F47-W52 HydrophobicContact CG-CE3 4.4Å; F47-W52 WeakPolarHBondContact O-CA 3.25Å; F47-W52 WeakPolarHBondContact O-CB 3.19Å; F47-W52 PolarHBondContact O-N 3.07Å; L50-W52 HydrophobicContact CB-CD2 3.91Å; L50-W52 HydrophobicContact CB-CE3 4.44Å; L50-W52 HydrophobicContact CB-CG 4.01Å; L50-W52 HydrophobicContact CD1-CD2 4.17Å; L50-W52 HydrophobicContact CD1-CE3 3.93Å; L50-W52 HydrophobicContact CD1-CH2 3.91Å; L50-W52 HydrophobicContact CD1-CZ2 4.15Å; L50-W52 HydrophobicContact CD1-CZ3 3.8Å; L50-W52 PolarHBondContact O-NE1 3.5Å; W52-D54 PolarHBondContact O-N 2.82Å; W52-W55 HydrophobicContact CB-CZ2 3.65Å; W52-W55 AromaticContact CD1-CZ2 3.93Å; W52-W55 AromaticContact CD1-NE1 3.68Å; W52-W55 HydrophobicContact CD2-CH2 4.26Å; W52-W55 AromaticContact CD2-CZ2 3.49Å; W52-W55 HydrophobicContact CD2-CZ2 3.49Å; W52-W55 VanDerWaalsContact CD2-CZ2 3.49Å; W52-W55 HydrophobicContact CE3-CH2 4.14Å; W52-W55 AromaticContact CE3-CZ2 3.82Å; W52-W55 HydrophobicContact CE3-CZ2 3.82Å; W52-W55 AromaticContact CG-CE2 3.74Å; W52-W55 HydrophobicContact CG-CH2 4.48Å; W52-W55 AromaticContact CG-CZ2 3.4Å; W52-W55 HydrophobicContact CG-CZ2 3.4Å; W52-W55 VanDerWaalsContact CG-CZ2 3.4Å; W52-W55 AromaticContact CG-NE1 3.65Å; W52-W55 PolarHBondContact O-N 3.31Å; W52-I56 HydrophobicContact CB-CD1 3.87Å; W52-I56 HydrophobicContact CB-CG1 4.24Å; W52-I56 HydrophobicContact CD2-CD1 4.46Å; W52-I56 HydrophobicContact CE3-CD1 3.79Å; W52-I56 WeakPolarHBondContact O-CB 3.31Å; W52-I56 PolarHBondContact O-N 3.45Å
53	Q	92.3	Very high	97	Very high	88 Å²	88	72.3 Å²	72.3	41%	0.411	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-19.2	-179.4	73.2	-71.3	-17.5	0	0	114	R48 G51 W55	R48-Q53 HydrophobicContact CB-CB 4.43Å; R48-Q53 HydrophobicContact CG-CG 4.5Å; R48-Q53 PolarHBondContact O-OE1 2.82Å; G51-Q53 VanDerWaalsContact CA-OE1 3.27Å; Q53-W55 VanDerWaalsContact C-N 3.32Å
54	D	92.2	Very high	97	Very high	130 Å²	130	69 Å²	69	70%	0.695	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-22.7	-177.7	-59.8	-17.2	0	0	0	112	W52	W52-D54 PolarHBondContact O-N 2.82Å
55	W	94.7	Very high	97	Very high	93 Å²	93	65.7 Å²	65.7	35%	0.352	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.5	-26.9	-179	60.8	-89.8	0	0	0	113.3	W52 Q53 Y116 F117	W52-W55 HydrophobicContact CB-CZ2 3.65Å; W52-W55 AromaticContact CD1-CZ2 3.93Å; W52-W55 AromaticContact CD1-NE1 3.68Å; W52-W55 HydrophobicContact CD2-CH2 4.26Å; W52-W55 AromaticContact CD2-CZ2 3.49Å; W52-W55 HydrophobicContact CD2-CZ2 3.49Å; W52-W55 VanDerWaalsContact CD2-CZ2 3.49Å; W52-W55 HydrophobicContact CE3-CH2 4.14Å; W52-W55 AromaticContact CE3-CZ2 3.82Å; W52-W55 HydrophobicContact CE3-CZ2 3.82Å; W52-W55 AromaticContact CG-CE2 3.74Å; W52-W55 HydrophobicContact CG-CH2 4.48Å; W52-W55 AromaticContact CG-CZ2 3.4Å; W52-W55 HydrophobicContact CG-CZ2 3.4Å; W52-W55 VanDerWaalsContact CG-CZ2 3.4Å; W52-W55 AromaticContact CG-NE1 3.65Å; W52-W55 PolarHBondContact O-N 3.31Å; Q53-W55 VanDerWaalsContact C-N 3.32Å; W55-Y116 HydrophobicContact CE3-CD2 4.08Å; W55-Y116 HydrophobicContact CE3-CG 4.24Å; W55-Y116 HydrophobicContact CZ3-CD2 4.3Å; W55-Y116 HydrophobicContact CZ3-CG 4.29Å; W55-Y116 CarbonylContact O-C 3.48Å; W55-Y116 WeakPolarHBondContact O-CA 3.4Å; W55-Y116 VanDerWaalsContact O-CB 3.25Å; W55-Y116 WeakPolarHBondContact O-CB 3.37Å; W55-F117 PolarHBondContact O-N 3.3Å
56	I	97.3	Very high	97	Very high	15 Å²	15	68.6 Å²	68.6	8%	0.077	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	124.2	172	-62	-177.9	0	0	0	110.1	F47 W52 V114	F47-I56 HydrophobicContact CB-CD1 4.08Å; F47-I56 HydrophobicContact CD1-CD1 3.82Å; F47-I56 HydrophobicContact CD2-CB 4.4Å; F47-I56 HydrophobicContact CD2-CD1 3.58Å; F47-I56 HydrophobicContact CD2-CG2 3.72Å; F47-I56 HydrophobicContact CE1-CD1 4.08Å; F47-I56 HydrophobicContact CE2-CD1 3.85Å; F47-I56 HydrophobicContact CE2-CG2 4.11Å; F47-I56 HydrophobicContact CG-CD1 3.57Å; F47-I56 HydrophobicContact CZ-CD1 4.09Å; W52-I56 HydrophobicContact CB-CD1 3.87Å; W52-I56 HydrophobicContact CB-CG1 4.24Å; W52-I56 HydrophobicContact CD2-CD1 4.46Å; W52-I56 HydrophobicContact CE3-CD1 3.79Å; W52-I56 WeakPolarHBondContact O-CB 3.31Å; W52-I56 PolarHBondContact O-N 3.45Å; I56-V114 HydrophobicContact CD1-CG1 4.19Å; I56-V114 HydrophobicContact CG1-CG1 4.21Å; I56-V114 HydrophobicContact CG2-CG1 3.87Å
57	I	97.9	Very high	96.9	Very high	71 Å²	71	68.9 Å²	68.9	36%	0.364	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-45.4	176.4	-57.4	164.1	0	0	0	110.3	L115 F117 V123	I57-L115 WeakPolarHBondContact CA-O 3.5Å; I57-L115 HydrophobicContact CB-CB 4.36Å; I57-L115 HydrophobicContact CB-CD2 4.11Å; I57-L115 HydrophobicContact CB-CG 4.11Å; I57-L115 WeakPolarHBondContact CB-O 3.47Å; I57-L115 HydrophobicContact CD1-CD2 4.47Å; I57-L115 HydrophobicContact CD1-CG 4.17Å; I57-L115 HydrophobicContact CG2-CD2 3.83Å; I57-L115 HydrophobicContact CG2-CG 4.38Å; I57-L115 PolarHBondContact N-O 2.84Å; I57-F117 HydrophobicContact CD1-CD1 4.14Å; I57-F117 HydrophobicContact CD1-CD2 3.88Å; I57-F117 HydrophobicContact CD1-CE1 3.94Å; I57-F117 HydrophobicContact CD1-CE2 3.66Å; I57-F117 HydrophobicContact CD1-CG 4.11Å; I57-F117 HydrophobicContact CD1-CZ 3.69Å; I57-F117 HydrophobicContact CG1-CD2 3.77Å; I57-F117 HydrophobicContact CG1-CE2 3.55Å; I57-F117 HydrophobicContact CG1-CG 4.46Å; I57-F117 HydrophobicContact CG1-CZ 4.07Å; I57-V123 HydrophobicContact CD1-CG1 3.94Å; I57-V123 HydrophobicContact CD1-CG2 4.09Å
58	A	98.1	Very high	96.8	Very high	37 Å²	37	73.3 Å²	73.3	31%	0.306	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	153.7	179.8	0	0	0	0	0	112.7	V114 L115	A58-V114 WeakPolarHBondContact O-CA 3.41Å; A58-L115 HydrophobicContact CB-CB 4.2Å; A58-L115 PolarHBondContact N-O 3.33Å; A58-L115 VanDerWaalsContact N-O 3.07Å; A58-L115 PolarHBondContact O-N 2.78Å
59	P	98.1	Very high	96.6	Very high	49 Å²	49	66.2 Å²	66.2	32%	0.318	35%	0.348	S	S	.	.			cis	-69.6	174.7	-11.1	33.6	-37.6	0	0	0	111.4	F47 G61	F47-P59 WeakPolarHBondContact CD2-O 3.27Å; F47-P59 HydrophobicContact CE2-CG 4.09Å; P59-G61 WeakPolarHBondContact CB-O 3.23Å; P59-G61 WeakPolarHBondContact CG-O 3.22Å; P59-G61 PolarHBondContact O-N 3.1Å
60	E	97.3	Very high	96.2	Very high	163 Å²	163	63 Å²	63	76%	0.762	33%	0.329	S	S	*	.	S	Bend	trans	-70.6	-21.5	172.6	-63.9	-175.1	171.5	0	0	112.7	F47	F47-E60 PolarHBondContact N-O 2.78Å
