A0A087WXK3_HUMAN Loading...

Integrator complex subunit 7

AlphaFold DB , UniProt , Accession A0A087WXK3, Species HUMAN (Homo sapiens, Human), Gene INTS7, Length 152 aa.

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	A	38.3	Very low	48.7	Very low	109 Å²	109	111.6 Å²	111.6	90%	0.901	64%	0.641	S	S	*	*				0	139.2	0	0	0	0	0	0	106.8	E3 D123	A1-E3 PolarHBondContact O-N 3.33Å; A1-D123 PolarHBondContact N-OD2 3.29Å
2	I	37.7	Very low	48.8	Very low	89 Å²	89	109.3 Å²	109.3	46%	0.456	65%	0.645	S	S	.	*			trans	-82.1	121	-175.8	-59.3	172.9	0	0	0	108.6
3	E	38.6	Very low	48.2	Very low	151 Å²	151	108.2 Å²	108.2	71%	0.706	65%	0.646	S	S	*	*			trans	-86.6	128.9	172.1	-63.5	-175.6	169.4	0	0	109	A1	A1-E3 PolarHBondContact O-N 3.33Å
4	A	50	Low	48.1	Very low	59 Å²	59	113.1 Å²	113.1	49%	0.488	66%	0.656	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.3	132.6	-180	0	0	0	0	0	110.3	V118	A4-V118 HydrophobicContact CB-CG1 4.01Å
5	L	49.8	Very low	47.7	Very low	123 Å²	123	115.1 Å²	115.1	64%	0.644	66%	0.657	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.7	126.5	173.2	-69.2	167.7	0	0	0	109.2
6	I	61.2	Low	47.6	Very low	144 Å²	144	118.9 Å²	118.9	74%	0.738	67%	0.667	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.9	124.7	174.3	-58.4	173.8	0	0	0	107.7	I116	I6-I116 HydrophobicContact CG2-CG2 4.44Å
7	L	48.3	Very low	47.1	Very low	83 Å²	83	123.5 Å²	123.5	44%	0.435	67%	0.673	S	S	.	*	P	Polyproline II helix	trans	-100.2	139.2	176.3	-62.2	175.4	0	0	0	110.6	K119	L7-K119 HydrophobicContact CD1-CD 3.97Å; L7-K119 HydrophobicContact CD1-CG 4.39Å
8	D	54.4	Low	47	Very low	104 Å²	104	120.3 Å²	120.3	56%	0.556	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-70.5	126.5	177.6	-172.5	-20.9	0	0	0	111	E10 S11	D8-E10 VanDerWaalsContact C-N 3.26Å; D8-E10 PolarHBondContact O-N 3.2Å; D8-E10 PolarHBondContact OD1-N 3.5Å; D8-S11 WeakPolarHBondContact O-CB 3.49Å; D8-S11 PolarHBondContact O-N 2.85Å; D8-S11 PolarHBondContact O-OG 3.26Å
9	P	50.9	Low	46.6	Very low	94 Å²	94	120.5 Å²	120.5	61%	0.61	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-60.4	-22.3	-178.4	21.9	-33.4	0	0	0	115.6	S11	P9-S11 VanDerWaalsContact C-N 3.27Å; P9-S11 PolarHBondContact O-N 3.48Å
10	E	52.9	Low	46.8	Very low	167 Å²	167	122 Å²	122	78%	0.78	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-75.9	-12.8	177.7	-73.6	-156.3	157	0	0	113.9	D8 A12	D8-E10 VanDerWaalsContact C-N 3.26Å; D8-E10 PolarHBondContact O-N 3.2Å; D8-E10 PolarHBondContact OD1-N 3.5Å; E10-A12 PolarHBondContact O-N 3.4Å
11	S	53.6	Low	46.3	Very low	105 Å²	105	119.4 Å²	119.4	73%	0.734	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-75.5	-8.3	-178.6	-54.4	0	0	0	0	113.9	D8 P9	D8-S11 WeakPolarHBondContact O-CB 3.49Å; D8-S11 PolarHBondContact O-N 2.85Å; D8-S11 PolarHBondContact O-OG 3.26Å; P9-S11 VanDerWaalsContact C-N 3.27Å; P9-S11 PolarHBondContact O-N 3.48Å
12	A	50.1	Low	46.8	Very low	83 Å²	83	121.5 Å²	121.5	69%	0.686	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-108.7	6	-169.3	0	0	0	0	0	114.9	E10 F14	E10-A12 PolarHBondContact O-N 3.4Å; A12-F14 PolarHBondContact O-N 3.36Å
13	S	41.4	Very low	47	Very low	95 Å²	95	121.6 Å²	121.6	66%	0.664	71%	0.712	S	S	*	*			trans	-78.7	88.5	178.1	63.4	0	0	0	0	111.2	Q15	S13-Q15 PolarHBondContact O-N 2.98Å
14	F	46.9	Very low	47.5	Very low	178 Å²	178	122.1 Å²	122.1	78%	0.781	71%	0.714	S	S	*	*			trans	-78.8	108.6	164.8	-171.8	-104.5	0	0	0	108.9	A12 E16	A12-F14 PolarHBondContact O-N 3.36Å; F14-E16 HydrophobicContact CD1-CG 4.49Å; F14-E16 HydrophobicContact CE1-CG 4.2Å; F14-E16 PolarHBondContact O-N 3.44Å
15	Q	42.2	Very low	47.5	Very low	143 Å²	143	121.2 Å²	121.2	67%	0.668	71%	0.707	S	S	*	*			trans	-77	99.5	173.7	-93.6	167.1	-70.4	0	0	110	S13 Y17	S13-Q15 PolarHBondContact O-N 2.98Å; Q15-Y17 HydrophobicContact CB-CD2 4.3Å; Q15-Y17 HydrophobicContact CB-CE2 4.36Å; Q15-Y17 PolarHBondContact O-N 3.06Å; Q15-Y17 VanDerWaalsContact O-N 3.15Å
16	E	44.8	Very low	47.9	Very low	175 Å²	175	121 Å²	121	82%	0.818	71%	0.707	S	S	*	*			trans	-72.4	96.4	166	-124.1	178.2	-165.5	0	0	109.2	F14	F14-E16 HydrophobicContact CD1-CG 4.49Å; F14-E16 HydrophobicContact CE1-CG 4.2Å; F14-E16 PolarHBondContact O-N 3.44Å
17	Y	39.8	Very low	48.5	Very low	197 Å²	197	116.8 Å²	116.8	77%	0.773	69%	0.689	S	S	*	*			trans	-86.6	105.9	163.4	-88.7	-84	0	0	0	108.5	Q15	Q15-Y17 HydrophobicContact CB-CD2 4.3Å; Q15-Y17 HydrophobicContact CB-CE2 4.36Å; Q15-Y17 PolarHBondContact O-N 3.06Å; Q15-Y17 VanDerWaalsContact O-N 3.15Å
18	G	44.6	Very low	50	Low	67 Å²	67	118.7 Å²	118.7	69%	0.691	70%	0.696	S	S	*	*			trans	-61.8	149.6	171.7	0	0	0	0	0	112.3
19	S	39.6	Very low	51.2	Low	123 Å²	123	121.1 Å²	121.1	86%	0.86	70%	0.699	S	S	*	*			trans	-152.3	114.7	155.5	-80.2	0	0	0	0	110.1
20	T	50.7	Low	52.3	Low	150 Å²	150	121 Å²	121	92%	0.92	69%	0.69	S	S	*	*			trans	-55.9	135.1	160.4	44.1	0	0	0	0	110.8
21	G	35.8	Very low	53.6	Low	69 Å²	69	119.7 Å²	119.7	71%	0.711	68%	0.678	S	S	*	*			trans	175	91.4	169.3	0	0	0	0	0	113.7	A23	G21-A23 PolarHBondContact O-N 3.4Å
22	T	49	Very low	55.1	Low	153 Å²	153	123.1 Å²	123.1	94%	0.939	68%	0.675	S	S	*	*			trans	-62.4	105.5	155.4	44.4	0	0	0	0	108.8
23	A	42.6	Very low	56.6	Low	91 Å²	91	123.7 Å²	123.7	75%	0.752	66%	0.664	S	S	*	*			trans	-150.6	138.2	168	0	0	0	0	0	110.3	G21 A25	G21-A23 PolarHBondContact O-N 3.4Å; A23-A25 PolarHBondContact O-N 3.29Å
24	H	49	Very low	58.3	Low	161 Å²	161	124.5 Å²	124.5	75%	0.745	66%	0.659	S	S	*	*			trans	-44.7	124.5	-179.4	-89.9	-113.8	0	0	0	114.2	D26	H24-D26 IonicContact ND1-OD1 3.87Å; H24-D26 IonicContact ND1-OD2 3.33Å; H24-D26 PolarHBondContact O-N 2.99Å; H24-D26 VanDerWaalsContact O-N 3.12Å
25	A	50.9	Low	60.1	Low	41 Å²	41	119.7 Å²	119.7	34%	0.339	65%	0.647	S	S	.	*			trans	-78.6	85.2	167	0	0	0	0	0	109.9	A23 E30 R31	A23-A25 PolarHBondContact O-N 3.29Å; A25-E30 HydrophobicContact CB-CB 4.43Å; A25-R31 PolarHBondContact O-NE 3.15Å
26	D	56.3	Low	62.3	Low	119 Å²	119	117 Å²	117	64%	0.636	64%	0.64	S	S	*	*			trans	-99.3	-3.3	-174.3	-84.8	-14.5	0	0	0	114.1	H24 E30	H24-D26 IonicContact ND1-OD1 3.87Å; H24-D26 IonicContact ND1-OD2 3.33Å; H24-D26 PolarHBondContact O-N 2.99Å; H24-D26 VanDerWaalsContact O-N 3.12Å; D26-E30 PolarHBondContact N-OE2 3.46Å
27	S	75.5	Confident	64.2	Low	54 Å²	54	115.9 Å²	115.9	38%	0.378	63%	0.63	S	S	.	*	S	Bend	trans	-96.9	133.7	171.9	-176.5	0	0	0	0	112.6	Y29 E30 R31	S27-Y29 PolarHBondContact O-N 3.31Å; S27-Y29 VanDerWaalsContact O-N 3.11Å; S27-Y29 PolarHBondContact OG-N 3.23Å; S27-E30 PolarHBondContact N-OE2 3.39Å; S27-E30 WeakPolarHBondContact O-CA 3.36Å; S27-E30 WeakPolarHBondContact O-CB 3.3Å; S27-E30 PolarHBondContact O-N 3.18Å; S27-R31 PolarHBondContact O-N 3.38Å
28	E	78.6	Confident	66.3	Low	123 Å²	123	110 Å²	110	58%	0.575	61%	0.612	S	S	*	*	H	α-helix	trans	-51.2	-32.6	170.4	-84.1	-70.1	137.7	0	0	112.5	R32	E28-R32 WeakPolarHBondContact O-CB 3.5Å; E28-R32 VanDerWaalsContact O-CG 3.32Å; E28-R32 WeakPolarHBondContact O-CG 3.43Å; E28-R32 PolarHBondContact O-N 3.26Å
