A0A077ZG07_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZG07, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 187 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.2	Very low	39.5	Very low	245 Å²	245	132.9 Å²	132.9	100%	1.207	78%	0.777	S	S	*	*				0	130.8	0	-72.9	168.6	174.9	0	0	107.7
2	V	37.4	Very low	39.9	Very low	137 Å²	137	137.3 Å²	137.3	83%	0.83	78%	0.779	S	S	*	*			trans	-63	126.2	-163.7	178.2	0	0	0	0	111.8
3	P	37.8	Very low	40.6	Very low	111 Å²	111	132.1 Å²	132.1	72%	0.721	76%	0.757	S	S	*	*			trans	-77.1	126.7	169.9	28.8	-28.9	0	0	0	110.6	V5	P3-V5 PolarHBondContact O-N 3.43Å
4	Q	38.3	Very low	40.7	Very low	182 Å²	182	133.3 Å²	133.3	85%	0.85	75%	0.75	S	S	*	*			trans	-67.1	112.1	170.2	-69.6	-96.9	-34.3	0	0	109.5	N6	Q4-N6 PolarHBondContact O-N 3.28Å
5	V	38.6	Very low	40.8	Very low	142 Å²	142	135.3 Å²	135.3	86%	0.861	74%	0.742	S	S	*	*			trans	-86.1	89.4	167.4	175.3	0	0	0	0	107.7	P3	P3-V5 PolarHBondContact O-N 3.43Å
6	N	35.3	Very low	41.3	Very low	133 Å²	133	136.1 Å²	136.1	71%	0.711	74%	0.739	S	S	*	*			trans	-80.6	133.8	155.8	-120.4	-4.5	0	0	0	107.9	Q4	Q4-N6 PolarHBondContact O-N 3.28Å
7	T	41	Very low	41.7	Very low	116 Å²	116	133.7 Å²	133.7	71%	0.712	73%	0.725	S	S	*	*			trans	145	90.8	139.9	51.2	0	0	0	0	111.7	S9	T7-S9 PolarHBondContact O-N 2.89Å
8	T	40.8	Very low	41.7	Very low	142 Å²	142	136.2 Å²	136.2	87%	0.871	72%	0.722	S	S	*	*				7.8	95.2	124.3	15.6	0	0	0	0	114.9
9	S	38.2	Very low	41.9	Very low	86 Å²	86	136.7 Å²	136.7	60%	0.601	72%	0.717	S	S	*	*			trans	-123.2	113.9	160.7	-176.7	0	0	0	0	109.1	T7 A11	T7-S9 PolarHBondContact O-N 2.89Å; S9-A11 PolarHBondContact O-N 3.44Å
10	P	48.9	Very low	42.4	Very low	116 Å²	116	134.1 Å²	134.1	75%	0.753	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	1.6	-177.8	26.3	-32.8	0	0	0	114.1	K12 S13	P10-K12 PolarHBondContact O-N 2.76Å; P10-S13 PolarHBondContact O-N 3.49Å
11	A	43.5	Very low	42.6	Very low	52 Å²	52	133.1 Å²	133.1	43%	0.43	70%	0.702	S	S	.	*	H	α-helix	trans	-63.3	-26.5	175.6	0	0	0	0	0	113.3	S9 S13 F14 Y15	S9-A11 PolarHBondContact O-N 3.44Å; A11-S13 VanDerWaalsContact C-N 3.3Å; A11-S13 PolarHBondContact O-N 3.39Å; A11-F14 PolarHBondContact O-N 3.29Å; A11-Y15 VanDerWaalsContact O-CD2 3.26Å; A11-Y15 WeakPolarHBondContact O-CD2 3.44Å
12	K	44.1	Very low	43.4	Very low	185 Å²	185	126.3 Å²	126.3	80%	0.804	67%	0.674	S	S	*	*	H	α-helix	trans	-67.2	-24.9	-179.2	-86.8	-175.7	176.8	178.9	0	114.4	P10	P10-K12 PolarHBondContact O-N 2.76Å