61	G	97.9	Very high	96	Very high	9 Å²	9	58.9 Å²	58.9	9%	0.093	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.7	-179	-179.8	0	0	0	0	0	110.1	Y44 V45 P59	Y44-G61 VanDerWaalsContact OH-CA 3.31Å; Y44-G61 WeakPolarHBondContact OH-CA 3.44Å; V45-G61 CarbonylContact O-C 3.39Å; V45-G61 WeakPolarHBondContact O-CA 3.46Å; P59-G61 WeakPolarHBondContact CB-O 3.23Å; P59-G61 WeakPolarHBondContact CG-O 3.22Å; P59-G61 PolarHBondContact O-N 3.1Å
62	Y	98.4	Very high	95.4	Very high	33 Å²	33	58.5 Å²	58.5	13%	0.129	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	154.5	-178.2	73	-77.1	0	0	0	112.2	V45 F47 A64 I112 M131 V132	V45-Y62 HydrophobicContact CB-CD1 4.15Å; V45-Y62 HydrophobicContact CB-CE1 3.77Å; V45-Y62 HydrophobicContact CG1-CD1 4.48Å; V45-Y62 HydrophobicContact CG1-CE1 3.9Å; V45-Y62 HydrophobicContact CG2-CE1 4.4Å; V45-Y62 PolarHBondContact N-O 3.13Å; V45-Y62 PolarHBondContact O-N 2.89Å; F47-Y62 AromaticContact CE1-CD1 3.97Å; F47-Y62 HydrophobicContact CE1-CD1 3.97Å; F47-Y62 AromaticContact CE1-CE1 3.76Å; F47-Y62 HydrophobicContact CE1-CE1 3.76Å; F47-Y62 HydrophobicContact CE2-CD1 4.39Å; F47-Y62 AromaticContact CZ-CD1 3.66Å; F47-Y62 HydrophobicContact CZ-CD1 3.66Å; F47-Y62 AromaticContact CZ-CE1 3.82Å; F47-Y62 HydrophobicContact CZ-CE1 3.82Å; Y62-A64 HydrophobicContact CD2-CB 4.15Å; Y62-A64 HydrophobicContact CE2-CB 3.46Å; Y62-A64 VanDerWaalsContact CE2-CB 3.46Å; Y62-A64 PolarHBondContact O-N 2.94Å; Y62-A64 VanDerWaalsContact O-N 3.08Å; Y62-I112 HydrophobicContact CD1-CD1 3.76Å; Y62-I112 HydrophobicContact CD2-CD1 4.08Å; Y62-I112 HydrophobicContact CD2-CG2 3.97Å; Y62-I112 HydrophobicContact CE1-CD1 3.86Å; Y62-I112 HydrophobicContact CE2-CD1 4.16Å; Y62-I112 HydrophobicContact CE2-CG2 4.44Å; Y62-I112 HydrophobicContact CG-CD1 3.88Å; Y62-I112 HydrophobicContact CG-CG2 4.41Å; Y62-M131 HydrophobicContact CE1-CE 4.21Å; Y62-M131 HydrophobicContact CE2-CB 4.17Å; Y62-M131 VanDerWaalsContact CE2-O 3.25Å; Y62-M131 WeakPolarHBondContact CE2-O 3.44Å; Y62-M131 WeakPolarHBondContact OH-CE 3.44Å; Y62-M131 PolarHBondContact OH-O 3.42Å; Y62-V132 HydrophobicContact CD2-CG2 3.6Å; Y62-V132 HydrophobicContact CE2-CG2 3.73Å
63	A	98.4	Very high	94.3	Very high	41 Å²	41	60.3 Å²	60.3	34%	0.339	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	94.1	173.5	0	0	0	0	0	109.8	L43 Y65 V132	L43-A63 CarbonylContact O-C 3.46Å; L43-A63 WeakPolarHBondContact O-CA 3.31Å; A63-Y65 HydrophobicContact CB-CD2 4.36Å; A63-Y65 HydrophobicContact CB-CE2 3.66Å; A63-Y65 VanDerWaalsContact O-CD2 3.31Å; A63-Y65 WeakPolarHBondContact O-CD2 3.45Å; A63-Y65 WeakPolarHBondContact O-CE2 3.39Å; A63-V132 WeakPolarHBondContact O-CG1 3.49Å
64	A	98.4	Very high	93.5	Very high	6 Å²	6	60.6 Å²	60.6	5%	0.05	32%	0.321	C	S	.	.			trans	-75.7	-37.1	-179.6	0	0	0	0	0	112.4	L43 V45 Y62 V132 V133	L43-A64 HydrophobicContact CD2-CB 4.21Å; L43-A64 HydrophobicContact CG-CB 4.37Å; L43-A64 PolarHBondContact O-N 3.3Å; V45-A64 HydrophobicContact CB-CB 4.48Å; V45-A64 HydrophobicContact CG2-CB 3.63Å; Y62-A64 HydrophobicContact CD2-CB 4.15Å; Y62-A64 HydrophobicContact CE2-CB 3.46Å; Y62-A64 VanDerWaalsContact CE2-CB 3.46Å; Y62-A64 PolarHBondContact O-N 2.94Å; Y62-A64 VanDerWaalsContact O-N 3.08Å; A64-V132 CarbonylContact O-C 3.51Å; A64-V132 WeakPolarHBondContact O-CA 3.43Å; A64-V133 PolarHBondContact O-N 3.24Å
65	Y	98.6	Very high	92.6	Very high	69 Å²	69	56 Å²	56	27%	0.271	30%	0.295	S	S	.	.			trans	57.9	165.6	-167.8	-51.6	-90.7	0	0	0	112.8	K40 H41 E42 L43 A63 V132	K40-Y65 HydrophobicContact CD-CD1 3.94Å; K40-Y65 HydrophobicContact CD-CG 3.86Å; K40-Y65 HydrophobicContact CG-CD1 4.19Å; K40-Y65 HydrophobicContact CG-CG 4.2Å; H41-Y65 WeakPolarHBondContact O-CA 2.94Å; H41-Y65 VanDerWaalsContact O-CB 3.23Å; H41-Y65 WeakPolarHBondContact O-CB 3.45Å; H41-Y65 WeakPolarHBondContact O-CD1 3.49Å; E42-Y65 HydrophobicContact CG-CD1 4.45Å; E42-Y65 HydrophobicContact CG-CE1 4.26Å; L43-Y65 PolarHBondContact O-N 2.81Å; A63-Y65 HydrophobicContact CB-CD2 4.36Å; A63-Y65 HydrophobicContact CB-CE2 3.66Å; A63-Y65 VanDerWaalsContact O-CD2 3.31Å; A63-Y65 WeakPolarHBondContact O-CD2 3.45Å; A63-Y65 WeakPolarHBondContact O-CE2 3.39Å; Y65-V132 HydrophobicContact CD2-CG1 3.94Å; Y65-V132 HydrophobicContact CE2-CG1 4.19Å
66	Y	97.9	Very high	91.3	Very high	90 Å²	90	54.5 Å²	54.5	35%	0.353	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	167.3	172	73.9	-73.9	0	0	0	111.1	K40 H41 L43 E68	K40-Y66 CarbonylContact C-O 3.35Å; K40-Y66 WeakPolarHBondContact CA-O 3.27Å; H41-Y66 HydrophobicContact CB-CD1 3.8Å; H41-Y66 HydrophobicContact CB-CE1 3.36Å; H41-Y66 HydrophobicContact CB-CE2 4.31Å; H41-Y66 HydrophobicContact CB-CG 4.46Å; H41-Y66 PolarHBondContact N-O 2.92Å; H41-Y66 PolarHBondContact O-N 2.95Å; L43-Y66 HydrophobicContact CB-CD1 3.76Å; L43-Y66 HydrophobicContact CB-CE1 4.46Å; L43-Y66 HydrophobicContact CD2-CD1 4.47Å; Y66-E68 HydrophobicContact CD2-CB 4.04Å; Y66-E68 HydrophobicContact CE2-CB 3.55Å; Y66-E68 HydrophobicContact CE2-CG 4.36Å; Y66-E68 WeakPolarHBondContact CE2-OE2 3.48Å; Y66-E68 PolarHBondContact OH-OE2 3.06Å
67	C	96.3	Very high	89.8	Confident	20 Å²	20	58.7 Å²	58.7	14%	0.135	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130.3	178.2	-63	0	0	0	0	110.1	K39 P106 V133 C136	K39-C67 WeakPolarHBondContact O-CA 3.47Å; C67-P106 HydrophobicContact CB-CG 4.49Å; C67-P106 VanDerWaalsContact SG-CA 3.51Å; C67-P106 VanDerWaalsContact SG-N 3.36Å; C67-V133 VanDerWaalsContact SG-CG1 3.54Å; C67-C136 WeakPolarHBondContact CA-SG 3.46Å; C67-C136 HydrophobicContact CB-CB 3.75Å; C67-C136 WeakPolarHBondContact CB-SG 3.29Å; C67-C136 VanDerWaalsContact SG-CA 3.5Å; C67-C136 WeakPolarHBondContact SG-CB 3.25Å; C67-C136 CovalentContact SG-SG 2.03Å; C67-C136 PolarHBondContact SG-SG 3.25Å
68	E	95.1	Very high	88.4	Confident	99 Å²	99	64.5 Å²	64.5	46%	0.463	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	151	177.7	171.3	178.8	-152.9	0	0	109.8	K39 H41 Y66	K39-E68 PolarHBondContact N-O 2.65Å; K39-E68 PolarHBondContact O-N 3.08Å; K39-E68 VanDerWaalsContact O-N 3.13Å; H41-E68 PolarHBondContact NE2-O 3.47Å; Y66-E68 HydrophobicContact CD2-CB 4.04Å; Y66-E68 HydrophobicContact CE2-CB 3.55Å; Y66-E68 HydrophobicContact CE2-CG 4.36Å; Y66-E68 WeakPolarHBondContact CE2-OE2 3.48Å; Y66-E68 PolarHBondContact OH-OE2 3.06Å