29	Y	80.4	Confident	68.3	Low	155 Å²	155	112.4 Å²	112.4	61%	0.608	61%	0.605	S	S	*	*	H	α-helix	trans	-64.5	-46.4	173.8	174	-99.8	0	0	0	111.9	S27 R31 R32 M33	S27-Y29 PolarHBondContact O-N 3.31Å; S27-Y29 VanDerWaalsContact O-N 3.11Å; S27-Y29 PolarHBondContact OG-N 3.23Å; Y29-R31 VanDerWaalsContact C-N 3.31Å; Y29-R31 PolarHBondContact O-N 3.45Å; Y29-R32 PolarHBondContact O-N 3.17Å; Y29-M33 HydrophobicContact CD1-CG 4.16Å; Y29-M33 HydrophobicContact CD2-CG 4.33Å; Y29-M33 HydrophobicContact CE1-CG 3.68Å; Y29-M33 HydrophobicContact CE2-CG 3.86Å; Y29-M33 HydrophobicContact CE2-SD 4.16Å; Y29-M33 HydrophobicContact CG-CG 4.47Å; Y29-M33 WeakPolarHBondContact O-CB 3.47Å; Y29-M33 WeakPolarHBondContact O-CG 3.34Å; Y29-M33 PolarHBondContact O-N 3.4Å
30	E	73.2	Confident	70.3	Confident	91 Å²	91	110.1 Å²	110.1	43%	0.425	59%	0.585	S	S	.	*	H	α-helix	trans	-63.7	-39.9	178.2	-67.5	170.1	158.7	0	0	110.9	A25 D26 S27 R32 M33 M34	A25-E30 HydrophobicContact CB-CB 4.43Å; D26-E30 PolarHBondContact N-OE2 3.46Å; S27-E30 PolarHBondContact N-OE2 3.39Å; S27-E30 WeakPolarHBondContact O-CA 3.36Å; S27-E30 WeakPolarHBondContact O-CB 3.3Å; S27-E30 PolarHBondContact O-N 3.18Å; E30-R32 VanDerWaalsContact C-N 3.35Å; E30-R32 PolarHBondContact O-N 2.74Å; E30-M33 PolarHBondContact O-N 2.8Å; E30-M34 VanDerWaalsContact O-CB 3.25Å; E30-M34 WeakPolarHBondContact O-CB 3.04Å; E30-M34 PolarHBondContact O-N 2.65Å
31	R	79.6	Confident	71.7	Confident	141 Å²	141	106.4 Å²	106.4	53%	0.532	56%	0.56	S	S	.	*	H	α-helix	trans	-62.3	-41.6	174.4	-66.4	-178.5	178.9	-152.7	-0.2	112	A25 S27 Y29 S35	A25-R31 PolarHBondContact O-NE 3.15Å; S27-R31 PolarHBondContact O-N 3.38Å; Y29-R31 VanDerWaalsContact C-N 3.31Å; Y29-R31 PolarHBondContact O-N 3.45Å; R31-S35 WeakPolarHBondContact O-CB 3.28Å; R31-S35 PolarHBondContact O-N 3.41Å
32	R	85.3	Confident	73.9	Confident	177 Å²	177	109.4 Å²	109.4	67%	0.668	56%	0.555	S	S	*	*	H	α-helix	trans	-65.3	-44.3	174.2	-75.8	177.6	-173.8	-157.7	0.8	111.8	E28 Y29 E30 M34 S35 V36	E28-R32 WeakPolarHBondContact O-CB 3.5Å; E28-R32 VanDerWaalsContact O-CG 3.32Å; E28-R32 WeakPolarHBondContact O-CG 3.43Å; E28-R32 PolarHBondContact O-N 3.26Å; Y29-R32 PolarHBondContact O-N 3.17Å; E30-R32 VanDerWaalsContact C-N 3.35Å; E30-R32 PolarHBondContact O-N 2.74Å; R32-M34 VanDerWaalsContact C-N 3.34Å; R32-M34 PolarHBondContact O-N 2.79Å; R32-S35 WeakPolarHBondContact O-CB 3.31Å; R32-S35 PolarHBondContact O-N 3.15Å; R32-V36 WeakPolarHBondContact O-CG2 3.47Å; R32-V36 PolarHBondContact O-N 2.93Å
33	M	82	Confident	75.5	Confident	94 Å²	94	107.3 Å²	107.3	46%	0.463	53%	0.534	S	S	.	.	H	α-helix	trans	-63.4	-41.5	178	-74.9	-61.4	-60.4	0	0	111.9	Y29 E30 V36 Y37	Y29-M33 HydrophobicContact CD1-CG 4.16Å; Y29-M33 HydrophobicContact CD2-CG 4.33Å; Y29-M33 HydrophobicContact CE1-CG 3.68Å; Y29-M33 HydrophobicContact CE2-CG 3.86Å; Y29-M33 HydrophobicContact CE2-SD 4.16Å; Y29-M33 HydrophobicContact CG-CG 4.47Å; Y29-M33 WeakPolarHBondContact O-CB 3.47Å; Y29-M33 WeakPolarHBondContact O-CG 3.34Å; Y29-M33 PolarHBondContact O-N 3.4Å; E30-M33 PolarHBondContact O-N 2.8Å; M33-V36 PolarHBondContact O-N 2.93Å; M33-Y37 WeakPolarHBondContact O-CB 3.36Å; M33-Y37 PolarHBondContact O-N 3.09Å
34	M	77.3	Confident	76.9	Confident	113 Å²	113	107 Å²	107	56%	0.557	52%	0.523	S	S	*	.	H	α-helix	trans	-68.4	-36	176.7	-166.6	157.2	169.3	0	0	111.7	E30 R32 Y37 N38	E30-M34 VanDerWaalsContact O-CB 3.25Å; E30-M34 WeakPolarHBondContact O-CB 3.04Å; E30-M34 PolarHBondContact O-N 2.65Å; R32-M34 VanDerWaalsContact C-N 3.34Å; R32-M34 PolarHBondContact O-N 2.79Å; M34-Y37 PolarHBondContact O-N 2.72Å; M34-N38 WeakPolarHBondContact O-CB 3.37Å; M34-N38 VanDerWaalsContact O-CG 3.23Å; M34-N38 PolarHBondContact O-N 3.31Å; M34-N38 PolarHBondContact O-ND2 2.77Å
35	S	85.9	Confident	78.1	Confident	77 Å²	77	104.2 Å²	104.2	54%	0.538	51%	0.511	S	S	.	.	H	α-helix	trans	-63.4	-46.1	171.3	-178.6	0	0	0	0	112.1	R31 R32 Y37 N38 H39	R31-S35 WeakPolarHBondContact O-CB 3.28Å; R31-S35 PolarHBondContact O-N 3.41Å; R32-S35 WeakPolarHBondContact O-CB 3.31Å; R32-S35 PolarHBondContact O-N 3.15Å; S35-Y37 VanDerWaalsContact C-N 3.34Å; S35-Y37 PolarHBondContact O-N 2.94Å; S35-N38 PolarHBondContact O-N 2.81Å; S35-H39 WeakPolarHBondContact O-CB 3.27Å; S35-H39 PolarHBondContact O-N 3.44Å
36	V	88.3	Confident	79.2	Confident	85 Å²	85	105.5 Å²	105.5	52%	0.515	52%	0.517	S	S	.	.	H	α-helix	trans	-60.8	-44.7	174.8	171	0	0	0	0	110.8	R32 M33 H39 V40	R32-V36 WeakPolarHBondContact O-CG2 3.47Å; R32-V36 PolarHBondContact O-N 2.93Å; M33-V36 PolarHBondContact O-N 2.93Å; V36-H39 PolarHBondContact O-N 2.83Å; V36-V40 HydrophobicContact CG1-CG2 4.38Å; V36-V40 VanDerWaalsContact O-CG2 3.29Å; V36-V40 WeakPolarHBondContact O-CG2 3.44Å; V36-V40 PolarHBondContact O-N 3.03Å
37	Y	84.3	Confident	79.7	Confident	152 Å²	152	103.7 Å²	103.7	60%	0.596	51%	0.507	S	S	*	.	H	α-helix	trans	-58.9	-49.9	177.4	176.6	-97.3	0	0	0	111.8	M33 M34 S35 H39 V40 L41	M33-Y37 WeakPolarHBondContact O-CB 3.36Å; M33-Y37 PolarHBondContact O-N 3.09Å; M34-Y37 PolarHBondContact O-N 2.72Å; S35-Y37 VanDerWaalsContact C-N 3.34Å; S35-Y37 PolarHBondContact O-N 2.94Å; Y37-H39 VanDerWaalsContact C-N 3.32Å; Y37-H39 PolarHBondContact O-N 3.36Å; Y37-V40 PolarHBondContact O-N 3.48Å; Y37-L41 HydrophobicContact CE1-CD2 4.49Å; Y37-L41 WeakPolarHBondContact O-CB 3.45Å; Y37-L41 PolarHBondContact O-N 3.24Å
38	N	83	Confident	78.9	Confident	75 Å²	75	105.1 Å²	105.1	40%	0.401	51%	0.51	S	S	.	.	H	α-helix	trans	-63.3	-38.7	178.6	-71.5	-35.5	0	0	0	111.9	M34 S35 L41 E42	M34-N38 WeakPolarHBondContact O-CB 3.37Å; M34-N38 VanDerWaalsContact O-CG 3.23Å; M34-N38 PolarHBondContact O-N 3.31Å; M34-N38 PolarHBondContact O-ND2 2.77Å; S35-N38 PolarHBondContact O-N 2.81Å; N38-L41 WeakPolarHBondContact O-CB 3.48Å; N38-L41 PolarHBondContact O-N 3.39Å; N38-E42 PolarHBondContact O-N 3.01Å
39	H	86.7	Confident	78.4	Confident	117 Å²	117	108.8 Å²	108.8	54%	0.542	52%	0.519	S	S	.	.	H	α-helix	trans	-65.5	-43.8	177.8	-171.4	60.8	0	0	0	112.4	S35 V36 Y37 L41 E42 E43	S35-H39 WeakPolarHBondContact O-CB 3.27Å; S35-H39 PolarHBondContact O-N 3.44Å; V36-H39 PolarHBondContact O-N 2.83Å; Y37-H39 VanDerWaalsContact C-N 3.32Å; Y37-H39 PolarHBondContact O-N 3.36Å; H39-L41 VanDerWaalsContact C-N 3.27Å; H39-L41 PolarHBondContact O-N 3.19Å; H39-E42 PolarHBondContact O-N 3.17Å; H39-E43 WeakPolarHBondContact O-CB 3Å; H39-E43 PolarHBondContact O-N 3.22Å
40	V	82.8	Confident	77.4	Confident	74 Å²	74	108.7 Å²	108.7	45%	0.448	52%	0.521	S	S	.	.	H	α-helix	trans	-62.2	-39.4	174.5	171.1	0	0	0	0	110.5	V36 Y37 E43 V44	V36-V40 HydrophobicContact CG1-CG2 4.38Å; V36-V40 VanDerWaalsContact O-CG2 3.29Å; V36-V40 WeakPolarHBondContact O-CG2 3.44Å; V36-V40 PolarHBondContact O-N 3.03Å; Y37-V40 PolarHBondContact O-N 3.48Å; V40-E43 PolarHBondContact O-N 3.43Å; V40-V44 HydrophobicContact CG1-CG2 4.39Å; V40-V44 WeakPolarHBondContact O-CB 3.37Å; V40-V44 VanDerWaalsContact O-CG2 3.24Å; V40-V44 WeakPolarHBondContact O-CG2 2.83Å; V40-V44 PolarHBondContact O-N 3.3Å