13	S	48.5	Very low	43.9	Very low	70 Å²	70	126.6 Å²	126.6	49%	0.49	67%	0.667	S	S	.	*	H	α-helix	trans	-76	-33.9	-179.2	-175.8	0	0	0	0	112.4	P10 A11 Q16 I17	P10-S13 PolarHBondContact O-N 3.49Å; A11-S13 VanDerWaalsContact C-N 3.3Å; A11-S13 PolarHBondContact O-N 3.39Å; S13-Q16 PolarHBondContact O-N 3.11Å; S13-I17 PolarHBondContact O-N 3.07Å
14	F	42.7	Very low	44.6	Very low	149 Å²	149	127.4 Å²	127.4	65%	0.654	66%	0.661	S	S	*	*	H	α-helix	trans	-73.1	-33.5	-176.9	-124.3	-88.6	0	0	0	113.4	A11 R18	A11-F14 PolarHBondContact O-N 3.29Å; F14-R18 PolarHBondContact O-N 3.39Å
15	Y	41.9	Very low	45.1	Very low	163 Å²	163	120.8 Å²	120.8	64%	0.639	64%	0.641	S	S	*	*	H	α-helix	trans	-69.5	-38.2	173.5	-71	-79.1	0	0	0	111.4	A11 I17 R18 F19	A11-Y15 VanDerWaalsContact O-CD2 3.26Å; A11-Y15 WeakPolarHBondContact O-CD2 3.44Å; Y15-I17 VanDerWaalsContact C-N 3.32Å; Y15-I17 PolarHBondContact O-N 2.9Å; Y15-R18 PolarHBondContact O-N 3.3Å; Y15-F19 WeakPolarHBondContact O-CD2 2.97Å; Y15-F19 PolarHBondContact O-N 3.47Å
16	Q	48.6	Very low	45.8	Very low	149 Å²	149	117.1 Å²	117.1	70%	0.696	63%	0.626	S	S	*	*	H	α-helix	trans	-65	-36.1	-177.5	-142.8	-174	21	0	0	112.4	S13 F19 T20	S13-Q16 PolarHBondContact O-N 3.11Å; Q16-F19 PolarHBondContact O-N 2.89Å; Q16-T20 PolarHBondContact O-N 3.13Å; Q16-T20 PolarHBondContact O-OG1 3.31Å; Q16-T20 VanDerWaalsContact O-OG1 3.07Å
17	I	48.2	Very low	46.6	Very low	95 Å²	95	115 Å²	115	49%	0.487	61%	0.614	S	S	.	*	H	α-helix	trans	-72.7	-33.1	178.4	-62.4	165.2	0	0	0	111.9	S13 Y15 T20 L21	S13-I17 PolarHBondContact O-N 3.07Å; Y15-I17 VanDerWaalsContact C-N 3.32Å; Y15-I17 PolarHBondContact O-N 2.9Å; I17-T20 PolarHBondContact O-OG1 3.3Å; I17-L21 HydrophobicContact CG2-CD1 4.37Å; I17-L21 PolarHBondContact O-N 3.47Å
18	R	42.5	Very low	47	Very low	178 Å²	178	115.8 Å²	115.8	67%	0.672	61%	0.611	S	S	*	*	H	α-helix	trans	-70	-33.7	175.2	-79.2	-164.7	-174.2	-147.9	3.3	112.6	F14 Y15 V22	F14-R18 PolarHBondContact O-N 3.39Å; Y15-R18 PolarHBondContact O-N 3.3Å; R18-V22 WeakPolarHBondContact O-CB 3.46Å; R18-V22 VanDerWaalsContact O-CG2 3.3Å; R18-V22 WeakPolarHBondContact O-CG2 3.19Å; R18-V22 PolarHBondContact O-N 3.48Å
19	F	45.1	Very low	47.7	Very low	146 Å²	146	117.1 Å²	117.1	64%	0.64	61%	0.607	S	S	*	*	H	α-helix	trans	-67.3	-38.6	176.7	-83.6	-75.3	0	0	0	112.2	Y15 Q16 Q23	Y15-F19 WeakPolarHBondContact O-CD2 2.97Å; Y15-F19 PolarHBondContact O-N 3.47Å; Q16-F19 PolarHBondContact O-N 2.89Å; F19-Q23 WeakPolarHBondContact O-CB 3.45Å; F19-Q23 PolarHBondContact O-N 2.99Å