69	G	91.9	Very high	87.4	Confident	25 Å²	25	63.3 Å²	63.3	26%	0.258	33%	0.332	S	S	.	.	S	Bend	trans	133.6	177.6	175.8	0	0	0	0	0	111.9	Q36 C104	Q36-G69 CarbonylContact O-C 3.6Å; Q36-G69 WeakPolarHBondContact O-CA 3.21Å; G69-C104 WeakPolarHBondContact O-CB 3.41Å
70	E	90.8	Very high	86.8	Confident	56 Å²	56	65.1 Å²	65.1	26%	0.262	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-86.3	141.8	-177.3	-69.3	-151.5	176.6	0	0	113.7	R35 Q36 C38 K101	R35-E70 HydrophobicContact CB-CG 3.66Å; Q36-E70 PolarHBondContact O-N 2.84Å; C38-E70 PolarHBondContact N-O 2.87Å; E70-K101 IonicContact OE1-NZ 3.77Å; E70-K101 IonicContact OE2-NZ 2.85Å; E70-K101 PolarHBondContact OE2-NZ 3.11Å
71	C	91.6	Very high	86.5	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.02	31%	0.314	C	S	.	.			trans	-108.6	73.9	168	-67.8	0	0	0	0	108.8	L75 P102 C138	C71-L75 HydrophobicContact CB-CD2 4.11Å; C71-P102 HydrophobicContact CB-CB 4.14Å; C71-P102 WeakPolarHBondContact CB-O 3.19Å; C71-C138 VanDerWaalsContact CA-SG 3.57Å; C71-C138 HydrophobicContact CB-CB 3.72Å; C71-C138 WeakPolarHBondContact CB-SG 3.44Å; C71-C138 VanDerWaalsContact SG-CA 3.53Å; C71-C138 WeakPolarHBondContact SG-CB 3.45Å; C71-C138 CovalentContact SG-SG 2.03Å; C71-C138 PolarHBondContact SG-SG 2.81Å
72	A	83.5	Confident	86.1	Confident	33 Å²	33	60.6 Å²	60.6	27%	0.273	32%	0.324	S	S	.	.			trans	-114.6	155.7	-179.5	0	0	0	0	0	111.2	P74 L75	A72-P74 CarbonylContact O-C 3.54Å; A72-L75 PolarHBondContact O-N 2.99Å
73	F	74.3	Confident	85.8	Confident	136 Å²	136	65.6 Å²	65.6	60%	0.596	35%	0.353	S	S	*	.	S	Bend	trans	-69.4	141.1	178.7	-172.1	-88.9	0	0	0	111.3	T89 L90	F73-T89 HydrophobicContact CB-CG2 3.87Å; F73-L90 HydrophobicContact CD2-CD2 3.96Å; F73-L90 HydrophobicContact CE2-CD2 3.96Å
74	P	75	Confident	85.6	Confident	95 Å²	95	69.6 Å²	69.6	62%	0.617	36%	0.364	S	S	*	.	S	Bend	cis	-77.2	127.8	-5.8	30	-32.4	0	0	0	111.9	A72 N76	A72-P74 CarbonylContact O-C 3.54Å; P74-N76 PolarHBondContact O-N 3.01Å
75	L	73.3	Confident	85.4	Confident	32 Å²	32	69.3 Å²	69.3	17%	0.168	36%	0.362	C	S	.	.			trans	-66.1	111.9	170	-65.9	-180	0	0	0	107.7	C71 A72 M79 A81 I86 C138	C71-L75 HydrophobicContact CB-CD2 4.11Å; A72-L75 PolarHBondContact O-N 2.99Å; L75-M79 HydrophobicContact CB-SD 4.49Å; L75-M79 HydrophobicContact CD2-SD 3.82Å; L75-A81 HydrophobicContact CB-CB 4.23Å; L75-A81 HydrophobicContact CD1-CB 3.65Å; L75-A81 HydrophobicContact CG-CB 4.49Å; L75-I86 HydrophobicContact CD1-CG1 3.96Å; L75-C138 HydrophobicContact CD2-CB 4.37Å
76	N	67.4	Low	85	Confident	63 Å²	63	69.1 Å²	69.1	34%	0.337	37%	0.365	S	S	.	.			trans	-74.3	159.4	-179.6	63.4	33.5	0	0	0	110.4	P74 Y78 M79	P74-N76 PolarHBondContact O-N 3.01Å; N76-Y78 HydrophobicContact CB-CD2 4.37Å; N76-Y78 PolarHBondContact O-N 2.03Å; N76-Y78 VanDerWaalsContact O-N 3.09Å; N76-Y78 WeakPolarHBondContact OD1-CB 3.45Å; N76-Y78 PolarHBondContact OD1-N 2.03Å; N76-M79 PolarHBondContact O-N 3.13Å; N76-M79 VanDerWaalsContact O-N 3.1Å; N76-M79 WeakPolarHBondContact OD1-CG 3.41Å; N76-M79 PolarHBondContact OD1-N 3.06Å
77	S	66.3	Low	84.8	Confident	103 Å²	103	68.9 Å²	68.9	72%	0.72	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-59.7	-21.7	178	51	0	0	0	0	113.2	M79	S77-M79 VanDerWaalsContact C-N 3.32Å
78	Y	68.1	Low	84.7	Confident	193 Å²	193	69.7 Å²	69.7	76%	0.757	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-75.4	-18	179.2	-55.8	-75.9	0	0	0	113.6	N76 N80	N76-Y78 HydrophobicContact CB-CD2 4.37Å; N76-Y78 PolarHBondContact O-N 2.03Å; N76-Y78 VanDerWaalsContact O-N 3.09Å; N76-Y78 WeakPolarHBondContact OD1-CB 3.45Å; N76-Y78 PolarHBondContact OD1-N 2.03Å; Y78-N80 VanDerWaalsContact C-N 3.3Å; Y78-N80 PolarHBondContact O-N 3Å
79	M	77.4	Confident	84.5	Confident	12 Å²	12	65.3 Å²	65.3	6%	0.059	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-84.2	5.5	179.5	-75.9	163.2	-173.5	0	0	113.9	A37 C38 L75 N76 S77 A81 G137 C138	A37-M79 HydrophobicContact CB-CE 3.33Å; C38-M79 HydrophobicContact CB-CG 4.38Å; L75-M79 HydrophobicContact CB-SD 4.49Å; L75-M79 HydrophobicContact CD2-SD 3.82Å; N76-M79 PolarHBondContact O-N 3.13Å; N76-M79 VanDerWaalsContact O-N 3.1Å; N76-M79 WeakPolarHBondContact OD1-CG 3.41Å; N76-M79 PolarHBondContact OD1-N 3.06Å; S77-M79 VanDerWaalsContact C-N 3.32Å; M79-A81 PolarHBondContact O-N 3.27Å; M79-G137 CarbonylContact O-C 3.57Å; M79-G137 WeakPolarHBondContact O-CA 3.33Å; M79-C138 PolarHBondContact O-N 3.09Å
80	N	85.3	Confident	84.5	Confident	86 Å²	86	68 Å²	68	46%	0.46	36%	0.362	S	S	.	.			trans	43.6	39	177.9	-64	-55.8	0	0	0	113.8	Y78 C136	Y78-N80 VanDerWaalsContact C-N 3.3Å; Y78-N80 PolarHBondContact O-N 3Å; N80-C136 PolarHBondContact ND2-O 3.19Å
81	A	89.7	Confident	84.7	Confident	28 Å²	28	68.2 Å²	68.2	23%	0.231	37%	0.367	C	S	.	.			trans	-72.2	139.4	-171.4	0	0	0	0	0	111.7	L75 M79 A85 I86 C138	L75-A81 HydrophobicContact CB-CB 4.23Å; L75-A81 HydrophobicContact CD1-CB 3.65Å; L75-A81 HydrophobicContact CG-CB 4.49Å; M79-A81 PolarHBondContact O-N 3.27Å; A81-A85 HydrophobicContact CB-CB 4.44Å; A81-I86 HydrophobicContact CB-CG1 4.18Å; A81-C138 WeakPolarHBondContact CA-O 3.46Å; A81-C138 HydrophobicContact CB-CB 4.14Å
82	T	90.9	Very high	84.7	Confident	49 Å²	49	69.9 Å²	69.9	30%	0.301	38%	0.375	S	S	.	.			trans	-73.9	158	170.7	67.6	0	0	0	0	111	H84 A85 I86 C138 H139	T82-H84 PolarHBondContact O-N 3.1Å; T82-A85 PolarHBondContact O-N 2.95Å; T82-A85 PolarHBondContact OG1-N 2.97Å; T82-I86 WeakPolarHBondContact O-CG1 3.1Å; T82-I86 PolarHBondContact O-N 2.95Å; T82-C138 PolarHBondContact N-O 3.12Å; T82-H139 VanDerWaalsContact CG2-CE1 3.45Å; T82-H139 WeakPolarHBondContact CG2-CE1 3.34Å; T82-H139 WeakPolarHBondContact CG2-ND1 3.37Å
83	N	91.8	Very high	85	Confident	139 Å²	139	76.5 Å²	76.5	74%	0.743	40%	0.398	S	S	*	.	H	α-helix	trans	-54.8	-36.6	171.2	-70.7	-17.1	0	0	0	111.8	I86 V87	N83-I86 PolarHBondContact O-N 3.25Å; N83-V87 WeakPolarHBondContact O-CG2 3.33Å; N83-V87 PolarHBondContact O-N 2.81Å
84	H	93.9	Very high	86	Confident	124 Å²	124	76.6 Å²	76.6	57%	0.574	40%	0.403	S	S	*	.	H	α-helix	trans	-63.5	-46.2	175.4	-176.2	-86.3	0	0	0	111.6	T82 I86 V87 Q88	T82-H84 PolarHBondContact O-N 3.1Å; H84-I86 VanDerWaalsContact C-N 3.3Å; H84-I86 PolarHBondContact O-N 2.9Å; H84-V87 PolarHBondContact O-N 3.15Å; H84-Q88 PolarHBondContact CE1-OE1 3.2Å; H84-Q88 VanDerWaalsContact O-CB 3.31Å; H84-Q88 WeakPolarHBondContact O-CB 3.23Å; H84-Q88 PolarHBondContact O-N 3.44Å