41	L	78.6	Confident	76.3	Confident	73 Å²	73	111.4 Å²	111.4	38%	0.382	53%	0.529	S	S	.	.	H	α-helix	trans	-63.8	-46.5	177.5	-161.5	71.9	0	0	0	111.6	Y37 N38 H39 E43 V44 E45	Y37-L41 HydrophobicContact CE1-CD2 4.49Å; Y37-L41 WeakPolarHBondContact O-CB 3.45Å; Y37-L41 PolarHBondContact O-N 3.24Å; N38-L41 WeakPolarHBondContact O-CB 3.48Å; N38-L41 PolarHBondContact O-N 3.39Å; H39-L41 VanDerWaalsContact C-N 3.27Å; H39-L41 PolarHBondContact O-N 3.19Å; L41-E43 VanDerWaalsContact C-N 3.34Å; L41-E43 PolarHBondContact O-N 2.85Å; L41-V44 PolarHBondContact O-N 3.07Å; L41-E45 WeakPolarHBondContact O-CG 3.47Å; L41-E45 PolarHBondContact O-N 3.26Å
42	E	83.1	Confident	74.5	Confident	132 Å²	132	108.5 Å²	108.5	62%	0.617	53%	0.527	S	S	*	.	H	α-helix	trans	-61.7	-40	174.8	-78.3	-176.6	169.8	0	0	112.3	N38 H39 E45 S46	N38-E42 PolarHBondContact O-N 3.01Å; H39-E42 PolarHBondContact O-N 3.17Å; E42-E45 PolarHBondContact O-N 2.95Å; E42-S46 WeakPolarHBondContact O-CB 3.4Å; E42-S46 PolarHBondContact O-N 3.44Å
43	E	82.9	Confident	72.7	Confident	108 Å²	108	102.8 Å²	102.8	51%	0.505	51%	0.513	S	S	.	.	H	α-helix	trans	-66.2	-42.2	177.7	-169.2	174	-174.3	0	0	111.4	H39 V40 L41 S46 L47	H39-E43 WeakPolarHBondContact O-CB 3Å; H39-E43 PolarHBondContact O-N 3.22Å; V40-E43 PolarHBondContact O-N 3.43Å; L41-E43 VanDerWaalsContact C-N 3.34Å; L41-E43 PolarHBondContact O-N 2.85Å; E43-S46 PolarHBondContact O-N 3.27Å; E43-L47 HydrophobicContact CG-CD1 4.2Å; E43-L47 WeakPolarHBondContact O-CB 3.17Å; E43-L47 VanDerWaalsContact O-CG 3.23Å; E43-L47 WeakPolarHBondContact O-CG 3.17Å; E43-L47 PolarHBondContact O-N 2.92Å
44	V	70.8	Confident	70.8	Confident	86 Å²	86	104.3 Å²	104.3	52%	0.521	53%	0.527	S	S	.	.	H	α-helix	trans	-62.8	-44.6	174.4	168.4	0	0	0	0	111.3	V40 L41 L47 N48	V40-V44 HydrophobicContact CG1-CG2 4.39Å; V40-V44 WeakPolarHBondContact O-CB 3.37Å; V40-V44 VanDerWaalsContact O-CG2 3.24Å; V40-V44 WeakPolarHBondContact O-CG2 2.83Å; V40-V44 PolarHBondContact O-N 3.3Å; L41-V44 PolarHBondContact O-N 3.07Å; V44-L47 PolarHBondContact O-N 3.38Å; V44-N48 WeakPolarHBondContact O-CB 3.33Å; V44-N48 PolarHBondContact O-N 2.83Å
45	E	74.2	Confident	69.4	Low	102 Å²	102	102.7 Å²	102.7	48%	0.477	53%	0.527	S	S	.	.	H	α-helix	trans	-65.3	-41	176.4	-74.8	-172	-176.2	0	0	112.3	L41 E42 N48 R49	L41-E45 WeakPolarHBondContact O-CG 3.47Å; L41-E45 PolarHBondContact O-N 3.26Å; E42-E45 PolarHBondContact O-N 2.95Å; E45-N48 PolarHBondContact O-N 2.84Å; E45-R49 WeakPolarHBondContact O-CG 3.23Å; E45-R49 PolarHBondContact O-N 3.4Å
46	S	73.9	Confident	67.4	Low	68 Å²	68	104.6 Å²	104.6	48%	0.476	52%	0.523	S	S	.	.	H	α-helix	trans	-62.9	-42.9	175.4	179.9	0	0	0	0	111.4	E42 E43 R49 K50	E42-S46 WeakPolarHBondContact O-CB 3.4Å; E42-S46 PolarHBondContact O-N 3.44Å; E43-S46 PolarHBondContact O-N 3.27Å; S46-R49 PolarHBondContact O-N 2.78Å; S46-K50 WeakPolarHBondContact O-CB 3.38Å; S46-K50 PolarHBondContact O-N 3.4Å
47	L	67.8	Low	65.2	Low	80 Å²	80	108.3 Å²	108.3	42%	0.419	54%	0.537	S	S	.	.	H	α-helix	trans	-63.4	-40.6	173.8	-75.7	167.3	0	0	0	111.6	E43 V44 R49 K50 Y51	E43-L47 HydrophobicContact CG-CD1 4.2Å; E43-L47 WeakPolarHBondContact O-CB 3.17Å; E43-L47 VanDerWaalsContact O-CG 3.23Å; E43-L47 WeakPolarHBondContact O-CG 3.17Å; E43-L47 PolarHBondContact O-N 2.92Å; V44-L47 PolarHBondContact O-N 3.38Å; L47-R49 VanDerWaalsContact C-N 3.3Å; L47-R49 PolarHBondContact O-N 3.45Å; L47-K50 PolarHBondContact O-N 2.9Å; L47-Y51 HydrophobicContact CD2-CD2 3.77Å; L47-Y51 HydrophobicContact CD2-CE2 3.64Å; L47-Y51 CarbonylContact O-C 3.48Å; L47-Y51 WeakPolarHBondContact O-CA 3.33Å; L47-Y51 WeakPolarHBondContact O-CB 3.41Å; L47-Y51 PolarHBondContact O-N 2.79Å
48	N	58	Low	63.2	Low	84 Å²	84	103.8 Å²	103.8	45%	0.449	52%	0.522	S	S	.	.	H	α-helix	trans	-66.6	-31.1	176.3	-163.7	5.7	0	0	0	112.4	V44 E45 Y51 T52 P53 Y56	V44-N48 WeakPolarHBondContact O-CB 3.33Å; V44-N48 PolarHBondContact O-N 2.83Å; E45-N48 PolarHBondContact O-N 2.84Å; N48-Y51 CarbonylContact O-C 3.56Å; N48-T52 VanDerWaalsContact O-CA 3.31Å; N48-T52 WeakPolarHBondContact O-CA 3.14Å; N48-T52 PolarHBondContact O-N 2.83Å; N48-P53 WeakPolarHBondContact OD1-CD 3.43Å; N48-Y56 PolarHBondContact OD1-OH 3.34Å
49	R	67.7	Low	61.4	Low	201 Å²	201	104.2 Å²	104.2	76%	0.758	53%	0.53	S	S	*	.	H	α-helix	trans	-78.7	-38.5	173.8	-70.5	178.7	-173	-104.2	3.6	113.1	E45 S46 L47	E45-R49 WeakPolarHBondContact O-CG 3.23Å; E45-R49 PolarHBondContact O-N 3.4Å; S46-R49 PolarHBondContact O-N 2.78Å; L47-R49 VanDerWaalsContact C-N 3.3Å; L47-R49 PolarHBondContact O-N 3.45Å
50	K	60.3	Low	59.6	Low	152 Å²	152	105.1 Å²	105.1	66%	0.661	54%	0.537	S	S	*	.	H	α-helix	trans	-79.6	-37.3	-176.5	-173.6	177.9	-177.9	-177.3	0	112.2	S46 L47	S46-K50 WeakPolarHBondContact O-CB 3.38Å; S46-K50 PolarHBondContact O-N 3.4Å; L47-K50 PolarHBondContact O-N 2.9Å
51	Y	50.2	Low	58	Low	148 Å²	148	108.4 Å²	108.4	58%	0.58	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	77.8	167.8	-54.7	-84.6	0	0	0	105.5	L47 N48 P53	L47-Y51 HydrophobicContact CD2-CD2 3.77Å; L47-Y51 HydrophobicContact CD2-CE2 3.64Å; L47-Y51 CarbonylContact O-C 3.48Å; L47-Y51 WeakPolarHBondContact O-CA 3.33Å; L47-Y51 WeakPolarHBondContact O-CB 3.41Å; L47-Y51 PolarHBondContact O-N 2.79Å; N48-Y51 CarbonylContact O-C 3.56Å; Y51-P53 WeakPolarHBondContact O-CD 3.42Å
52	T	42.1	Very low	56.4	Low	81 Å²	81	111.6 Å²	111.6	50%	0.497	57%	0.569	S	S	.	*			trans	-54.7	116	162.8	40.4	0	0	0	0	106.8	N48 V54 Y56	N48-T52 VanDerWaalsContact O-CA 3.31Å; N48-T52 WeakPolarHBondContact O-CA 3.14Å; N48-T52 PolarHBondContact O-N 2.83Å; T52-V54 PolarHBondContact O-N 2.92Å; T52-Y56 WeakPolarHBondContact CA-OH 3.48Å; T52-Y56 HydrophobicContact CG2-CE2 4.26Å
53	P	46.2	Very low	55.1	Low	56 Å²	56	110 Å²	110	36%	0.364	56%	0.563	S	S	.	*			trans	-40.8	118.2	162.3	-21.4	8.3	0	0	0	108.1	N48 Y51 S55 Y56	N48-P53 WeakPolarHBondContact OD1-CD 3.43Å; Y51-P53 WeakPolarHBondContact O-CD 3.42Å; P53-S55 PolarHBondContact O-N 3.44Å; P53-Y56 HydrophobicContact CB-CD1 4.32Å; P53-Y56 HydrophobicContact CB-CE1 3.66Å; P53-Y56 WeakPolarHBondContact CD-OH 3.43Å; P53-Y56 HydrophobicContact CG-CE1 3.55Å; P53-Y56 WeakPolarHBondContact CG-OH 3.34Å; P53-Y56 VanDerWaalsContact O-CD2 3.28Å; P53-Y56 WeakPolarHBondContact O-CD2 3.43Å; P53-Y56 WeakPolarHBondContact O-CE2 3.24Å
54	V	41.8	Very low	54	Low	126 Å²	126	109.2 Å²	109.2	76%	0.764	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	31.4	167.9	-163.2	0	0	0	0	109.3	T52	T52-V54 PolarHBondContact O-N 2.92Å
55	S	49.5	Very low	53.9	Low	80 Å²	80	110.9 Å²	110.9	56%	0.559	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	-13.4	-174.7	178.5	0	0	0	0	111.9	P53	P53-S55 PolarHBondContact O-N 3.44Å
56	Y	43.8	Very low	54.3	Low	117 Å²	117	114.5 Å²	114.5	46%	0.459	59%	0.589	S	S	.	*	S	Bend	trans	-107.8	5	-179.8	18.2	-104.7	0	0	0	115.2	N48 T52 P53	N48-Y56 PolarHBondContact OD1-OH 3.34Å; T52-Y56 WeakPolarHBondContact CA-OH 3.48Å; T52-Y56 HydrophobicContact CG2-CE2 4.26Å; P53-Y56 HydrophobicContact CB-CD1 4.32Å; P53-Y56 HydrophobicContact CB-CE1 3.66Å; P53-Y56 WeakPolarHBondContact CD-OH 3.43Å; P53-Y56 HydrophobicContact CG-CE1 3.55Å; P53-Y56 WeakPolarHBondContact CG-OH 3.34Å; P53-Y56 VanDerWaalsContact O-CD2 3.28Å; P53-Y56 WeakPolarHBondContact O-CD2 3.43Å; P53-Y56 WeakPolarHBondContact O-CE2 3.24Å