20	T	51.2	Low	48.3	Very low	85 Å²	85	115.1 Å²	115.1	52%	0.521	60%	0.596	S	S	.	*	H	α-helix	trans	-65.6	-43.4	176.2	16.9	0	0	0	0	112.6	Q16 I17 Q23 E24	Q16-T20 PolarHBondContact O-N 3.13Å; Q16-T20 PolarHBondContact O-OG1 3.31Å; Q16-T20 VanDerWaalsContact O-OG1 3.07Å; I17-T20 PolarHBondContact O-OG1 3.3Å; T20-Q23 PolarHBondContact O-N 3.17Å; T20-E24 WeakPolarHBondContact O-CG 3.35Å; T20-E24 PolarHBondContact O-N 3.35Å
21	L	47.2	Very low	48.4	Very low	113 Å²	113	113.2 Å²	113.2	59%	0.592	58%	0.576	S	S	*	*	H	α-helix	trans	-72.6	-35.6	-179.5	-89.3	158.3	0	0	0	113.6	I17 Q23 E24 G25	I17-L21 HydrophobicContact CG2-CD1 4.37Å; I17-L21 PolarHBondContact O-N 3.47Å; L21-Q23 VanDerWaalsContact C-N 3.3Å; L21-E24 PolarHBondContact O-N 3.38Å; L21-G25 PolarHBondContact O-N 3.36Å
22	V	50.9	Low	49	Very low	103 Å²	103	119.2 Å²	119.2	62%	0.624	60%	0.595	S	S	*	*	H	α-helix	trans	-69.4	-32.9	174.3	172.5	0	0	0	0	110.9	R18 A26	R18-V22 WeakPolarHBondContact O-CB 3.46Å; R18-V22 VanDerWaalsContact O-CG2 3.3Å; R18-V22 WeakPolarHBondContact O-CG2 3.19Å; R18-V22 PolarHBondContact O-N 3.48Å; V22-A26 WeakPolarHBondContact O-CB 3.31Å; V22-A26 PolarHBondContact O-N 2.7Å; V22-A26 VanDerWaalsContact O-N 3.13Å
23	Q	48.6	Very low	49.7	Very low	143 Å²	143	117.1 Å²	117.1	67%	0.668	59%	0.589	S	S	*	*	H	α-helix	trans	-72.4	-29.9	176.1	-164.7	161.9	-0	0	0	112.5	F19 T20 L21 L27	F19-Q23 WeakPolarHBondContact O-CB 3.45Å; F19-Q23 PolarHBondContact O-N 2.99Å; T20-Q23 PolarHBondContact O-N 3.17Å; L21-Q23 VanDerWaalsContact C-N 3.3Å; Q23-L27 WeakPolarHBondContact O-CB 3.3Å; Q23-L27 PolarHBondContact O-N 2.82Å
24	E	52.2	Low	50	Low	128 Å²	128	116.3 Å²	116.3	60%	0.598	59%	0.591	S	S	*	*	H	α-helix	trans	-77.3	-40.5	172.8	-72.2	-174	151.7	0	0	112.8	T20 L21 L27 M28	T20-E24 WeakPolarHBondContact O-CG 3.35Å; T20-E24 PolarHBondContact O-N 3.35Å; L21-E24 PolarHBondContact O-N 3.38Å; E24-L27 PolarHBondContact O-N 3.1Å; E24-M28 WeakPolarHBondContact O-CG 3.39Å; E24-M28 PolarHBondContact O-N 2.86Å; E24-M28 VanDerWaalsContact O-N 3.17Å
25	G	49.8	Very low	50.7	Low	43 Å²	43	119.7 Å²	119.7	44%	0.443	60%	0.6	S	S	.	*	H	α-helix	trans	-65.8	-44	179.4	0	0	0	0	0	113.4	L21 L27 M28 E29	L21-G25 PolarHBondContact O-N 3.36Å; G25-L27 VanDerWaalsContact C-N 3.31Å; G25-L27 PolarHBondContact O-N 3.39Å; G25-M28 PolarHBondContact O-N 2.9Å; G25-E29 PolarHBondContact O-N 3.04Å
26	A	52.2	Low	51.6	Low	64 Å²	64	115.3 Å²	115.3	53%	0.529	59%	0.59	S	S	.	*	H	α-helix	trans	-72.2	-25.7	177.5	0	0	0	0	0	112.6	V22	V22-A26 WeakPolarHBondContact O-CB 3.31Å; V22-A26 PolarHBondContact O-N 2.7Å; V22-A26 VanDerWaalsContact O-N 3.13Å