85	A	93.9	Very high	86.9	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-62	-37	176.9	0	0	0	0	0	112.3	A81 T82 T89 P102 C138	A81-A85 HydrophobicContact CB-CB 4.44Å; T82-A85 PolarHBondContact O-N 2.95Å; T82-A85 PolarHBondContact OG1-N 2.97Å; A85-T89 WeakPolarHBondContact O-CB 3.16Å; A85-T89 PolarHBondContact O-N 3.41Å; A85-T89 PolarHBondContact O-OG1 3.07Å; A85-P102 HydrophobicContact CB-CB 3.98Å; A85-P102 HydrophobicContact CB-CG 3.98Å; A85-P102 VanDerWaalsContact O-CG 3.28Å; A85-P102 WeakPolarHBondContact O-CG 2.98Å; A85-C138 HydrophobicContact CB-CB 4.49Å; A85-C138 VanDerWaalsContact CB-O 3.26Å; A85-C138 WeakPolarHBondContact CB-O 3.31Å
86	I	91.4	Very high	87.9	Confident	66 Å²	66	77.1 Å²	77.1	34%	0.338	41%	0.405	S	S	.	.	H	α-helix	trans	-62.1	-52.2	173.4	-64.2	166.5	0	0	0	110.3	L75 A81 T82 N83 H84 Q88 T89 L90	L75-I86 HydrophobicContact CD1-CG1 3.96Å; A81-I86 HydrophobicContact CB-CG1 4.18Å; T82-I86 WeakPolarHBondContact O-CG1 3.1Å; T82-I86 PolarHBondContact O-N 2.95Å; N83-I86 PolarHBondContact O-N 3.25Å; H84-I86 VanDerWaalsContact C-N 3.3Å; H84-I86 PolarHBondContact O-N 2.9Å; I86-Q88 PolarHBondContact O-N 3.36Å; I86-T89 WeakPolarHBondContact O-CB 3.08Å; I86-T89 PolarHBondContact O-N 3.48Å; I86-L90 HydrophobicContact CG2-CD1 4.38Å; I86-L90 WeakPolarHBondContact O-CG 3.42Å; I86-L90 PolarHBondContact O-N 2.92Å
87	V	93	Very high	89.2	Confident	84 Å²	84	82.5 Å²	82.5	51%	0.509	43%	0.428	S	S	.	.	H	α-helix	trans	-60.3	-45.4	178.6	172.4	0	0	0	0	111	N83 H84 T89 L90 V91	N83-V87 WeakPolarHBondContact O-CG2 3.33Å; N83-V87 PolarHBondContact O-N 2.81Å; H84-V87 PolarHBondContact O-N 3.15Å; V87-T89 VanDerWaalsContact C-N 3.3Å; V87-T89 PolarHBondContact O-N 3.24Å; V87-L90 WeakPolarHBondContact O-CB 3.04Å; V87-L90 PolarHBondContact O-N 3.49Å; V87-L90 VanDerWaalsContact O-N 3.11Å; V87-V91 HydrophobicContact CG1-CG2 4.29Å; V87-V91 WeakPolarHBondContact O-CG2 3.04Å; V87-V91 PolarHBondContact O-N 2.03Å
88	Q	93.8	Very high	90.6	Very high	38 Å²	38	82 Å²	82	18%	0.178	42%	0.42	C	S	.	.	H	α-helix	trans	-60.1	-40.1	177.7	-178.8	177.2	-25.7	0	0	111.7	H84 I86 L90 V91 H92 V99 P100 P102	H84-Q88 PolarHBondContact CE1-OE1 3.2Å; H84-Q88 VanDerWaalsContact O-CB 3.31Å; H84-Q88 WeakPolarHBondContact O-CB 3.23Å; H84-Q88 PolarHBondContact O-N 3.44Å; I86-Q88 PolarHBondContact O-N 3.36Å; Q88-L90 VanDerWaalsContact C-N 3.34Å; Q88-L90 PolarHBondContact O-N 3.36Å; Q88-V91 PolarHBondContact O-N 2.78Å; Q88-H92 VanDerWaalsContact O-CB 3.31Å; Q88-H92 WeakPolarHBondContact O-CB 3.03Å; Q88-H92 PolarHBondContact O-N 3.47Å; Q88-V99 HydrophobicContact CG-CG1 3.9Å; Q88-P100 PolarHBondContact NE2-O 2.98Å; Q88-P102 HydrophobicContact CB-CG 4.25Å; Q88-P102 HydrophobicContact CG-CG 4.25Å
89	T	91.4	Very high	91.9	Very high	6 Å²	6	74.5 Å²	74.5	4%	0.037	39%	0.394	C	S	.	.	H	α-helix	trans	-62.6	-41.4	175.1	-55.1	0	0	0	0	111.5	F73 A85 I86 V87 H92 F93 P102	F73-T89 HydrophobicContact CB-CG2 3.87Å; A85-T89 WeakPolarHBondContact O-CB 3.16Å; A85-T89 PolarHBondContact O-N 3.41Å; A85-T89 PolarHBondContact O-OG1 3.07Å; I86-T89 WeakPolarHBondContact O-CB 3.08Å; I86-T89 PolarHBondContact O-N 3.48Å; V87-T89 VanDerWaalsContact C-N 3.3Å; V87-T89 PolarHBondContact O-N 3.24Å; T89-H92 PolarHBondContact O-N 2.85Å; T89-F93 PolarHBondContact O-N 3.46Å; T89-P102 WeakPolarHBondContact OG1-CD 3.46Å; T89-P102 VanDerWaalsContact OG1-CG 3.26Å; T89-P102 WeakPolarHBondContact OG1-CG 3.41Å
90	L	92.1	Very high	92.7	Very high	82 Å²	82	78.1 Å²	78.1	43%	0.429	42%	0.419	S	S	.	.	H	α-helix	trans	-65.2	-40.9	176.3	-65.4	171.2	0	0	0	111.8	F73 I86 V87 Q88 F93 I94	F73-L90 HydrophobicContact CD2-CD2 3.96Å; F73-L90 HydrophobicContact CE2-CD2 3.96Å; I86-L90 HydrophobicContact CG2-CD1 4.38Å; I86-L90 WeakPolarHBondContact O-CG 3.42Å; I86-L90 PolarHBondContact O-N 2.92Å; V87-L90 WeakPolarHBondContact O-CB 3.04Å; V87-L90 PolarHBondContact O-N 3.49Å; V87-L90 VanDerWaalsContact O-N 3.11Å; Q88-L90 VanDerWaalsContact C-N 3.34Å; Q88-L90 PolarHBondContact O-N 3.36Å; L90-F93 WeakPolarHBondContact O-CB 3.12Å; L90-F93 PolarHBondContact O-N 3.29Å; L90-I94 PolarHBondContact O-N 3.24Å
91	V	94	Very high	93.1	Very high	61 Å²	61	77.8 Å²	77.8	37%	0.37	41%	0.414	S	S	.	.	H	α-helix	trans	-70.4	-39.6	177.4	-179	0	0	0	0	111.2	V87 Q88 F93 I94 N95 V99	V87-V91 HydrophobicContact CG1-CG2 4.29Å; V87-V91 WeakPolarHBondContact O-CG2 3.04Å; V87-V91 PolarHBondContact O-N 2.03Å; Q88-V91 PolarHBondContact O-N 2.78Å; V91-F93 VanDerWaalsContact C-N 3.26Å; V91-F93 PolarHBondContact O-N 3.38Å; V91-I94 PolarHBondContact O-N 3.5Å; V91-N95 PolarHBondContact O-N 3.05Å; V91-V99 HydrophobicContact CB-CG1 4.39Å; V91-V99 HydrophobicContact CG1-CB 4.21Å; V91-V99 HydrophobicContact CG1-CG1 4.25Å; V91-V99 HydrophobicContact CG1-CG2 3.71Å
92	H	93.3	Very high	93.3	Very high	38 Å²	38	76.9 Å²	76.9	18%	0.176	41%	0.405	C	S	.	.	H	α-helix	trans	-57.1	-40.2	172.8	174	73	0	0	0	111.5	Q88 T89 I94 N95 P96 V99 K101	Q88-H92 VanDerWaalsContact O-CB 3.31Å; Q88-H92 WeakPolarHBondContact O-CB 3.03Å; Q88-H92 PolarHBondContact O-N 3.47Å; T89-H92 PolarHBondContact O-N 2.85Å; H92-I94 PolarHBondContact O-N 2.91Å; H92-N95 CarbonylContact O-C 3.47Å; H92-N95 PolarHBondContact O-N 3.45Å; H92-P96 VanDerWaalsContact O-CA 3.29Å; H92-P96 WeakPolarHBondContact O-CA 3.44Å; H92-P96 WeakPolarHBondContact O-CB 3.01Å; H92-P96 WeakPolarHBondContact O-CD 2.94Å; H92-P96 VanDerWaalsContact O-N 3.11Å; H92-V99 HydrophobicContact CB-CG1 4.3Å; H92-V99 PolarHBondContact ND1-O 3.48Å; H92-K101 VanDerWaalsContact CD2-CG 3.41Å; H92-K101 WeakPolarHBondContact CD2-CG 3.06Å; H92-K101 VanDerWaalsContact NE2-CG 3.25Å; H92-K101 WeakPolarHBondContact NE2-CG 3.44Å
93	F	89.9	Confident	93.5	Very high	172 Å²	172	78.7 Å²	78.7	75%	0.754	42%	0.419	S	S	*	.	H	α-helix	trans	-61.5	-30.5	175.8	-174.2	-97.3	0	0	0	113.1	T89 L90 V91	T89-F93 PolarHBondContact O-N 3.46Å; L90-F93 WeakPolarHBondContact O-CB 3.12Å; L90-F93 PolarHBondContact O-N 3.29Å; V91-F93 VanDerWaalsContact C-N 3.26Å; V91-F93 PolarHBondContact O-N 3.38Å