57	M	41.8	Very low	54.8	Low	162 Å²	162	114.9 Å²	114.9	80%	0.798	58%	0.584	S	S	*	*	S	Bend	trans	-100.4	16.8	172.6	-70.3	-72.6	94.4	0	0	113.6
58	I	43	Very low	55.8	Low	57 Å²	57	118 Å²	118	29%	0.292	60%	0.597	S	S	.	*	S	Bend	trans	-116.1	120.4	163.2	-57.7	177.6	0	0	0	105.6	I60 M63 I88	I58-I60 PolarHBondContact O-N 3.46Å; I58-M63 HydrophobicContact CB-SD 4.21Å; I58-M63 HydrophobicContact CD1-CE 4.23Å; I58-M63 HydrophobicContact CD1-SD 3.5Å; I58-M63 VanDerWaalsContact CD1-SD 3.5Å; I58-M63 HydrophobicContact CG1-SD 4.48Å; I58-M63 HydrophobicContact CG2-CB 4.03Å; I58-M63 HydrophobicContact CG2-CE 4.43Å; I58-M63 HydrophobicContact CG2-CG 4.4Å; I58-M63 HydrophobicContact CG2-SD 3.73Å; I58-I88 HydrophobicContact CD1-CD1 3.1Å; I58-I88 HydrophobicContact CD1-CG1 4.39Å; I58-I88 HydrophobicContact CG1-CD1 4.46Å
59	P	44.9	Very low	57.2	Low	85 Å²	85	118.9 Å²	118.9	55%	0.552	60%	0.598	S	S	*	*			trans	-51.2	119.5	172.5	-18.6	28.5	0	0	0	107.3	D61 N62	P59-D61 PolarHBondContact O-N 2.92Å; P59-N62 HydrophobicContact CB-CB 4.29Å; P59-N62 WeakPolarHBondContact O-CB 3.43Å; P59-N62 PolarHBondContact O-N 3.36Å
60	I	48.8	Very low	58.2	Low	136 Å²	136	117.2 Å²	117.2	70%	0.697	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-54.1	-31.3	-176.5	-67.5	168.7	0	0	0	110.2	I58 N62 M63	I58-I60 PolarHBondContact O-N 3.46Å; I60-N62 PolarHBondContact O-N 3.16Å; I60-M63 PolarHBondContact O-N 2.91Å
61	D	49.4	Very low	59.6	Low	143 Å²	143	112.1 Å²	112.1	77%	0.765	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-67.2	-16	177.9	-49.6	-25.3	0	0	0	113.8	P59	P59-D61 PolarHBondContact O-N 2.92Å
62	N	44.6	Very low	61.6	Low	140 Å²	140	113.6 Å²	113.6	75%	0.749	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-104.8	1	-175.7	-117.5	61.8	0	0	0	113.8	P59 I60	P59-N62 HydrophobicContact CB-CB 4.29Å; P59-N62 WeakPolarHBondContact O-CB 3.43Å; P59-N62 PolarHBondContact O-N 3.36Å; I60-N62 PolarHBondContact O-N 3.16Å
63	M	55.3	Low	63.8	Low	97 Å²	97	113.2 Å²	113.2	48%	0.478	58%	0.584	S	S	.	*	S	Bend	trans	-125.2	4.9	-176.1	-149.1	161.4	67.1	0	0	114	I58 I60 N65 I88	I58-M63 HydrophobicContact CB-SD 4.21Å; I58-M63 HydrophobicContact CD1-CE 4.23Å; I58-M63 HydrophobicContact CD1-SD 3.5Å; I58-M63 VanDerWaalsContact CD1-SD 3.5Å; I58-M63 HydrophobicContact CG1-SD 4.48Å; I58-M63 HydrophobicContact CG2-CB 4.03Å; I58-M63 HydrophobicContact CG2-CE 4.43Å; I58-M63 HydrophobicContact CG2-CG 4.4Å; I58-M63 HydrophobicContact CG2-SD 3.73Å; I60-M63 PolarHBondContact O-N 2.91Å; M63-N65 PolarHBondContact O-N 3.37Å; M63-I88 HydrophobicContact CE-CD1 3.53Å; M63-I88 HydrophobicContact SD-CD1 3.34Å; M63-I88 WeakPolarHBondContact SD-CD1 3.15Å; M63-I88 HydrophobicContact SD-CG1 4.31Å
64	T	60.6	Low	66	Low	93 Å²	93	117.3 Å²	117.3	57%	0.571	60%	0.598	S	S	*	*			trans	-74.1	101.3	164.8	36.7	0	0	0	0	109.2	E66	T64-E66 PolarHBondContact O-N 2.91Å
65	N	68.8	Low	68.3	Low	120 Å²	120	117.6 Å²	117.6	64%	0.642	60%	0.595	S	S	*	*			trans	-76.9	98	172	-159.3	-79	0	0	0	108.5	M63 M67	M63-N65 PolarHBondContact O-N 3.37Å; N65-M67 WeakPolarHBondContact OD1-CG 3.47Å
66	E	80.9	Confident	70.1	Confident	179 Å²	179	122.2 Å²	122.2	84%	0.836	61%	0.614	S	S	*	*			trans	-83.9	122.7	174.2	-66.6	-173	179.3	0	0	109.8	T64	T64-E66 PolarHBondContact O-N 2.91Å
67	M	84.3	Confident	72.2	Confident	76 Å²	76	124.2 Å²	124.2	37%	0.374	62%	0.622	S	S	.	*			trans	-124.6	129.9	175.2	-67	-176.5	-71.8	0	0	110	N65 F82 L84	N65-M67 WeakPolarHBondContact OD1-CG 3.47Å; M67-F82 HydrophobicContact CB-CD1 3.64Å; M67-F82 HydrophobicContact CB-CE1 3.8Å; M67-F82 HydrophobicContact CB-CG 4.5Å; M67-F82 HydrophobicContact CE-CB 3.65Å; M67-F82 HydrophobicContact CE-CD1 4.19Å; M67-F82 HydrophobicContact CE-CG 4.18Å; M67-F82 HydrophobicContact CG-CD1 4.39Å; M67-F82 HydrophobicContact SD-CB 4.14Å; M67-F82 HydrophobicContact SD-CD1 3.93Å; M67-F82 HydrophobicContact SD-CG 4.45Å; M67-L84 HydrophobicContact CE-CD2 3.19Å; M67-L84 HydrophobicContact CE-CG 3.89Å
68	E	89.3	Confident	74.5	Confident	146 Å²	146	121.3 Å²	121.3	68%	0.682	61%	0.605	S	S	*	*			trans	-123.6	134.9	174.1	-176.6	-174.7	153.8	0	0	109.1	R70	E68-R70 IonicContact OE1-CZ 3.42Å; E68-R70 IonicContact OE1-NE 3.32Å; E68-R70 PolarHBondContact OE1-NE 2.84Å; E68-R70 VanDerWaalsContact OE1-NE 3.16Å; E68-R70 IonicContact OE1-NH2 2.65Å; E68-R70 PolarHBondContact OE1-NH2 2.77Å
69	Q	87.1	Confident	76.6	Confident	101 Å²	101	122.2 Å²	122.2	47%	0.472	62%	0.616	S	S	.	*			trans	-131.8	127.1	168.2	-174.7	172	-20.7	0	0	109.9	V71 T80 F82	Q69-V71 HydrophobicContact CG-CG1 3.99Å; Q69-T80 PolarHBondContact OE1-OG1 3.44Å; Q69-F82 HydrophobicContact CB-CE1 3.83Å; Q69-F82 HydrophobicContact CB-CZ 3.73Å
70	R	90.1	Very high	78.7	Confident	166 Å²	166	120.5 Å²	120.5	63%	0.626	60%	0.604	S	S	*	*			trans	-87.8	131.6	169.2	-66.8	-175.6	-176.5	131.1	15.3	109.1	E68	E68-R70 IonicContact OE1-CZ 3.42Å; E68-R70 IonicContact OE1-NE 3.32Å; E68-R70 PolarHBondContact OE1-NE 2.84Å; E68-R70 VanDerWaalsContact OE1-NE 3.16Å; E68-R70 IonicContact OE1-NH2 2.65Å; E68-R70 PolarHBondContact OE1-NH2 2.77Å
71	V	90	Very high	80.7	Confident	45 Å²	45	122.5 Å²	122.5	27%	0.273	61%	0.61	S	S	.	*			trans	-131.8	135.3	178.2	-64.8	0	0	0	0	108.3	Q69 F78	Q69-V71 HydrophobicContact CG-CG1 3.99Å; V71-F78 HydrophobicContact CG2-CB 3.88Å; V71-F78 HydrophobicContact CG2-CD2 3.57Å; V71-F78 HydrophobicContact CG2-CE2 4.4Å; V71-F78 HydrophobicContact CG2-CG 3.98Å
72	E	90.9	Very high	82.5	Confident	180 Å²	180	120.1 Å²	120.1	84%	0.841	59%	0.593	S	S	*	*			trans	-80.7	119.7	168.5	-69.3	-58.7	142.3	0	0	107.6
73	P	89.4	Confident	84.5	Confident	72 Å²	72	121.2 Å²	121.2	47%	0.468	60%	0.598	S	S	.	*			trans	-66.2	145.3	178.9	28.8	-34.2	0	0	0	110.3	F78	P73-F78 HydrophobicContact CB-CB 4.08Å; P73-F78 HydrophobicContact CB-CD1 4.45Å
74	H	90.6	Very high	85.9	Confident	143 Å²	143	119.4 Å²	119.4	66%	0.662	59%	0.59	S	S	*	*	B	Isolated β-bridge	trans	-102.6	107.9	171.3	-175.1	-80.5	0	0	0	108.5	Y77	H74-Y77 PolarHBondContact N-O 3.28Å; H74-Y77 PolarHBondContact O-N 2.92Å
75	N	90.8	Very high	86.8	Confident	131 Å²	131	121.7 Å²	121.7	70%	0.701	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	55.5	-133.2	-164.3	-52.3	-39.8	0	0	0	110.3	Y77	N75-Y77 VanDerWaalsContact C-N 3.27Å; N75-Y77 PolarHBondContact O-N 3.03Å
76	D	87.4	Confident	87.3	Confident	177 Å²	177	117.7 Å²	117.7	95%	0.947	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	16.9	-177.8	-60.2	-20.2	0	0	0	113.3
77	Y	88.2	Confident	87	Confident	160 Å²	160	113.5 Å²	113.5	63%	0.627	57%	0.572	S	S	*	*	B	Isolated β-bridge	trans	-132.2	140.7	-176.7	-178.9	-98.7	0	0	0	112.8	H74 N75	H74-Y77 PolarHBondContact N-O 3.28Å; H74-Y77 PolarHBondContact O-N 2.92Å; N75-Y77 VanDerWaalsContact C-N 3.27Å; N75-Y77 PolarHBondContact O-N 3.03Å