27	L	52	Low	52.2	Low	89 Å²	89	114.5 Å²	114.5	47%	0.466	58%	0.58	S	S	.	*	H	α-helix	trans	-67.1	-43.3	173	-147.9	82.7	0	0	0	109.8	Q23 E24 G25 E29 A30 F31	Q23-L27 WeakPolarHBondContact O-CB 3.3Å; Q23-L27 PolarHBondContact O-N 2.82Å; E24-L27 PolarHBondContact O-N 3.1Å; G25-L27 VanDerWaalsContact C-N 3.31Å; G25-L27 PolarHBondContact O-N 3.39Å; L27-E29 PolarHBondContact O-N 3.39Å; L27-A30 WeakPolarHBondContact O-CB 3.45Å; L27-A30 PolarHBondContact O-N 3.04Å; L27-A30 VanDerWaalsContact O-N 3.11Å; L27-F31 HydrophobicContact CB-CE2 4.3Å; L27-F31 HydrophobicContact CD2-CE2 3.99Å; L27-F31 HydrophobicContact CD2-CZ 4.24Å; L27-F31 HydrophobicContact CG-CE2 4Å; L27-F31 WeakPolarHBondContact O-CD2 3.32Å; L27-F31 VanDerWaalsContact O-CE2 3.3Å; L27-F31 WeakPolarHBondContact O-CE2 3.39Å
28	M	50.3	Low	53.1	Low	132 Å²	132	114.9 Å²	114.9	65%	0.65	59%	0.587	S	S	*	*	H	α-helix	trans	-64.2	-35.7	-174.8	-70.4	-66.2	-93.1	0	0	113.9	E24 G25 A30 F31	E24-M28 WeakPolarHBondContact O-CG 3.39Å; E24-M28 PolarHBondContact O-N 2.86Å; E24-M28 VanDerWaalsContact O-N 3.17Å; G25-M28 PolarHBondContact O-N 2.9Å; M28-A30 VanDerWaalsContact C-N 3.32Å; M28-A30 PolarHBondContact O-N 3.37Å; M28-F31 VanDerWaalsContact CA-CD2 3.46Å; M28-F31 WeakPolarHBondContact O-CB 3.2Å; M28-F31 PolarHBondContact O-N 3.04Å; M28-F31 HydrophobicContact SD-CD2 3.96Å; M28-F31 HydrophobicContact SD-CE2 3.74Å; M28-F31 HydrophobicContact SD-CZ 4.31Å
29	E	54.4	Low	54.3	Low	170 Å²	170	109.4 Å²	109.4	79%	0.794	58%	0.58	S	S	*	*	H	α-helix	trans	-72.3	-24.1	174.6	-74.8	-171.7	128.4	0	0	113.2	G25 L27 F31	G25-E29 PolarHBondContact O-N 3.04Å; L27-E29 PolarHBondContact O-N 3.39Å; E29-F31 VanDerWaalsContact C-N 3.25Å; E29-F31 PolarHBondContact O-N 2.86Å
30	A	51	Low	55.4	Low	45 Å²	45	108.6 Å²	108.6	37%	0.372	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-76.2	-8.5	174	0	0	0	0	0	113.6	L27 M28 Q32	L27-A30 WeakPolarHBondContact O-CB 3.45Å; L27-A30 PolarHBondContact O-N 3.04Å; L27-A30 VanDerWaalsContact O-N 3.11Å; M28-A30 VanDerWaalsContact C-N 3.32Å; M28-A30 PolarHBondContact O-N 3.37Å; A30-Q32 PolarHBondContact O-N 2.87Å
31	F	52	Low	56.2	Low	75 Å²	75	108 Å²	108	33%	0.329	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-70.4	-13.5	179.4	-81.7	-100.9	0	0	0	114.2	L27 M28 E29 Q33 W37	L27-F31 HydrophobicContact CB-CE2 4.3Å; L27-F31 HydrophobicContact CD2-CE2 3.99Å; L27-F31 HydrophobicContact CD2-CZ 4.24Å; L27-F31 HydrophobicContact CG-CE2 4Å; L27-F31 WeakPolarHBondContact O-CD2 3.32Å; L27-F31 VanDerWaalsContact O-CE2 