94	I	93.8	Very high	93.7	Very high	137 Å²	137	73.3 Å²	73.3	70%	0.703	39%	0.392	S	S	*	.	H	α-helix	trans	-83.9	-41	178.8	-61.4	167.6	0	0	0	111.3	L90 V91 H92	L90-I94 PolarHBondContact O-N 3.24Å; V91-I94 PolarHBondContact O-N 3.5Å; H92-I94 PolarHBondContact O-N 2.91Å
95	N	94.5	Very high	93.8	Very high	72 Å²	72	68.8 Å²	68.8	39%	0.385	38%	0.376	S	S	.	.			trans	-140.3	71.5	-174	-162.2	11.2	0	0	0	113.1	V91 H92 E97 T98 V99	V91-N95 PolarHBondContact O-N 3.05Å; H92-N95 CarbonylContact O-C 3.47Å; H92-N95 PolarHBondContact O-N 3.45Å; N95-E97 VanDerWaalsContact C-N 3.27Å; N95-E97 PolarHBondContact O-N 2.94Å; N95-T98 VanDerWaalsContact ND2-CG2 3.34Å; N95-T98 WeakPolarHBondContact ND2-CG2 3.4Å; N95-T98 PolarHBondContact ND2-OG1 3.31Å; N95-T98 PolarHBondContact O-N 3.48Å; N95-T98 PolarHBondContact O-OG1 3.05Å; N95-T98 VanDerWaalsContact O-OG1 3.12Å; N95-V99 PolarHBondContact O-N 3.47Å
96	P	93.4	Very high	94	Very high	67 Å²	67	71.7 Å²	71.7	44%	0.435	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-25.7	-170.1	25.6	-34.9	0	0	0	113.9	H92 T98	H92-P96 VanDerWaalsContact O-CA 3.29Å; H92-P96 WeakPolarHBondContact O-CA 3.44Å; H92-P96 WeakPolarHBondContact O-CB 3.01Å; H92-P96 WeakPolarHBondContact O-CD 2.94Å; H92-P96 VanDerWaalsContact O-N 3.11Å; P96-T98 PolarHBondContact O-N 2.71Å
97	E	95.6	Very high	94.1	Very high	176 Å²	176	70.7 Å²	70.7	82%	0.822	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-20.8	179.1	-61.8	-56.7	128.7	0	0	113.1	N95	N95-E97 VanDerWaalsContact C-N 3.27Å; N95-E97 PolarHBondContact O-N 2.94Å
98	T	95.9	Very high	94.3	Very high	91 Å²	91	70.6 Å²	70.6	56%	0.558	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.2	-31.4	-174.4	65.4	0	0	0	0	113.5	N95 P96	N95-T98 VanDerWaalsContact ND2-CG2 3.34Å; N95-T98 WeakPolarHBondContact ND2-CG2 3.4Å; N95-T98 PolarHBondContact ND2-OG1 3.31Å; N95-T98 PolarHBondContact O-N 3.48Å; N95-T98 PolarHBondContact O-OG1 3.05Å; N95-T98 VanDerWaalsContact O-OG1 3.12Å; P96-T98 PolarHBondContact O-N 2.71Å
99	V	95.4	Very high	94.5	Very high	36 Å²	36	72 Å²	72	22%	0.218	39%	0.394	C	S	.	.	S	Bend	trans	-117.1	120.6	-177.1	177	0	0	0	0	108	Q88 V91 H92 N95	Q88-V99 HydrophobicContact CG-CG1 3.9Å; V91-V99 HydrophobicContact CB-CG1 4.39Å; V91-V99 HydrophobicContact CG1-CB 4.21Å; V91-V99 HydrophobicContact CG1-CG1 4.25Å; V91-V99 HydrophobicContact CG1-CG2 3.71Å; H92-V99 HydrophobicContact CB-CG1 4.3Å; H92-V99 PolarHBondContact ND1-O 3.48Å; N95-V99 PolarHBondContact O-N 3.47Å
100	P	94.7	Very high	94.8	Very high	89 Å²	89	75.8 Å²	75.8	58%	0.578	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-76.8	160.4	177.4	31.5	-34.7	0	0	0	112	Q88	Q88-P100 PolarHBondContact NE2-O 2.98Å
101	K	92.4	Very high	95.1	Very high	79 Å²	79	73.6 Å²	73.6	34%	0.343	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-59.3	150.4	165.9	-65.1	-177.8	-179.5	175.5	0	110.1	E70 H92	E70-K101 IonicContact OE1-NZ 3.77Å; E70-K101 IonicContact OE2-NZ 2.85Å; E70-K101 PolarHBondContact OE2-NZ 3.11Å; H92-K101 VanDerWaalsContact CD2-CG 3.41Å; H92-K101 WeakPolarHBondContact CD2-CG 3.06Å; H92-K101 VanDerWaalsContact NE2-CG 3.25Å; H92-K101 WeakPolarHBondContact NE2-CG 3.44Å
102	P	94.4	Very high	95.3	Very high	8 Å²	8	71.8 Å²	71.8	5%	0.052	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-58.3	156.7	167.3	-21.1	32.4	0	0	0	112	C71 A85 Q88 T89 C138 H139	C71-P102 HydrophobicContact CB-CB 4.14Å; C71-P102 WeakPolarHBondContact CB-O 3.19Å; A85-P102 HydrophobicContact CB-CB 3.98Å; A85-P102 HydrophobicContact CB-CG 3.98Å; A85-P102 VanDerWaalsContact O-CG 3.28Å; A85-P102 WeakPolarHBondContact O-CG 2.98Å; Q88-P102 HydrophobicContact CB-CG 4.25Å; Q88-P102 HydrophobicContact CG-CG 4.25Å; T89-P102 WeakPolarHBondContact OG1-CD 3.46Å; T89-P102 VanDerWaalsContact OG1-CG 3.26Å; T89-P102 WeakPolarHBondContact OG1-CG 3.41Å; P102-C138 HydrophobicContact CB-CB 4.46Å; P102-H139 WeakPolarHBondContact CB-O 3.38Å
103	C	95.1	Very high	95.6	Very high	88 Å²	88	73.3 Å²	73.3	60%	0.595	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-93.1	142.5	-178.7	-71.1	0	0	0	0	111.2	A105 C138 H139	C103-A105 PolarHBondContact O-N 3.46Å; C103-C138 WeakPolarHBondContact O-CA 2.99Å; C103-H139 PolarHBondContact N-O 3.07Å; C103-H139 PolarHBondContact O-N 3.23Å
104	C	95.5	Very high	96	Very high	25 Å²	25	65.3 Å²	65.3	17%	0.169	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	114.8	167.9	-175.3	0	0	0	0	109.5	C38 G69	C38-C104 WeakPolarHBondContact CA-SG 3.26Å; C38-C104 HydrophobicContact CB-CB 3.67Å; C38-C104 WeakPolarHBondContact CB-SG 3.44Å; C38-C104 VanDerWaalsContact SG-CA 3.53Å; C38-C104 WeakPolarHBondContact SG-CB 3.46Å; C38-C104 CovalentContact SG-SG 2.03Å; C38-C104 PolarHBondContact SG-SG 2.92Å; G69-C104 WeakPolarHBondContact O-CB 3.41Å
105	A	96.6	Very high	96.2	Very high	30 Å²	30	61.3 Å²	61.3	25%	0.248	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	161.2	-173.2	0	0	0	0	0	112.8	C103 T107 C136 G137	C103-A105 PolarHBondContact O-N 3.46Å; A105-T107 PolarHBondContact O-N 3.22Å; A105-C136 WeakPolarHBondContact O-CA 3.33Å; A105-G137 PolarHBondContact N-O 3.37Å; A105-G137 PolarHBondContact O-N 3.18Å
106	P	96.9	Very high	96.4	Very high	60 Å²	60	59.6 Å²	59.6	39%	0.39	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	131.7	173.2	-22.2	34.2	0	0	0	112	C67 L109 V133	C67-P106 HydrophobicContact CB-CG 4.49Å; C67-P106 VanDerWaalsContact SG-CA 3.51Å; C67-P106 VanDerWaalsContact SG-N 3.36Å; P106-L109 HydrophobicContact CB-CD1 4.1Å; P106-L109 HydrophobicContact CB-CD2 4.13Å; P106-L109 HydrophobicContact CB-CG 4.08Å; P106-V133 HydrophobicContact CB-CG1 4.17Å; P106-V133 HydrophobicContact CB-CG2 3.98Å; P106-V133 HydrophobicContact CG-CG1 4.44Å; P106-V133 HydrophobicContact CG-CG2 3.71Å
107	T	95.2	Very high	96.6	Very high	45 Å²	45	60.9 Å²	60.9	28%	0.276	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-23.2	178.4	61.8	0	0	0	0	112.6	A105 A135 H139	A105-T107 PolarHBondContact O-N 3.22Å; T107-A135 PolarHBondContact N-O 3.34Å; T107-A135 PolarHBondContact OG1-O 3.46Å; T107-H139 WeakPolarHBondContact CG2-NE2 3.45Å
108	Q	96.3	Very high	96.6	Very high	83 Å²	83	54.7 Å²	54.7	39%	0.388	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	132.7	174.8	-60.6	179.8	26.8	0	0	108.8	R134 A135	Q108-R134 HydrophobicContact CB-CB 4.09Å; Q108-R134 WeakPolarHBondContact O-CB 3.38Å; Q108-R134 PolarHBondContact O-N 2.9Å; Q108-A135 HydrophobicContact CB-CB 4.08Å; Q108-A135 HydrophobicContact CG-CB 4.24Å; Q108-A135 PolarHBondContact O-N 3.35Å