78	F	89.1	Confident	86.7	Confident	101 Å²	101	112.2 Å²	112.2	44%	0.443	57%	0.566	S	S	.	*			trans	-141.9	156	167.4	67.9	-87.7	0	0	0	110.3	V71 P73	V71-F78 HydrophobicContact CG2-CB 3.88Å; V71-F78 HydrophobicContact CG2-CD2 3.57Å; V71-F78 HydrophobicContact CG2-CE2 4.4Å; V71-F78 HydrophobicContact CG2-CG 3.98Å; P73-F78 HydrophobicContact CB-CB 4.08Å; P73-F78 HydrophobicContact CB-CD1 4.45Å
79	S	89.2	Confident	86.4	Confident	75 Å²	75	109.9 Å²	109.9	52%	0.524	56%	0.558	S	S	.	*			trans	-142.4	151.6	171.6	64.8	0	0	0	0	110.6
80	T	88.4	Confident	86.2	Confident	49 Å²	49	106.6 Å²	106.6	30%	0.301	55%	0.551	S	S	.	*			trans	-146.6	159.6	174.3	-175.4	0	0	0	0	108.8	Q69 F82	Q69-T80 PolarHBondContact OE1-OG1 3.44Å; T80-F82 HydrophobicContact CG2-CD2 4.33Å; T80-F82 HydrophobicContact CG2-CE2 3.55Å; T80-F82 HydrophobicContact CG2-CZ 4.07Å
81	Q	89.9	Confident	86	Confident	179 Å²	179	102.3 Å²	102.3	84%	0.836	54%	0.543	S	S	*	.			trans	-134.1	131.6	-179.2	-66.9	179.9	67.6	0	0	109.4
82	F	86.9	Confident	85.7	Confident	92 Å²	92	102.2 Å²	102.2	40%	0.404	54%	0.54	S	S	.	.			trans	-117.6	136.5	174.3	-60.2	-80.1	0	0	0	108.8	M67 Q69 T80	M67-F82 HydrophobicContact CB-CD1 3.64Å; M67-F82 HydrophobicContact CB-CE1 3.8Å; M67-F82 HydrophobicContact CB-CG 4.5Å; M67-F82 HydrophobicContact CE-CB 3.65Å; M67-F82 HydrophobicContact CE-CD1 4.19Å; M67-F82 HydrophobicContact CE-CG 4.18Å; M67-F82 HydrophobicContact CG-CD1 4.39Å; M67-F82 HydrophobicContact SD-CB 4.14Å; M67-F82 HydrophobicContact SD-CD1 3.93Å; M67-F82 HydrophobicContact SD-CG 4.45Å; Q69-F82 HydrophobicContact CB-CE1 3.83Å; Q69-F82 HydrophobicContact CB-CZ 3.73Å; T80-F82 HydrophobicContact CG2-CD2 4.33Å; T80-F82 HydrophobicContact CG2-CE2 3.55Å; T80-F82 HydrophobicContact CG2-CZ 4.07Å
83	L	87	Confident	85.4	Confident	164 Å²	164	98.9 Å²	98.9	86%	0.859	53%	0.528	S	S	*	.			trans	-103.7	118.4	173.1	-173.2	66.1	0	0	0	108.8
84	L	84.1	Confident	85.4	Confident	58 Å²	58	97.2 Å²	97.2	30%	0.304	52%	0.515	S	S	.	.			trans	-96.3	134.6	177.9	-70.5	167.9	0	0	0	110.3	M67 F86 I94	M67-L84 HydrophobicContact CE-CD2 3.19Å; M67-L84 HydrophobicContact CE-CG 3.89Å; L84-F86 HydrophobicContact CB-CE2 4.08Å; L84-F86 HydrophobicContact CB-CZ 3.92Å; L84-F86 HydrophobicContact CD1-CZ 4.09Å; L84-I94 HydrophobicContact CD1-CD1 3.54Å; L84-I94 HydrophobicContact CD1-CG1 3.88Å; L84-I94 HydrophobicContact CD1-CG2 3.95Å
85	N	80	Confident	85.4	Confident	141 Å²	141	93.2 Å²	93.2	75%	0.754	50%	0.5	S	S	*	.			trans	-104.2	118.2	168.9	-178	26.2	0	0	0	109.8	A87	N85-A87 PolarHBondContact O-N 3.03Å
86	F	80	Confident	85.4	Confident	37 Å²	37	90.5 Å²	90.5	16%	0.162	49%	0.488	C	S	.	.			trans	-93.2	95.1	176.2	-59.2	-74.7	0	0	0	109.8	L84 I88 H92 I94 V118 S120	L84-F86 HydrophobicContact CB-CE2 4.08Å; L84-F86 HydrophobicContact CB-CZ 3.92Å; L84-F86 HydrophobicContact CD1-CZ 4.09Å; F86-I88 PolarHBondContact O-N 3.27Å; F86-H92 HydrophobicContact CD1-CB 4.12Å; F86-H92 AromaticContact CD1-CD2 3.53Å; F86-H92 AromaticContact CD1-CE1 3.61Å; F86-H92 AromaticContact CD1-CG 3.44Å; F86-H92 VanDerWaalsContact CD1-CG 3.44Å; F86-H92 AromaticContact CD1-ND1 3.51Å; F86-H92 AromaticContact CD1-NE2 3.61Å; F86-H92 HydrophobicContact CE1-CB 3.73Å; F86-H92 AromaticContact CE1-CD2 3.99Å; F86-H92 AromaticContact CE1-CG 3.61Å; F86-H92 AromaticContact CE1-ND1 3.95Å; F86-I94 HydrophobicContact CE1-CD1 4.44Å; F86-I94 HydrophobicContact CZ-CD1 3.94Å; F86-V118 HydrophobicContact CE2-CG1 3.97Å; F86-V118 HydrophobicContact CZ-CB 4.24Å; F86-V118 HydrophobicContact CZ-CG1 3.89Å; F86-S120 VanDerWaalsContact CB-OG 3.27Å; F86-S120 WeakPolarHBondContact CB-OG 3.44Å; F86-S120 WeakPolarHBondContact CD2-OG 3.47Å; F86-S120 WeakPolarHBondContact CG-OG 3.41Å
87	A	74.3	Confident	85.6	Confident	91 Å²	91	86.8 Å²	86.8	75%	0.752	47%	0.465	S	S	*	.			trans	-67.3	-13.6	177.7	0	0	0	0	0	113.3	N85	N85-A87 PolarHBondContact O-N 3.03Å
88	I	79.2	Confident	85.6	Confident	49 Å²	49	81.1 Å²	81.1	25%	0.251	45%	0.449	S	S	.	.	S	Bend	trans	-133.3	133.2	-172.2	-55.1	-179.5	0	0	0	109.9	I58 M63 F86 H92	I58-I88 HydrophobicContact CD1-CD1 3.1Å; I58-I88 HydrophobicContact CD1-CG1 4.39Å; I58-I88 HydrophobicContact CG1-CD1 4.46Å; M63-I88 HydrophobicContact CE-CD1 3.53Å; M63-I88 HydrophobicContact SD-CD1 3.34Å; M63-I88 WeakPolarHBondContact SD-CD1 3.15Å; M63-I88 HydrophobicContact SD-CG1 4.31Å; F86-I88 PolarHBondContact O-N 3.27Å; I88-H92 PolarHBondContact O-CE1 2.96Å; I88-H92 PolarHBondContact O-NE2 3.36Å
89	L	81.3	Confident	85.7	Confident	97 Å²	97	79.6 Å²	79.6	51%	0.508	45%	0.451	S	S	.	.			trans	-69.2	143.3	172.9	-56.9	-179.9	0	0	0	110.2	S120 E122	L89-S120 WeakPolarHBondContact CA-O 3.13Å; L89-E122 HydrophobicContact CD1-CB 3.8Å; L89-E122 HydrophobicContact CD1-CG 4.43Å; L89-E122 HydrophobicContact CD2-CB 4.34Å
90	G	84.2	Confident	85.8	Confident	32 Å²	32	80 Å²	80	33%	0.33	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	138.3	-167.9	-179.3	0	0	0	0	0	112.9	H92 K119 S120	G90-H92 PolarHBondContact O-CD2 3.43Å; G90-K119 CarbonylContact O-C 3.43Å; G90-K119 WeakPolarHBondContact O-CA 3.02Å; G90-S120 PolarHBondContact N-O 3.33Å; G90-S120 PolarHBondContact O-N 2.93Å
91	T	84.3	Confident	85.8	Confident	76 Å²	76	82.5 Å²	82.5	47%	0.466	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	129.1	178.2	-52.8	0	0	0	0	109.3	V118 K119	T91-V118 CarbonylContact C-O 3.49Å; T91-V118 WeakPolarHBondContact CA-O 3.32Å; T91-K119 HydrophobicContact CG2-CG 4.29Å; T91-K119 PolarHBondContact OG1-NZ 2.79Å
92	H	83.6	Confident	85.9	Confident	42 Å²	42	76.2 Å²	76.2	19%	0.194	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	142.9	-179.8	-62.8	-94.3	0	0	0	109.9	F86 I88 G90 F117 V118 S120	F86-H92 HydrophobicContact CD1-CB 4.12Å; F86-H92 AromaticContact CD1-CD2 3.53Å; F86-H92 AromaticContact CD1-CE1 3.61Å; F86-H92 AromaticContact CD1-CG 3.44Å; F86-H92 VanDerWaalsContact CD1-CG 3.44Å; F86-H92 AromaticContact CD1-ND1 3.51Å; F86-H92 AromaticContact CD1-NE2 3.61Å; F86-H92 HydrophobicContact CE1-CB 3.73Å; F86-H92 AromaticContact CE1-CD2 3.99Å; F86-H92 AromaticContact CE1-CG 3.61Å; F86-H92 AromaticContact CE1-ND1 3.95Å; I88-H92 PolarHBondContact O-CE1 2.96Å; I88-H92 PolarHBondContact O-NE2 3.36Å; G90-H92 PolarHBondContact O-CD2 3.43Å; H92-F117 WeakPolarHBondContact O-CA 3.29Å; H92-V118 PolarHBondContact N-O 2.78Å; H92-V118 PolarHBondContact O-N 2.93Å; H92-S120 PolarHBondContact CD2-OG 2.91Å
93	N	86.4	Confident	86.1	Confident	111 Å²	111	77 Å²	77	59%	0.594	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.3	115.8	174.3	-62.6	-9.8	0	0	0	108.2	T115 F117	N93-T115 HydrophobicContact CB-CG2 4.38Å; N93-F117 WeakPolarHBondContact OD1-CD1 3.46Å; N93-F117 WeakPolarHBondContact OD1-CE1 3.32Å
94	I	89.1	Confident	86.4	Confident	37 Å²	37	75.9 Å²	75.9	19%	0.19	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.6	179.6	-55.4	161.8	0	0	0	107.5	L84 F86 V96 T115 I116 V118	L84-I94 HydrophobicContact CD1-CD1 3.54Å; L84-I94 HydrophobicContact CD1-CG1 3.88Å; L84-I94 HydrophobicContact CD1-CG2 3.95Å; F86-I94 HydrophobicContact CE1-CD1 4.44Å; F86-I94 HydrophobicContact CZ-CD1 3.94Å; I94-V96 HydrophobicContact CG2-CG2 4.31Å; I94-T115 CarbonylContact O-C 3.57Å; I94-T115 VanDerWaalsContact O-CA 3.24Å; I94-T115 WeakPolarHBondContact O-CA 3.35Å; I94-I116 HydrophobicContact CB-CB 4.4Å; I94-I116 PolarHBondContact N-O 3.31Å; I94-I116 PolarHBondContact O-N 2.91Å; I94-V118 HydrophobicContact CD1-CB 4.08Å; I94-V118 HydrophobicContact CD1-CG2 3.4Å