3.3Å; L27-F31 WeakPolarHBondContact O-CE2 3.39Å; M28-F31 VanDerWaalsContact CA-CD2 3.46Å; M28-F31 WeakPolarHBondContact O-CB 3.2Å; M28-F31 PolarHBondContact O-N 3.04Å; M28-F31 HydrophobicContact SD-CD2 3.96Å; M28-F31 HydrophobicContact SD-CE2 3.74Å; M28-F31 HydrophobicContact SD-CZ 4.31Å; E29-F31 VanDerWaalsContact C-N 3.25Å; E29-F31 PolarHBondContact O-N 2.86Å; F31-Q33 VanDerWaalsContact C-N 3.31Å; F31-Q33 PolarHBondContact O-N 3.36Å; F31-W37 AromaticContact CD1-CE2 3.66Å; F31-W37 AromaticContact CD1-CZ2 3.61Å; F31-W37 HydrophobicContact CD1-CZ2 3.61Å; F31-W37 AromaticContact CD1-NE1 3.49Å; F31-W37 HydrophobicContact CE1-CH2 4.48Å; F31-W37 AromaticContact CE1-CZ2 3.82Å; F31-W37 HydrophobicContact CE1-CZ2 3.82Å
32	Q	55.5	Low	57.3	Low	178 Å²	178	111.5 Å²	111.5	83%	0.832	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-75.6	-13.3	-178.5	-94.3	-86	-32.1	0	0	114.2	A30	A30-Q32 PolarHBondContact O-N 2.87Å
33	Q	57.9	Low	58.1	Low	142 Å²	142	115.6 Å²	115.6	66%	0.664	58%	0.579	S	S	*	*	S	Bend	trans	-106.6	99.1	176.4	-69	-179.4	7.8	0	0	109.8	F31 R35 V36	F31-Q33 VanDerWaalsContact C-N 3.31Å; F31-Q33 PolarHBondContact O-N 3.36Å; Q33-R35 PolarHBondContact O-N 3.01Å; Q33-V36 PolarHBondContact O-N 3.4Å
34	G	55.2	Low	59.1	Low	53 Å²	53	111 Å²	111	55%	0.546	56%	0.561	S	S	.	*	H	α-helix	trans	-52.1	-8	-176.9	0	0	0	0	0	117
35	R	57.3	Low	60.1	Low	220 Å²	220	108.6 Å²	108.6	83%	0.83	56%	0.555	S	S	*	*	H	α-helix	trans	-72.3	-30	169.4	-69.4	-165.9	-88.2	-161.7	-4.7	113.3	Q33 W37	Q33-R35 PolarHBondContact O-N 3.01Å; R35-W37 VanDerWaalsContact C-N 3.32Å
36	V	61.3	Low	61.2	Low	71 Å²	71	109.5 Å²	109.5	43%	0.43	55%	0.552	S	S	.	*	H	α-helix	trans	-68.5	-34.5	177.3	-175.4	0	0	0	0	110.7	Q33 V38 A39 Y40	Q33-V36 PolarHBondContact O-N 3.4Å; V36-V38 PolarHBondContact O-N 3.05Å; V36-A39 PolarHBondContact O-N 3.44Å; V36-Y40 WeakPolarHBondContact O-CB 3.19Å; V36-Y40 PolarHBondContact O-N 2.87Å
37	W	61.2	Low	61.9	Low	131 Å²	131	107.9 Å²	107.9	50%	0.496	54%	0.539	S	S	.	.	H	α-helix	trans	-59.1	-47.2	177.3	-89.4	88	0	0	0	113.2	F31 R35 A39 Y40 V41	F31-W37 AromaticContact CD1-CE2 3.66Å; F31-W37 AromaticContact CD1-CZ2 3.61Å; F31-W37 HydrophobicContact CD1-CZ2 3.61Å; F31-W37 AromaticContact CD1-NE1 3.49Å; F31-W37 HydrophobicContact CE1-CH2 4.48Å; F31-W37 AromaticContact CE1-CZ2 3.82Å; F31-W37 HydrophobicContact CE1-CZ2 3.82Å; R35-W37 VanDerWaalsContact C-N 3.32Å; W37-A39 VanDerWaalsContact C-N 3.29Å; W37-A39 PolarHBondContact O-N 3Å; W37-Y40 PolarHBondContact O-N 2.74Å; W37-V41 HydrophobicContact CE3-CG2 4.23Å; W37-V41 WeakPolarHBondContact O-CB 3.34Å; W37-V41 VanDerWaalsContact O-CG2 3.31Å; W37-V41 WeakPolarHBondContact O-CG2 3.4Å; W37-V41 PolarHBondContact O-N 3.29Å