109	L	98.3	Very high	96.6	Very high	67 Å²	67	58.8 Å²	58.8	35%	0.351	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	144.6	177.9	-58.3	107	0	0	0	111.7	P106 N130 V132 V133	P106-L109 HydrophobicContact CB-CD1 4.1Å; P106-L109 HydrophobicContact CB-CD2 4.13Å; P106-L109 HydrophobicContact CB-CG 4.08Å; L109-N130 HydrophobicContact CB-CB 4.18Å; L109-N130 HydrophobicContact CD1-CB 4.48Å; L109-N130 HydrophobicContact CD2-CB 4.36Å; L109-V132 CarbonylContact C-O 3.54Å; L109-V132 WeakPolarHBondContact CA-O 3.38Å; L109-V133 HydrophobicContact CD2-CG2 4.34Å
110	N	98.4	Very high	96.6	Very high	85 Å²	85	61.3 Å²	61.3	46%	0.455	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	160.9	173.8	-75.1	-4.7	0	0	0	111	M131 V132	N110-M131 PolarHBondContact O-N 2.8Å; N110-V132 HydrophobicContact CB-CB 4.13Å; N110-V132 PolarHBondContact N-O 2.91Å; N110-V132 PolarHBondContact O-N 3.48Å; N110-V132 VanDerWaalsContact O-N 3.1Å
111	A	98.3	Very high	96.6	Very high	37 Å²	37	61.5 Å²	61.5	31%	0.306	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	156.3	174.7	0	0	0	0	0	111.5	K127 Y128 R129	A111-K127 HydrophobicContact CB-CD 4.35Å; A111-K127 HydrophobicContact CB-CG 3.94Å; A111-Y128 CarbonylContact C-O 3.45Å; A111-Y128 WeakPolarHBondContact CA-O 3.35Å; A111-Y128 VanDerWaalsContact CB-O 3.23Å; A111-Y128 WeakPolarHBondContact CB-O 3.34Å; A111-R129 HydrophobicContact CB-CG 4.36Å
112	I	98.4	Very high	96.8	Very high	23 Å²	23	61.9 Å²	61.9	12%	0.118	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	158.3	166	65.5	175.7	0	0	0	109.8	F47 Y62 V114 K127 Y128 M131 V132	F47-I112 HydrophobicContact CZ-CD1 4.23Å; Y62-I112 HydrophobicContact CD1-CD1 3.76Å; Y62-I112 HydrophobicContact CD2-CD1 4.08Å; Y62-I112 HydrophobicContact CD2-CG2 3.97Å; Y62-I112 HydrophobicContact CE1-CD1 3.86Å; Y62-I112 HydrophobicContact CE2-CD1 4.16Å; Y62-I112 HydrophobicContact CE2-CG2 4.44Å; Y62-I112 HydrophobicContact CG-CD1 3.88Å; Y62-I112 HydrophobicContact CG-CG2 4.41Å; I112-V114 HydrophobicContact CD1-CG2 3.86Å; I112-V114 HydrophobicContact CG1-CG2 4.03Å; I112-K127 CarbonylContact O-C 3.57Å; I112-K127 WeakPolarHBondContact O-CA 3.31Å; I112-Y128 PolarHBondContact N-O 3Å; I112-Y128 PolarHBondContact O-N 3.38Å; I112-M131 HydrophobicContact CD1-CB 4.08Å; I112-M131 HydrophobicContact CD1-CE 3.95Å; I112-M131 HydrophobicContact CD1-CG 4.23Å; I112-M131 HydrophobicContact CG1-CB 3.84Å; I112-M131 HydrophobicContact CG1-CG 3.9Å; I112-M131 HydrophobicContact CG2-CB 4.22Å; I112-V132 HydrophobicContact CG2-CG2 3.51Å
113	S	98.4	Very high	97	Very high	69 Å²	69	65.8 Å²	65.8	48%	0.483	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	133.5	168.6	-62.8	0	0	0	0	108.9	K126	S113-K126 CarbonylContact C-O 3.53Å; S113-K126 WeakPolarHBondContact CA-O 3.25Å
114	V	98.3	Very high	97.1	Very high	5 Å²	5	64.1 Å²	64.1	3%	0.03	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.5	179.6	-177.3	0	0	0	0	108.3	F47 I56 A58 I112 Y116 K126 Y128	F47-V114 HydrophobicContact CZ-CG2 4.43Å; I56-V114 HydrophobicContact CD1-CG1 4.19Å; I56-V114 HydrophobicContact CG1-CG1 4.21Å; I56-V114 HydrophobicContact CG2-CG1 3.87Å; A58-V114 WeakPolarHBondContact O-CA 3.41Å; I112-V114 HydrophobicContact CD1-CG2 3.86Å; I112-V114 HydrophobicContact CG1-CG2 4.03Å; V114-Y116 HydrophobicContact CG1-CD1 4.39Å; V114-K126 PolarHBondContact N-O 3.4Å; V114-K126 PolarHBondContact O-N 2.99Å; V114-Y128 HydrophobicContact CB-CD2 4Å; V114-Y128 HydrophobicContact CB-CE2 3.99Å; V114-Y128 HydrophobicContact CG2-CD2 3.81Å; V114-Y128 HydrophobicContact CG2-CE2 4.22Å
115	L	98.4	Very high	97.2	Very high	52 Å²	52	69 Å²	69	27%	0.272	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	123.6	171.8	-171	70.9	0	0	0	107.8	I57 A58 V123 I124 L125	I57-L115 WeakPolarHBondContact CA-O 3.5Å; I57-L115 HydrophobicContact CB-CB 4.36Å; I57-L115 HydrophobicContact CB-CD2 4.11Å; I57-L115 HydrophobicContact CB-CG 4.11Å; I57-L115 WeakPolarHBondContact CB-O 3.47Å; I57-L115 HydrophobicContact CD1-CD2 4.47Å; I57-L115 HydrophobicContact CD1-CG 4.17Å; I57-L115 HydrophobicContact CG2-CD2 3.83Å; I57-L115 HydrophobicContact CG2-CG 4.38Å; I57-L115 PolarHBondContact N-O 2.84Å; A58-L115 HydrophobicContact CB-CB 4.2Å; A58-L115 PolarHBondContact N-O 3.33Å; A58-L115 VanDerWaalsContact N-O 3.07Å; A58-L115 PolarHBondContact O-N 2.78Å; L115-V123 HydrophobicContact CD1-CG1 3.55Å; L115-V123 HydrophobicContact CD2-CG1 4.4Å; L115-V123 HydrophobicContact CG-CG1 4.01Å; L115-I124 WeakPolarHBondContact CA-O 3.39Å; L115-L125 HydrophobicContact CB-CD1 4.35Å; L115-L125 HydrophobicContact CD1-CB 3.96Å; L115-L125 HydrophobicContact CD1-CD1 4.28Å
116	Y	98.1	Very high	97.3	Very high	36 Å²	36	72.2 Å²	72.2	14%	0.141	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	162.5	-174.6	70.9	-81.4	0	0	0	111.9	W55 V114 I124 K126 Y128	W55-Y116 HydrophobicContact CE3-CD2 4.08Å; W55-Y116 HydrophobicContact CE3-CG 4.24Å; W55-Y116 HydrophobicContact CZ3-CD2 4.3Å; W55-Y116 HydrophobicContact CZ3-CG 4.29Å; W55-Y116 CarbonylContact O-C 3.48Å; W55-Y116 WeakPolarHBondContact O-CA 3.4Å; W55-Y116 VanDerWaalsContact O-CB 3.25Å; W55-Y116 WeakPolarHBondContact O-CB 3.37Å; V114-Y116 HydrophobicContact CG1-CD1 4.39Å; Y116-I124 HydrophobicContact CD1-CB 4.37Å; Y116-I124 HydrophobicContact CE1-CB 3.94Å; Y116-I124 HydrophobicContact CE1-CG2 3.82Å; Y116-I124 HydrophobicContact CE2-CB 4.41Å; Y116-I124 PolarHBondContact N-O 3.06Å; Y116-I124 PolarHBondContact O-N 3.05Å; Y116-K126 HydrophobicContact CE1-CB 3.78Å; Y116-K126 HydrophobicContact CE1-CD 4.26Å; Y116-Y128 HydrophobicContact CE1-CE2 4.44Å
117	F	97.9	Very high	97.4	Very high	94 Å²	94	76.3 Å²	76.3	41%	0.412	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	129	169.4	-68	-69.7	0	0	0	110.5	W55 I57 N122 V123	W55-F117 PolarHBondContact O-N 3.3Å; I57-F117 HydrophobicContact CD1-CD1 4.14Å; I57-F117 HydrophobicContact CD1-CD2 3.88Å; I57-F117 HydrophobicContact CD1-CE1 3.94Å; I57-F117 HydrophobicContact CD1-CE2 3.66Å; I57-F117 HydrophobicContact CD1-CG 4.11Å; I57-F117 HydrophobicContact CD1-CZ 3.69Å; I57-F117 HydrophobicContact CG1-CD2 3.77Å; I57-F117 HydrophobicContact CG1-CE2 3.55Å; I57-F117 HydrophobicContact CG1-CG 4.46Å; I57-F117 HydrophobicContact CG1-CZ 4.07Å; F117-N122 VanDerWaalsContact CA-O 3.31Å; F117-N122 WeakPolarHBondContact CA-O 3.41Å; F117-V123 HydrophobicContact CD1-CG2 4.04Å; F117-V123 HydrophobicContact CE1-CG2 3.61Å; F117-V123 HydrophobicContact CZ-CG2 4.46Å