95	T	90.1	Very high	86.6	Confident	59 Å²	59	75 Å²	75	36%	0.362	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125.1	173.3	-62.3	0	0	0	0	109.7	E97 R113 T114 T115	T95-E97 HydrophobicContact CG2-CG 4.11Å; T95-R113 HydrophobicContact CG2-CG 3.59Å; T95-T114 WeakPolarHBondContact CA-O 3.24Å; T95-T115 PolarHBondContact OG1-OG1 3.22Å
96	V	90.8	Very high	87.2	Confident	73 Å²	73	72.5 Å²	72.5	44%	0.442	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	129.4	174	-175.8	0	0	0	0	108.3	I94 R113 T114 I116	I94-V96 HydrophobicContact CG2-CG2 4.31Å; V96-R113 WeakPolarHBondContact O-CA 3.38Å; V96-T114 PolarHBondContact N-O 2.9Å; V96-T114 PolarHBondContact O-N 2.92Å; V96-I116 HydrophobicContact CG2-CD1 4.49Å
97	E	90.7	Very high	87.7	Confident	100 Å²	100	74.4 Å²	74.4	47%	0.467	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	144.8	176.6	-66.8	-178	110.4	0	0	109.1	T95 R113	T95-E97 HydrophobicContact CG2-CG 4.11Å; E97-R113 VanDerWaalsContact CD-NH1 3.26Å; E97-R113 HydrophobicContact CG-CB 4.05Å; E97-R113 HydrophobicContact CG-CG 3.73Å; E97-R113 WeakPolarHBondContact OE1-CD 3.25Å; E97-R113 IonicContact OE1-CZ 2.83Å; E97-R113 IonicContact OE1-NE 2.79Å; E97-R113 IonicContact OE1-NH1 3.16Å; E97-R113 PolarHBondContact OE1-NH1 2.95Å; E97-R113 IonicContact OE2-NH1 3.66Å; E97-R113 PolarHBondContact OE2-NH1 2.88Å
98	S	89.5	Confident	88.4	Confident	40 Å²	40	76.6 Å²	76.6	28%	0.28	44%	0.441	S	S	.	.			trans	-120.4	145	168.2	60.4	0	0	0	0	111.3	G111	S98-G111 WeakPolarHBondContact O-CA 3.4Å; S98-G111 PolarHBondContact O-N 3.08Å; S98-G111 VanDerWaalsContact O-N 3.14Å; S98-G111 VanDerWaalsContact OG-CA 3.25Å; S98-G111 WeakPolarHBondContact OG-CA 3.4Å
99	S	90.8	Very high	88.8	Confident	69 Å²	69	82.5 Å²	82.5	48%	0.483	47%	0.465	S	S	.	.			trans	-141.6	152.5	179.7	64.1	0	0	0	0	110.1	W108	S99-W108 CarbonylContact C-O 3.6Å; S99-W108 VanDerWaalsContact CA-O 3.26Å; S99-W108 WeakPolarHBondContact CA-O 3.36Å; S99-W108 VanDerWaalsContact CB-O 3.31Å; S99-W108 WeakPolarHBondContact CB-O 3.4Å
100	V	90.6	Very high	88.7	Confident	83 Å²	83	82.4 Å²	82.4	50%	0.503	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	133.4	177.3	175.9	0	0	0	0	108.4	W108	V100-W108 PolarHBondContact N-O 2.81Å; V100-W108 PolarHBondContact O-N 2.93Å
101	K	89.8	Confident	88.3	Confident	103 Å²	103	82.2 Å²	82.2	45%	0.448	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	126.7	171.7	-162.4	176.2	-146	177.1	0	109.1	G105 I106 V107	K101-G105 WeakPolarHBondContact CE-O 3.44Å; K101-I106 WeakPolarHBondContact CA-O 3.26Å; K101-V107 HydrophobicContact CD-CG2 4.49Å; K101-V107 HydrophobicContact CG-CG2 4.18Å
102	D	90.6	Very high	88.1	Confident	47 Å²	47	83.2 Å²	83.2	25%	0.251	47%	0.474	S	S	.	.			trans	-84.6	176.2	177.5	73.1	20.6	0	0	0	112.7	N104 G105 I106 W108	D102-N104 PolarHBondContact O-N 3.44Å; D102-N104 WeakPolarHBondContact OD1-CA 3.35Å; D102-N104 WeakPolarHBondContact OD1-CB 3.39Å; D102-N104 PolarHBondContact OD1-N 2.86Å; D102-G105 PolarHBondContact O-N 3.47Å; D102-G105 PolarHBondContact OD1-N 3.36Å; D102-G105 VanDerWaalsContact OD1-N 3.08Å; D102-I106 PolarHBondContact N-O 2.9Å; D102-I106 PolarHBondContact OD1-N 3.37Å; D102-I106 WeakPolarHBondContact OD2-CB 3.31Å; D102-W108 PolarHBondContact OD2-NE1 2.9Å
103	A	92	Very high	88.4	Confident	109 Å²	109	88.8 Å²	88.8	90%	0.901	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.8	-179.8	0	0	0	0	0	114.1	G105	A103-G105 VanDerWaalsContact C-N 3.27Å
104	N	93.8	Very high	88.5	Confident	140 Å²	140	87 Å²	87	75%	0.749	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-0.2	175.8	-57.5	-49.4	0	0	0	111.7	D102 I106	D102-N104 PolarHBondContact O-N 3.44Å; D102-N104 WeakPolarHBondContact OD1-CA 3.35Å; D102-N104 WeakPolarHBondContact OD1-CB 3.39Å; D102-N104 PolarHBondContact OD1-N 2.86Å; N104-I106 VanDerWaalsContact C-N 3.32Å; N104-I106 HydrophobicContact CB-CD1 4.37Å; N104-I106 HydrophobicContact CB-CG1 4.28Å
105	G	88.5	Confident	88.5	Confident	39 Å²	39	88 Å²	88	40%	0.402	49%	0.494	S	S	.	.	S	Bend	trans	81.8	7.4	-178	0	0	0	0	0	114.2	K101 D102 A103	K101-G105 WeakPolarHBondContact CE-O 3.44Å; D102-G105 PolarHBondContact O-N 3.47Å; D102-G105 PolarHBondContact OD1-N 3.36Å; D102-G105 VanDerWaalsContact OD1-N 3.08Å; A103-G105 VanDerWaalsContact C-N 3.27Å
106	I	91.9	Very high	88.6	Confident	88 Å²	88	88.1 Å²	88.1	45%	0.451	49%	0.492	S	S	.	.			trans	-76.4	133.4	178.2	-55.9	174.3	0	0	0	108.6	K101 D102 N104 W108	K101-I106 WeakPolarHBondContact CA-O 3.26Å; D102-I106 PolarHBondContact N-O 2.9Å; D102-I106 PolarHBondContact OD1-N 3.37Å; D102-I106 WeakPolarHBondContact OD2-CB 3.31Å; N104-I106 VanDerWaalsContact C-N 3.32Å; N104-I106 HydrophobicContact CB-CD1 4.37Å; N104-I106 HydrophobicContact CB-CG1 4.28Å; I106-W108 HydrophobicContact CG2-CZ2 4.22Å
107	V	89.6	Confident	88.4	Confident	77 Å²	77	88.2 Å²	88.2	47%	0.467	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	123.5	178.9	179.8	0	0	0	0	109.6	K101	K101-V107 HydrophobicContact CD-CG2 4.49Å; K101-V107 HydrophobicContact CG-CG2 4.18Å
108	W	89.4	Confident	88.2	Confident	137 Å²	137	84 Å²	84	52%	0.519	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	114.7	179.1	-61.3	88	0	0	0	109.2	S99 V100 D102 I106 T110	S99-W108 CarbonylContact C-O 3.6Å; S99-W108 VanDerWaalsContact CA-O 3.26Å; S99-W108 WeakPolarHBondContact CA-O 3.36Å; S99-W108 VanDerWaalsContact CB-O 3.31Å; S99-W108 WeakPolarHBondContact CB-O 3.4Å; V100-W108 PolarHBondContact N-O 2.81Å; V100-W108 PolarHBondContact O-N 2.93Å; D102-W108 PolarHBondContact OD2-NE1 2.9Å; I106-W108 HydrophobicContact CG2-CZ2 4.22Å; W108-T110 HydrophobicContact CB-CG2 3.72Å; W108-T110 PolarHBondContact O-N 2.78Å
109	K	86.9	Confident	88	Confident	173 Å²	173	86.4 Å²	86.4	75%	0.752	47%	0.473	S	S	*	.			trans	-77	75.4	174	-66.4	-167.9	176.9	-164.6	0	110
110	T	81	Confident	87.7	Confident	96 Å²	96	83.1 Å²	83.1	59%	0.589	45%	0.451	S	S	*	.			trans	-99.3	-10.9	-174.4	53.1	0	0	0	0	113.3	W108	W108-T110 HydrophobicContact CB-CG2 3.72Å; W108-T110 PolarHBondContact O-N 2.78Å
111	G	75.8	Confident	87.3	Confident	27 Å²	27	84.3 Å²	84.3	28%	0.278	45%	0.454	S	S	.	.	S	Bend	trans	-88.1	161.3	-175.4	0	0	0	0	0	114.8	S98	S98-G111 WeakPolarHBondContact O-CA 3.4Å; S98-G111 PolarHBondContact O-N 3.08Å; S98-G111 VanDerWaalsContact O-N 3.14Å; S98-G111 VanDerWaalsContact OG-CA 3.25Å; S98-G111 WeakPolarHBondContact OG-CA 3.4Å
112	P	80	Confident	86.7	Confident	98 Å²	98	81.3 Å²	81.3	64%	0.636	44%	0.441	S	S	*	.			trans	-62	140.5	170.3	27.2	-33.1	0	0	0	110.4