38	V	67.7	Low	62.8	Low	104 Å²	104	109.3 Å²	109.3	63%	0.63	54%	0.543	S	S	*	.	H	α-helix	trans	-63.5	-39.8	-179.1	-177.6	0	0	0	0	110.6	V36 R42	V36-V38 PolarHBondContact O-N 3.05Å; V38-R42 WeakPolarHBondContact O-CB 3.3Å; V38-R42 PolarHBondContact O-N 3.26Å; V38-R42 VanDerWaalsContact O-N 3.07Å
39	A	66.8	Low	64	Low	63 Å²	63	108.2 Å²	108.2	52%	0.521	54%	0.54	S	S	.	.	H	α-helix	trans	-67.7	-44.2	176.7	0	0	0	0	0	112.1	V36 W37 R42 W43	V36-A39 PolarHBondContact O-N 3.44Å; W37-A39 VanDerWaalsContact C-N 3.29Å; W37-A39 PolarHBondContact O-N 3Å; A39-R42 PolarHBondContact O-N 3.47Å; A39-W43 WeakPolarHBondContact O-CB 3.5Å; A39-W43 PolarHBondContact O-N 3.37Å
40	Y	67.9	Low	65.1	Low	128 Å²	128	107.6 Å²	107.6	50%	0.502	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-48.2	179.3	-175.6	-98.6	0	0	0	112.1	V36 W37 R42 W43 V44	V36-Y40 WeakPolarHBondContact O-CB 3.19Å; V36-Y40 PolarHBondContact O-N 2.87Å; W37-Y40 PolarHBondContact O-N 2.74Å; Y40-R42 VanDerWaalsContact C-N 3.29Å; Y40-R42 PolarHBondContact O-N 2.9Å; Y40-W43 PolarHBondContact O-N 3.31Å; Y40-W43 VanDerWaalsContact O-N 3.1Å; Y40-V44 HydrophobicContact CD1-CG2 3.98Å; Y40-V44 HydrophobicContact CD2-CG2 4.45Å; Y40-V44 HydrophobicContact CE1-CG2 3.58Å; Y40-V44 HydrophobicContact CE2-CG2 4.1Å; Y40-V44 HydrophobicContact CG-CG2 4.4Å; Y40-V44 WeakPolarHBondContact O-CG2 3.32Å; Y40-V44 PolarHBondContact O-N 3.19Å
41	V	68.9	Low	66.3	Low	74 Å²	74	110.4 Å²	110.4	45%	0.448	54%	0.542	S	S	.	.	H	α-helix	trans	-61	-40.1	176.8	174.3	0	0	0	0	110.7	W37 T45	W37-V41 HydrophobicContact CE3-CG2 4.23Å; W37-V41 WeakPolarHBondContact O-CB 3.34Å; W37-V41 VanDerWaalsContact O-CG2 3.31Å; W37-V41 WeakPolarHBondContact O-CG2 3.4Å; W37-V41 PolarHBondContact O-N 3.29Å; V41-T45 HydrophobicContact CG1-CG2 4.3Å; V41-T45 VanDerWaalsContact O-CB 3.32Å; V41-T45 WeakPolarHBondContact O-CB 3.28Å; V41-T45 WeakPolarHBondContact O-CG2 3.44Å; V41-T45 PolarHBondContact O-N 3.07Å; V41-T45 PolarHBondContact O-OG1 3.4Å