118	D	95.5	Very high	97.5	Very high	47 Å²	47	77.4 Å²	77.4	25%	0.251	41%	0.414	S	S	.	.			trans	-78.4	177.4	168.5	74.4	7.5	0	0	0	112.1	S120 S121 N122 I124	D118-S120 PolarHBondContact O-N 3.21Å; D118-S120 VanDerWaalsContact OD1-C 3.29Å; D118-S120 WeakPolarHBondContact OD1-CA 3.26Å; D118-S120 WeakPolarHBondContact OD1-CB 3.28Å; D118-S120 PolarHBondContact OD1-N 3.41Å; D118-S121 PolarHBondContact O-N 2.67Å; D118-S121 PolarHBondContact OD1-N 3.35Å; D118-S121 VanDerWaalsContact OD1-N 3.13Å; D118-N122 PolarHBondContact N-O 3.36Å; D118-N122 WeakPolarHBondContact OD1-CB 3.41Å; D118-N122 PolarHBondContact OD1-N 3.02Å; D118-N122 PolarHBondContact OD1-ND2 3.29Å; D118-N122 WeakPolarHBondContact OD2-CB 3.42Å; D118-N122 PolarHBondContact OD2-ND2 2.9Å; D118-N122 VanDerWaalsContact OD2-ND2 3.07Å; D118-I124 HydrophobicContact CB-CG1 3.89Å
119	D	95	Very high	97.6	Very high	176 Å²	176	83.1 Å²	83.1	94%	0.941	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-18.7	-179.1	-58.4	-34.6	0	0	0	113.4
120	S	96.6	Very high	97.6	Very high	90 Å²	90	85.3 Å²	85.3	63%	0.629	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	12.3	176.4	-62.3	0	0	0	0	112.5	D118 N122	D118-S120 PolarHBondContact O-N 3.21Å; D118-S120 VanDerWaalsContact OD1-C 3.29Å; D118-S120 WeakPolarHBondContact OD1-CA 3.26Å; D118-S120 WeakPolarHBondContact OD1-CB 3.28Å; D118-S120 PolarHBondContact OD1-N 3.41Å; S120-N122 VanDerWaalsContact CB-ND2 3.33Å; S120-N122 WeakPolarHBondContact CB-ND2 3.49Å; S120-N122 PolarHBondContact O-N 3.43Å
121	S	94.1	Very high	97.6	Very high	93 Å²	93	83.9 Å²	83.9	65%	0.65	44%	0.436	S	S	*	.	S	Bend	trans	61	22.8	-176.4	-54.7	0	0	0	0	114.6	D118	D118-S121 PolarHBondContact O-N 2.67Å; D118-S121 PolarHBondContact OD1-N 3.35Å; D118-S121 VanDerWaalsContact OD1-N 3.13Å
122	N	96.9	Very high	97.6	Very high	87 Å²	87	83.1 Å²	83.1	47%	0.465	43%	0.427	S	S	.	.			trans	-81.6	146.2	171.3	-54.4	-64.2	0	0	0	110.5	F117 D118 S120 I124	F117-N122 VanDerWaalsContact CA-O 3.31Å; F117-N122 WeakPolarHBondContact CA-O 3.41Å; D118-N122 PolarHBondContact N-O 3.36Å; D118-N122 WeakPolarHBondContact OD1-CB 3.41Å; D118-N122 PolarHBondContact OD1-N 3.02Å; D118-N122 PolarHBondContact OD1-ND2 3.29Å; D118-N122 WeakPolarHBondContact OD2-CB 3.42Å; D118-N122 PolarHBondContact OD2-ND2 2.9Å; D118-N122 VanDerWaalsContact OD2-ND2 3.07Å; S120-N122 VanDerWaalsContact CB-ND2 3.33Å; S120-N122 WeakPolarHBondContact CB-ND2 3.49Å; S120-N122 PolarHBondContact O-N 3.43Å; N122-I124 HydrophobicContact CB-CD1 4.08Å; N122-I124 PolarHBondContact O-N 3.38Å
123	V	97.9	Very high	97.6	Very high	89 Å²	89	82.5 Å²	82.5	54%	0.539	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	114.9	174.7	178.9	0	0	0	0	109.8	I57 L115 F117	I57-V123 HydrophobicContact CD1-CG1 3.94Å; I57-V123 HydrophobicContact CD1-CG2 4.09Å; L115-V123 HydrophobicContact CD1-CG1 3.55Å; L115-V123 HydrophobicContact CD2-CG1 4.4Å; L115-V123 HydrophobicContact CG-CG1 4.01Å; F117-V123 HydrophobicContact CD1-CG2 4.04Å; F117-V123 HydrophobicContact CE1-CG2 3.61Å; F117-V123 HydrophobicContact CZ-CG2 4.46Å
124	I	98.3	Very high	97.5	Very high	54 Å²	54	86.6 Å²	86.6	28%	0.277	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	128.5	-177.4	-53.4	-56.3	0	0	0	110.5	L115 Y116 D118 N122 K126	L115-I124 WeakPolarHBondContact CA-O 3.39Å; Y116-I124 HydrophobicContact CD1-CB 4.37Å; Y116-I124 HydrophobicContact CE1-CB 3.94Å; Y116-I124 HydrophobicContact CE1-CG2 3.82Å; Y116-I124 HydrophobicContact CE2-CB 4.41Å; Y116-I124 PolarHBondContact N-O 3.06Å; Y116-I124 PolarHBondContact O-N 3.05Å; D118-I124 HydrophobicContact CB-CG1 3.89Å; N122-I124 HydrophobicContact CB-CD1 4.08Å; N122-I124 PolarHBondContact O-N 3.38Å; I124-K126 HydrophobicContact CG2-CB 4.48Å
125	L	98.2	Very high	97.4	Very high	128 Å²	128	87.3 Å²	87.3	67%	0.67	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	117.6	167.1	-179	64.7	0	0	0	109.6	L115	L115-L125 HydrophobicContact CB-CD1 4.35Å; L115-L125 HydrophobicContact CD1-CB 3.96Å; L115-L125 HydrophobicContact CD1-CD1 4.28Å
126	K	98.1	Very high	97.2	Very high	96 Å²	96	85.4 Å²	85.4	42%	0.417	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	141.4	-178.1	-175	168.2	172.4	-176.8	0	112.4	S113 V114 Y116 I124 Y128	S113-K126 CarbonylContact C-O 3.53Å; S113-K126 WeakPolarHBondContact CA-O 3.25Å; V114-K126 PolarHBondContact N-O 3.4Å; V114-K126 PolarHBondContact O-N 2.99Å; Y116-K126 HydrophobicContact CE1-CB 3.78Å; Y116-K126 HydrophobicContact CE1-CD 4.26Å; I124-K126 HydrophobicContact CG2-CB 4.48Å; K126-Y128 HydrophobicContact CB-CD2 4.38Å; K126-Y128 HydrophobicContact CB-CE2 3.82Å; K126-Y128 HydrophobicContact CD-CE1 4.32Å; K126-Y128 HydrophobicContact CD-CE2 3.84Å; K126-Y128 HydrophobicContact CG-CD2 4.18Å; K126-Y128 HydrophobicContact CG-CE2 3.75Å
127	K	98.3	Very high	97	Very high	146 Å²	146	83.7 Å²	83.7	64%	0.635	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	113.8	175	-171.8	172.6	-176	173	0	110.6	A111 I112	A111-K127 HydrophobicContact CB-CD 4.35Å; A111-K127 HydrophobicContact CB-CG 3.94Å; I112-K127 CarbonylContact O-C 3.57Å; I112-K127 WeakPolarHBondContact O-CA 3.31Å
128	Y	98.1	Very high	96.9	Very high	68 Å²	68	79.2 Å²	79.2	27%	0.267	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	117.6	176.2	-71.4	-93.1	0	0	0	110	A111 I112 V114 Y116 K126 M131	A111-Y128 CarbonylContact C-O 3.45Å; A111-Y128 WeakPolarHBondContact CA-O 3.35Å; A111-Y128 VanDerWaalsContact CB-O 3.23Å; A111-Y128 WeakPolarHBondContact CB-O 3.34Å; I112-Y128 PolarHBondContact N-O 3Å; I112-Y128 PolarHBondContact O-N 3.38Å; V114-Y128 HydrophobicContact CB-CD2 4Å; V114-Y128 HydrophobicContact CB-CE2 3.99Å; V114-Y128 HydrophobicContact CG2-CD2 3.81Å; V114-Y128 HydrophobicContact CG2-CE2 4.22Å; Y116-Y128 HydrophobicContact CE1-CE2 4.44Å; K126-Y128 HydrophobicContact CB-CD2 4.38Å; K126-Y128 HydrophobicContact CB-CE2 3.82Å; K126-Y128 HydrophobicContact CD-CE1 4.32Å; K126-Y128 HydrophobicContact CD-CE2 3.84Å; K126-Y128 HydrophobicContact CG-CD2 4.18Å; K126-Y128 HydrophobicContact CG-CE2 3.75Å; Y128-M131 WeakPolarHBondContact O-CG 3.45Å