113	R	89.3	Confident	86.1	Confident	159 Å²	159	81 Å²	81	60%	0.6	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	107.4	165.2	179.2	175.9	178.7	126.5	-2.6	107.6	T95 V96 E97	T95-R113 HydrophobicContact CG2-CG 3.59Å; V96-R113 WeakPolarHBondContact O-CA 3.38Å; E97-R113 VanDerWaalsContact CD-NH1 3.26Å; E97-R113 HydrophobicContact CG-CB 4.05Å; E97-R113 HydrophobicContact CG-CG 3.73Å; E97-R113 WeakPolarHBondContact OE1-CD 3.25Å; E97-R113 IonicContact OE1-CZ 2.83Å; E97-R113 IonicContact OE1-NE 2.79Å; E97-R113 IonicContact OE1-NH1 3.16Å; E97-R113 PolarHBondContact OE1-NH1 2.95Å; E97-R113 IonicContact OE2-NH1 3.66Å; E97-R113 PolarHBondContact OE2-NH1 2.88Å
114	T	89.3	Confident	85.4	Confident	73 Å²	73	79.3 Å²	79.3	45%	0.448	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	131.7	-179	-59.3	0	0	0	0	109.7	T95 V96 I116	T95-T114 WeakPolarHBondContact CA-O 3.24Å; V96-T114 PolarHBondContact N-O 2.9Å; V96-T114 PolarHBondContact O-N 2.92Å; T114-I116 HydrophobicContact CG2-CG1 4.46Å
115	T	89	Confident	84.8	Confident	58 Å²	58	79.8 Å²	79.8	36%	0.356	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	130.2	174.1	-60.1	0	0	0	0	109.9	N93 I94 T95 F117	N93-T115 HydrophobicContact CB-CG2 4.38Å; I94-T115 CarbonylContact O-C 3.57Å; I94-T115 VanDerWaalsContact O-CA 3.24Å; I94-T115 WeakPolarHBondContact O-CA 3.35Å; T95-T115 PolarHBondContact OG1-OG1 3.22Å; T115-F117 HydrophobicContact CG2-CZ 4.4Å
116	I	90.3	Very high	84.4	Confident	61 Å²	61	80.3 Å²	80.3	31%	0.313	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	133.8	178.8	-54.8	171.2	0	0	0	108.3	I6 I94 V96 T114 V118	I6-I116 HydrophobicContact CG2-CG2 4.44Å; I94-I116 HydrophobicContact CB-CB 4.4Å; I94-I116 PolarHBondContact N-O 3.31Å; I94-I116 PolarHBondContact O-N 2.91Å; V96-I116 HydrophobicContact CG2-CD1 4.49Å; T114-I116 HydrophobicContact CG2-CG1 4.46Å; I116-V118 HydrophobicContact CG2-CG2 4.12Å
117	F	86.7	Confident	83.7	Confident	76 Å²	76	80 Å²	80	33%	0.333	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	122.3	173.8	-62.1	-82.7	0	0	0	109.7	H92 N93 T115	H92-F117 WeakPolarHBondContact O-CA 3.29Å; N93-F117 WeakPolarHBondContact OD1-CD1 3.46Å; N93-F117 WeakPolarHBondContact OD1-CE1 3.32Å; T115-F117 HydrophobicContact CG2-CZ 4.4Å
118	V	87.4	Confident	83.3	Confident	11 Å²	11	82.4 Å²	82.4	7%	0.067	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	124.2	177.9	174	0	0	0	0	109.6	A4 F86 T91 H92 I94 I116	A4-V118 HydrophobicContact CB-CG1 4.01Å; F86-V118 HydrophobicContact CE2-CG1 3.97Å; F86-V118 HydrophobicContact CZ-CB 4.24Å; F86-V118 HydrophobicContact CZ-CG1 3.89Å; T91-V118 CarbonylContact C-O 3.49Å; T91-V118 WeakPolarHBondContact CA-O 3.32Å; H92-V118 PolarHBondContact N-O 2.78Å; H92-V118 PolarHBondContact O-N 2.93Å; I94-V118 HydrophobicContact CD1-CB 4.08Å; I94-V118 HydrophobicContact CD1-CG2 3.4Å; I116-V118 HydrophobicContact CG2-CG2 4.12Å
119	K	85.8	Confident	83	Confident	90 Å²	90	79 Å²	79	39%	0.391	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	110.9	170.2	-71	-177.5	-177.1	-71.4	0	109.1	L7 G90 T91	L7-K119 HydrophobicContact CD1-CD 3.97Å; L7-K119 HydrophobicContact CD1-CG 4.39Å; G90-K119 CarbonylContact O-C 3.43Å; G90-K119 WeakPolarHBondContact O-CA 3.02Å; T91-K119 HydrophobicContact CG2-CG 4.29Å; T91-K119 PolarHBondContact OG1-NZ 2.79Å
120	S	84.6	Confident	82.6	Confident	1 Å²	1	77 Å²	77	1%	0.007	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	111.4	171.8	-66	0	0	0	0	108.9	F86 L89 G90 H92	F86-S120 VanDerWaalsContact CB-OG 3.27Å; F86-S120 WeakPolarHBondContact CB-OG 3.44Å; F86-S120 WeakPolarHBondContact CD2-OG 3.47Å; F86-S120 WeakPolarHBondContact CG-OG 3.41Å; L89-S120 WeakPolarHBondContact CA-O 3.13Å; G90-S120 PolarHBondContact N-O 3.33Å; G90-S120 PolarHBondContact O-N 2.93Å; H92-S120 PolarHBondContact CD2-OG 2.91Å
121	L	81.3	Confident	82.6	Confident	108 Å²	108	77.6 Å²	77.6	57%	0.565	39%	0.39	S	S	*	.			trans	-106	159.9	177.7	-60	176.9	0	0	0	110.1
122	E	77.4	Confident	82.9	Confident	40 Å²	40	83.5 Å²	83.5	19%	0.187	41%	0.41	C	S	.	.			trans	-73.5	135.9	173.7	-168.2	178.8	171.5	0	0	110.9	L89 P124 Q127 R130	L89-E122 HydrophobicContact CD1-CB 3.8Å; L89-E122 HydrophobicContact CD1-CG 4.43Å; L89-E122 HydrophobicContact CD2-CB 4.34Å; E122-P124 WeakPolarHBondContact O-CD 3.49Å; E122-Q127 HydrophobicContact CB-CG 4.08Å; E122-Q127 HydrophobicContact CG-CG 3.77Å; E122-Q127 PolarHBondContact O-NE2 2.94Å; E122-R130 IonicContact OE1-CZ 3.9Å; E122-R130 IonicContact OE1-NE 3.77Å; E122-R130 IonicContact OE1-NH1 2.74Å; E122-R130 PolarHBondContact OE1-NH1 3.19Å; E122-R130 IonicContact OE1-NH2 3.77Å; E122-R130 PolarHBondContact OE1-NH2 3.14Å; E122-R130 IonicContact OE2-CZ 2.86Å; E122-R130 IonicContact OE2-NH1 3.4Å; E122-R130 PolarHBondContact OE2-NH1 3.25Å; E122-R130 IonicContact OE2-NH2 2.8Å; E122-R130 PolarHBondContact OE2-NH2 2.86Å
123	D	78.8	Confident	82.7	Confident	41 Å²	41	84.7 Å²	84.7	22%	0.219	41%	0.407	C	S	.	.			trans	-54.8	120.9	171.7	-175.5	-30.1	0	0	0	110.4	A1 Y125 S126 Q127	A1-D123 PolarHBondContact N-OD2 3.29Å; D123-Y125 PolarHBondContact O-N 2.93Å; D123-Y125 VanDerWaalsContact O-N 3.09Å; D123-Y125 VanDerWaalsContact OD1-CB 3.3Å; D123-Y125 WeakPolarHBondContact OD1-CB 3.35Å; D123-Y125 PolarHBondContact OD1-N 3.49Å; D123-S126 WeakPolarHBondContact O-CA 3.47Å; D123-S126 WeakPolarHBondContact O-CB 3.49Å; D123-S126 PolarHBondContact O-N 2.97Å; D123-Q127 PolarHBondContact O-N 3.01Å; D123-Q127 VanDerWaalsContact O-N 3.15Å
124	P	77.5	Confident	81.8	Confident	72 Å²	72	83.7 Å²	83.7	47%	0.468	41%	0.409	S	S	.	.	H	α-helix	trans	-53.7	-31.7	-179.3	-26.5	34.1	0	0	0	113.8	E122 Q127 Q128	E122-P124 WeakPolarHBondContact O-CD 3.49Å; P124-Q127 WeakPolarHBondContact O-CB 3.25Å; P124-Q127 PolarHBondContact O-N 3.37Å; P124-Q128 PolarHBondContact O-N 3.38Å
125	Y	79.6	Confident	80.5	Confident	150 Å²	150	87.6 Å²	87.6	59%	0.588	42%	0.423	S	S	*	.	H	α-helix	trans	-69.3	-39.2	177.4	-174.4	-105.3	0	0	0	111.8	D123 Q127 Q128 I129	D123-Y125 PolarHBondContact O-N 2.93Å; D123-Y125 VanDerWaalsContact O-N 3.09Å; D123-Y125 VanDerWaalsContact OD1-CB 3.3Å; D123-Y125 WeakPolarHBondContact OD1-CB 3.35Å; D123-Y125 PolarHBondContact OD1-N 3.49Å; Y125-Q127 VanDerWaalsContact C-N 3.29Å; Y125-Q127 PolarHBondContact O-N 2.81Å; Y125-Q128 PolarHBondContact O-N 3.29Å; Y125-I129 HydrophobicContact CD1-CD1 4.17Å; Y125-I129 HydrophobicContact CE1-CD1 3.52Å; Y125-I129 HydrophobicContact CE1-CG1 4.24Å; Y125-I129 PolarHBondContact O-N 2.83Å; Y125-I129 VanDerWaalsContact O-N 3.15Å
126	S	79.9	Confident	79.2	Confident	51 Å²	51	89 Å²	89	36%	0.357	44%	0.44	S	S	.	.	H	α-helix	trans	-64.5	-37.5	175.9	-61	0	0	0	0	111.3	D123 I129 R130	D123-S126 WeakPolarHBondContact O-CA 3.47Å; D123-S126 WeakPolarHBondContact O-CB 3.49Å; D123-S126 PolarHBondContact O-N 2.97Å; S126-I129 PolarHBondContact O-N 3.2Å; S126-R130 PolarHBondContact O-N 3.47Å
127	Q	77.9	Confident	77.5	Confident	82 Å²	82	93.6 Å²	93.6	38%	0.383	46%	0.46	S	S	.	.	H	α-helix	trans	-60.8	-45.5	174.6	-61.6	179.2	36.5	0	0	111.4	E122 D123 P124 Y125 R130 L131	E122-Q127 HydrophobicContact CB-CG 4.08Å; E122-Q127 HydrophobicContact CG-CG 3.77Å; E122-Q127 PolarHBondContact O-NE2 2.94Å; D123-Q127 PolarHBondContact O-N 3.01Å; D123-Q127 VanDerWaalsContact O-N 3.15Å; P124-Q127 WeakPolarHBondContact O-CB 3.25Å; P124-Q127 PolarHBondContact O-N 3.37Å; Y125-Q127 VanDerWaalsContact C-N 3.29Å; Y125-Q127 PolarHBondContact O-N 2.81Å; Q127-R130 PolarHBondContact O-N 3.17Å; Q127-L131 WeakPolarHBondContact O-CG 3.41Å; Q127-L131 PolarHBondContact O-N 3.35Å