129	R	98.3	Very high	96.7	Very high	204 Å²	204	81.3 Å²	81.3	77%	0.77	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	160.2	177.2	-61.7	-176.2	-175.1	175.3	1.3	110.6	A111 M131	A111-R129 HydrophobicContact CB-CG 4.36Å; R129-M131 VanDerWaalsContact C-N 3.33Å; R129-M131 PolarHBondContact O-N 3.31Å
130	N	97.9	Very high	96.8	Very high	113 Å²	113	76.6 Å²	76.6	60%	0.604	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	60.9	36.1	174.3	-52.7	-23.4	0	0	0	114.7	L109	L109-N130 HydrophobicContact CB-CB 4.18Å; L109-N130 HydrophobicContact CD1-CB 4.48Å; L109-N130 HydrophobicContact CD2-CB 4.36Å
131	M	98.2	Very high	96.8	Very high	55 Å²	55	75.9 Å²	75.9	27%	0.271	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-28.2	-175.9	-67.2	-64.4	-74.1	0	0	112.8	Y62 N110 I112 Y128 R129	Y62-M131 HydrophobicContact CE1-CE 4.21Å; Y62-M131 HydrophobicContact CE2-CB 4.17Å; Y62-M131 VanDerWaalsContact CE2-O 3.25Å; Y62-M131 WeakPolarHBondContact CE2-O 3.44Å; Y62-M131 WeakPolarHBondContact OH-CE 3.44Å; Y62-M131 PolarHBondContact OH-O 3.42Å; N110-M131 PolarHBondContact O-N 2.8Å; I112-M131 HydrophobicContact CD1-CB 4.08Å; I112-M131 HydrophobicContact CD1-CE 3.95Å; I112-M131 HydrophobicContact CD1-CG 4.23Å; I112-M131 HydrophobicContact CG1-CB 3.84Å; I112-M131 HydrophobicContact CG1-CG 3.9Å; I112-M131 HydrophobicContact CG2-CB 4.22Å; Y128-M131 WeakPolarHBondContact O-CG 3.45Å; R129-M131 VanDerWaalsContact C-N 3.33Å; R129-M131 PolarHBondContact O-N 3.31Å
132	V	98.6	Very high	97	Very high	21 Å²	21	74.9 Å²	74.9	13%	0.127	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	123.2	-173.3	174.3	0	0	0	0	110.5	Y62 A63 A64 Y65 L109 N110 I112 R134	Y62-V132 HydrophobicContact CD2-CG2 3.6Å; Y62-V132 HydrophobicContact CE2-CG2 3.73Å; A63-V132 WeakPolarHBondContact O-CG1 3.49Å; A64-V132 CarbonylContact O-C 3.51Å; A64-V132 WeakPolarHBondContact O-CA 3.43Å; Y65-V132 HydrophobicContact CD2-CG1 3.94Å; Y65-V132 HydrophobicContact CE2-CG1 4.19Å; L109-V132 CarbonylContact C-O 3.54Å; L109-V132 WeakPolarHBondContact CA-O 3.38Å; N110-V132 HydrophobicContact CB-CB 4.13Å; N110-V132 PolarHBondContact N-O 2.91Å; N110-V132 PolarHBondContact O-N 3.48Å; N110-V132 VanDerWaalsContact O-N 3.1Å; I112-V132 HydrophobicContact CG2-CG2 3.51Å; V132-R134 PolarHBondContact O-N 3.11Å
133	V	98.4	Very high	97	Very high	10 Å²	10	74.2 Å²	74.2	6%	0.061	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	121.8	175.6	178.4	0	0	0	0	110	K40 A64 C67 P106 L109	K40-V133 HydrophobicContact CD-CG1 4.3Å; K40-V133 WeakPolarHBondContact CD-O 3.47Å; K40-V133 HydrophobicContact CG-CG1 4.17Å; A64-V133 PolarHBondContact O-N 3.24Å; C67-V133 VanDerWaalsContact SG-CG1 3.54Å; P106-V133 HydrophobicContact CB-CG1 4.17Å; P106-V133 HydrophobicContact CB-CG2 3.98Å; P106-V133 HydrophobicContact CG-CG1 4.44Å; P106-V133 HydrophobicContact CG-CG2 3.71Å; L109-V133 HydrophobicContact CD2-CG2 4.34Å
134	R	96.6	Very high	96.9	Very high	155 Å²	155	73.3 Å²	73.3	59%	0.585	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	-42.7	174	-169.9	-154.7	178.9	-172.2	6.7	111.4	Q108 V132	Q108-R134 HydrophobicContact CB-CB 4.09Å; Q108-R134 WeakPolarHBondContact O-CB 3.38Å; Q108-R134 PolarHBondContact O-N 2.9Å; V132-R134 PolarHBondContact O-N 3.11Å
135	A	95.1	Very high	96.8	Very high	20 Å²	20	74.6 Å²	74.6	17%	0.165	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	149.8	-178.4	0	0	0	0	0	111	T107 Q108	T107-A135 PolarHBondContact N-O 3.34Å; T107-A135 PolarHBondContact OG1-O 3.46Å; Q108-A135 HydrophobicContact CB-CB 4.08Å; Q108-A135 HydrophobicContact CG-CB 4.24Å; Q108-A135 PolarHBondContact O-N 3.35Å
136	C	95.2	Very high	96.7	Very high	12 Å²	12	70.8 Å²	70.8	8%	0.081	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	162.3	175.2	-60.5	0	0	0	0	110.6	K39 K40 C67 N80 A105	K39-C136 VanDerWaalsContact C-SG 3.56Å; K39-C136 PolarHBondContact O-SG 2.82Å; K40-C136 WeakPolarHBondContact CA-SG 3.49Å; K40-C136 PolarHBondContact N-SG 2.83Å; C67-C136 WeakPolarHBondContact CA-SG 3.46Å; C67-C136 HydrophobicContact CB-CB 3.75Å; C67-C136 WeakPolarHBondContact CB-SG 3.29Å; C67-C136 VanDerWaalsContact SG-CA 3.5Å; C67-C136 WeakPolarHBondContact SG-CB 3.25Å; C67-C136 CovalentContact SG-SG 2.03Å; C67-C136 PolarHBondContact SG-SG 3.25Å; N80-C136 PolarHBondContact ND2-O 3.19Å; A105-C136 WeakPolarHBondContact O-CA 3.33Å
137	G	94.4	Very high	96.6	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.6	175.9	174.2	0	0	0	0	0	113.4	M79 A105	M79-G137 CarbonylContact O-C 3.57Å; M79-G137 WeakPolarHBondContact O-CA 3.33Å; A105-G137 PolarHBondContact N-O 3.37Å; A105-G137 PolarHBondContact O-N 3.18Å
138	C	94.9	Very high	96.5	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	121.5	-176.5	-64.8	0	0	0	0	111.6	C71 L75 M79 A81 T82 A85 P102 C103	C71-C138 VanDerWaalsContact CA-SG 3.57Å; C71-C138 HydrophobicContact CB-CB 3.72Å; C71-C138 WeakPolarHBondContact CB-SG 3.44Å; C71-C138 VanDerWaalsContact SG-CA 3.53Å; C71-C138 WeakPolarHBondContact SG-CB 3.45Å; C71-C138 CovalentContact SG-SG 2.03Å; C71-C138 PolarHBondContact SG-SG 2.81Å; L75-C138 HydrophobicContact CD2-CB 4.37Å; M79-C138 PolarHBondContact O-N 3.09Å; A81-C138 WeakPolarHBondContact CA-O 3.46Å; A81-C138 HydrophobicContact CB-CB 4.14Å; T82-C138 PolarHBondContact N-O 3.12Å; A85-C138 HydrophobicContact CB-CB 4.49Å; A85-C138 VanDerWaalsContact CB-O 3.26Å; A85-C138 WeakPolarHBondContact CB-O 3.31Å; P102-C138 HydrophobicContact CB-CB 4.46Å; C103-C138 WeakPolarHBondContact O-CA 2.99Å
139	H	91.8	Very high	96.3	Very high	91 Å²	91	61.9 Å²	61.9	42%	0.421	28%	0.28	S	S	.	.			trans	-130	0	-175.7	-71.6	-91	0	0	0	112.7	T82 P102 C103 T107	T82-H139 VanDerWaalsContact CG2-CE1 3.45Å; T82-H139 WeakPolarHBondContact CG2-CE1 3.34Å; T82-H139 WeakPolarHBondContact CG2-ND1 3.37Å; P102-H139 WeakPolarHBondContact CB-O 3.38Å; C103-H139 PolarHBondContact N-O 3.07Å; C103-H139 PolarHBondContact O-N 3.23Å; T107-H139 WeakPolarHBondContact CG2-NE2 3.45Å

Retrieved 139 of 139 residues in 114.8 ms (Link to these results)

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