128	Q	81.2	Confident	75.9	Confident	127 Å²	127	97.9 Å²	97.9	59%	0.593	48%	0.481	S	S	*	.	H	α-helix	trans	-62.4	-43.5	179.4	-73.6	-179	-8	0	0	112.9	P124 Y125 R130 L131 Q132	P124-Q128 PolarHBondContact O-N 3.38Å; Y125-Q128 PolarHBondContact O-N 3.29Å; Q128-R130 VanDerWaalsContact C-N 3.31Å; Q128-R130 PolarHBondContact O-N 3.22Å; Q128-L131 PolarHBondContact O-N 3.23Å; Q128-Q132 PolarHBondContact O-N 3.02Å
129	I	82.4	Confident	74.1	Confident	64 Å²	64	102.3 Å²	102.3	33%	0.328	51%	0.51	S	S	.	.	H	α-helix	trans	-60.5	-41.8	179.3	-71.9	-170	0	0	0	111.3	Y125 S126 Q132 Q133	Y125-I129 HydrophobicContact CD1-CD1 4.17Å; Y125-I129 HydrophobicContact CE1-CD1 3.52Å; Y125-I129 HydrophobicContact CE1-CG1 4.24Å; Y125-I129 PolarHBondContact O-N 2.83Å; Y125-I129 VanDerWaalsContact O-N 3.15Å; S126-I129 PolarHBondContact O-N 3.2Å; I129-Q132 PolarHBondContact O-N 3.45Å; I129-Q133 PolarHBondContact O-N 2.92Å
130	R	80.4	Confident	72.3	Confident	131 Å²	131	105.7 Å²	105.7	49%	0.494	53%	0.532	S	S	.	.	H	α-helix	trans	-65.6	-40.2	177.6	-70.5	-165.1	-48	-131.3	-3	112.5	E122 S126 Q127 Q128 Q132 Q133 Q134	E122-R130 IonicContact OE1-CZ 3.9Å; E122-R130 IonicContact OE1-NE 3.77Å; E122-R130 IonicContact OE1-NH1 2.74Å; E122-R130 PolarHBondContact OE1-NH1 3.19Å; E122-R130 IonicContact OE1-NH2 3.77Å; E122-R130 PolarHBondContact OE1-NH2 3.14Å; E122-R130 IonicContact OE2-CZ 2.86Å; E122-R130 IonicContact OE2-NH1 3.4Å; E122-R130 PolarHBondContact OE2-NH1 3.25Å; E122-R130 IonicContact OE2-NH2 2.8Å; E122-R130 PolarHBondContact OE2-NH2 2.86Å; S126-R130 PolarHBondContact O-N 3.47Å; Q127-R130 PolarHBondContact O-N 3.17Å; Q128-R130 VanDerWaalsContact C-N 3.31Å; Q128-R130 PolarHBondContact O-N 3.22Å; R130-Q132 VanDerWaalsContact C-N 3.28Å; R130-Q132 PolarHBondContact O-N 3.4Å; R130-Q133 PolarHBondContact O-N 3.11Å; R130-Q134 WeakPolarHBondContact O-CG 3.5Å; R130-Q134 PolarHBondContact O-N 3.4Å
131	L	79.8	Confident	70.6	Confident	109 Å²	109	114.3 Å²	114.3	57%	0.571	57%	0.572	S	S	*	*	H	α-helix	trans	-62	-38.3	175.7	-70.1	169.5	0	0	0	111.5	Q127 Q128	Q127-L131 WeakPolarHBondContact O-CG 3.41Å; Q127-L131 PolarHBondContact O-N 3.35Å; Q128-L131 PolarHBondContact O-N 3.23Å
132	Q	81.5	Confident	69.1	Low	151 Å²	151	118.2 Å²	118.2	71%	0.706	59%	0.587	S	S	*	*	H	α-helix	trans	-70.6	-39.1	177.8	-161.2	172	78.7	0	0	112.4	Q128 I129 R130 Q135 A136	Q128-Q132 PolarHBondContact O-N 3.02Å; I129-Q132 PolarHBondContact O-N 3.45Å; R130-Q132 VanDerWaalsContact C-N 3.28Å; R130-Q132 PolarHBondContact O-N 3.4Å; Q132-Q135 PolarHBondContact O-N 3.4Å; Q132-A136 PolarHBondContact O-N 3.19Å
133	Q	76.6	Confident	67.7	Low	123 Å²	123	124 Å²	124	58%	0.575	61%	0.614	S	S	*	*	H	α-helix	trans	-67.7	-34.8	176.2	-76.1	-177.2	39.1	0	0	113.2	I129 R130 Q135 A136	I129-Q133 PolarHBondContact O-N 2.92Å; R130-Q133 PolarHBondContact O-N 3.11Å; Q133-Q135 VanDerWaalsContact C-N 3.29Å; Q133-Q135 PolarHBondContact O-N 3.43Å; Q133-A136 PolarHBondContact O-N 3.45Å
134	Q	70.6	Confident	66.2	Low	138 Å²	138	131 Å²	131	65%	0.645	65%	0.646	S	S	*	*	H	α-helix	trans	-64.6	-32.6	176.8	-77.8	179.3	10.8	0	0	112.7	R130 A136	R130-Q134 WeakPolarHBondContact O-CG 3.5Å; R130-Q134 PolarHBondContact O-N 3.4Å; Q134-A136 VanDerWaalsContact C-N 3.32Å
135	Q	62.7	Low	64.8	Low	156 Å²	156	136.4 Å²	136.4	73%	0.729	67%	0.665	S	S	*	*	H	α-helix	trans	-73.7	-24	176.8	-68.2	-178.8	14.1	0	0	113	Q132 Q133 Q137	Q132-Q135 PolarHBondContact O-N 3.4Å; Q133-Q135 VanDerWaalsContact C-N 3.29Å; Q133-Q135 PolarHBondContact O-N 3.43Å; Q135-Q137 VanDerWaalsContact C-N 3.32Å; Q135-Q137 PolarHBondContact O-N 3.12Å
136	A	60.3	Low	63.2	Low	87 Å²	87	140.4 Å²	140.4	72%	0.719	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-8.3	179.1	0	0	0	0	0	114.1	Q132 Q133 Q134	Q132-A136 PolarHBondContact O-N 3.19Å; Q133-A136 PolarHBondContact O-N 3.45Å; Q134-A136 VanDerWaalsContact C-N 3.32Å
137	Q	55.4	Low	61.4	Low	157 Å²	157	145.2 Å²	145.2	73%	0.734	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	34.8	-179.2	-71.6	-179.6	-7.9	0	0	113.7	Q135	Q135-Q137 VanDerWaalsContact C-N 3.32Å; Q135-Q137 PolarHBondContact O-N 3.12Å
138	Q	52.3	Low	60	Low	166 Å²	166	145 Å²	145	78%	0.776	71%	0.713	S	S	*	*			trans	-60.4	134.7	163.6	-68.6	-149.2	29.2	0	0	110	L140	Q138-L140 PolarHBondContact O-N 3.33Å
139	P	50.4	Low	58.3	Low	105 Å²	105	148.9 Å²	148.9	68%	0.682	72%	0.724	S	S	*	*			trans	-67.5	124.5	-171.6	25.6	-32.1	0	0	0	110.8	Q141	P139-Q141 HydrophobicContact CB-CB 4.42Å; P139-Q141 PolarHBondContact O-N 3.19Å
140	L	47.8	Very low	56.7	Low	161 Å²	161	151.7 Å²	151.7	84%	0.843	74%	0.744	S	S	*	*			trans	-63.4	20.5	168.7	-99.5	152.2	0	0	0	114.1	Q138 Q142	Q138-L140 PolarHBondContact O-N 3.33Å; L140-Q142 PolarHBondContact O-N 3.15Å
141	Q	49	Very low	54.9	Low	181 Å²	181	157.2 Å²	157.2	85%	0.846	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-0.1	-170	-96.3	-178.4	16.1	0	0	116.3	P139	P139-Q141 HydrophobicContact CB-CB 4.42Å; P139-Q141 PolarHBondContact O-N 3.19Å
142	Q	49.1	Very low	53.1	Low	191 Å²	191	165.1 Å²	165.1	89%	0.893	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	-1.6	-178.3	-88.1	-177.1	18.9	0	0	117	L140	L140-Q142 PolarHBondContact O-N 3.15Å
143	Q	49.2	Very low	51.7	Low	161 Å²	161	165.9 Å²	165.9	75%	0.752	80%	0.799	S	S	*	*	S	Bend	trans	-100.1	-4.7	-175.5	-93.1	-178.4	-6.4	0	0	117
144	Q	47.6	Very low	50.4	Low	188 Å²	188	168.1 Å²	168.1	88%	0.879	81%	0.811	S	S	*	*	S	Bend	trans	-92.5	-5	-177	-151.6	152	29.4	0	0	115.6
145	Q	46.9	Very low	49.3	Very low	185 Å²	185	169.8 Å²	169.8	86%	0.864	82%	0.82	S	S	*	*	S	Bend	trans	-93.9	-6.5	178.8	-100.2	175.3	8.4	0	0	115.5
146	R	45.3	Very low	48.5	Very low	234 Å²	234	170.6 Å²	170.6	88%	0.883	83%	0.826	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-5.7	-176.2	-120.4	-169.3	-173.6	-175.9	3.5	116
147	N	43.5	Very low	47.7	Very low	152 Å²	152	175.8 Å²	175.8	81%	0.813	83%	0.833	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	7.3	-173.4	-73.8	-25	0	0	0	115.4
148	A	48.8	Very low	47.2	Very low	78 Å²	78	177.1 Å²	177.1	65%	0.645	84%	0.839	S	S	*	*	S	Bend	trans	-91.9	-4.3	-177.4	0	0	0	0	0	115.5
149	Y	45.4	Very low	46.9	Very low	209 Å²	209	177.9 Å²	177.9	82%	0.82	84%	0.844	S	S	*	*	S	Bend	trans	-129.5	54.7	-174.9	-61.4	-76.9	0	0	0	113.1
150	T	47.7	Very low	46.6	Very low	123 Å²	123	183.5 Å²	183.5	76%	0.755	86%	0.856	S	S	*	*			trans	-154.9	76.1	157	-54.3	0	0	0	0	109
151	R	42	Very low	46.5	Very low	247 Å²	247	185.3 Å²	185.3	93%	0.932	86%	0.857	S	S	*	*			trans	-135.7	121.9	149.9	-74.7	-163.7	177.1	-154.9	-0.5	107.5
152	F	43.2	Very low	46.3	Very low	275 Å²	275	185.7 Å²	185.7	100%	1.206	86%	0.858	S	S	*	*			trans	-56.9	0	171.6	-68.3	-90.7	0	0	0	111.5

Retrieved 152 of 152 residues in 32.1 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).