42	R	70.9	Confident	67.5	Low	185 Å²	185	114 Å²	114	70%	0.698	55%	0.554	S	S	*	*	H	α-helix	trans	-65.5	-37.9	174.6	-168.7	172.9	-172.5	159.6	2.1	112.5	V38 A39 Y40 T45 T46	V38-R42 WeakPolarHBondContact O-CB 3.3Å; V38-R42 PolarHBondContact O-N 3.26Å; V38-R42 VanDerWaalsContact O-N 3.07Å; A39-R42 PolarHBondContact O-N 3.47Å; Y40-R42 VanDerWaalsContact C-N 3.29Å; Y40-R42 PolarHBondContact O-N 2.9Å; R42-T45 WeakPolarHBondContact CA-OG1 3.16Å; R42-T45 PolarHBondContact O-OG1 3.49Å; R42-T45 VanDerWaalsContact O-OG1 3.04Å; R42-T46 WeakPolarHBondContact O-CB 3.25Å; R42-T46 VanDerWaalsContact O-CG2 3.25Å; R42-T46 WeakPolarHBondContact O-CG2 3.37Å; R42-T46 PolarHBondContact O-N 2.99Å; R42-T46 PolarHBondContact O-OG1 3.33Å
43	W	68.1	Low	68.7	Low	189 Å²	189	108.7 Å²	108.7	72%	0.716	53%	0.534	S	S	*	.	H	α-helix	trans	-70.6	-44.9	177.4	-157	83.8	0	0	0	112	A39 Y40 T46 A47	A39-W43 WeakPolarHBondContact O-CB 3.5Å; A39-W43 PolarHBondContact O-N 3.37Å; Y40-W43 PolarHBondContact O-N 3.31Å; Y40-W43 VanDerWaalsContact O-N 3.1Å; W43-T46 WeakPolarHBondContact CA-OG1 3.36Å; W43-T46 PolarHBondContact O-N 3.02Å; W43-T46 PolarHBondContact O-OG1 3.26Å; W43-A47 VanDerWaalsContact O-CB 3.28Å; W43-A47 WeakPolarHBondContact O-CB 3.18Å; W43-A47 PolarHBondContact O-N 3.37Å
44	V	69.8	Low	69.6	Low	48 Å²	48	104.7 Å²	104.7	29%	0.291	53%	0.525	S	S	.	.	H	α-helix	trans	-62.5	-46.2	175.9	173.8	0	0	0	0	110.8	Y40 A47 Q48	Y40-V44 HydrophobicContact CD1-CG2 3.98Å; Y40-V44 HydrophobicContact CD2-CG2 4.45Å; Y40-V44 HydrophobicContact CE1-CG2 3.58Å; Y40-V44 HydrophobicContact CE2-CG2 4.1Å; Y40-V44 HydrophobicContact CG-CG2 4.4Å; Y40-V44 WeakPolarHBondContact O-CG2 3.32Å; Y40-V44 PolarHBondContact O-N 3.19Å; V44-A47 PolarHBondContact O-N 3.46Å; V44-Q48 HydrophobicContact CG1-CG 4.16Å; V44-Q48 WeakPolarHBondContact O-CB 3.43Å; V44-Q48 WeakPolarHBondContact O-CG 3.34Å; V44-Q48 PolarHBondContact O-N 2.86Å
45	T	73.3	Confident	70.9	Confident	77 Å²	77	109.9 Å²	109.9	47%	0.472	53%	0.532	S	S	.	.	H	α-helix	trans	-65	-41.1	178.4	51.3	0	0	0	0	112.1	V41 R42 L49	V41-T45 HydrophobicContact CG1-CG2 4.3Å; V41-T45 VanDerWaalsContact O-CB 3.32Å; V41-T45 WeakPolarHBondContact O-CB 3.28Å; V41-T45 WeakPolarHBondContact O-CG2 3.44Å; V41-T45 PolarHBondContact O-N 3.07Å; V41-T45 PolarHBondContact O-OG1 3.4Å; R42-T45 WeakPolarHBondContact CA-OG1 3.16Å; R42-T45 PolarHBondContact O-OG1 3.49Å; R42-T45 VanDerWaalsContact O-OG1 3.04Å; T45-L49 WeakPolarHBondContact O-CB 3.21Å; T45-L49 PolarHBondContact O-N 3.39Å
46	T	71.3	Confident	72.2	Confident	61 Å²	61	105.7 Å²	105.7	37%	0.374	52%	0.52	S	S	.	.	H	α-helix	trans	-68.2	-37.1	175.6	50.5	0	0	0	0	112.8	R42 W43 K50	R42-T46 WeakPolarHBondContact O-CB 3.25Å; R42-T46 VanDerWaalsContact O-CG2 3.25Å; R42-T46 WeakPolarHBondContact O-CG2 3.37Å; R42-T46 PolarHBondContact O-N 2.99Å; R42-T46 PolarHBondContact O-OG1 3.33Å; W43-T46 WeakPolarHBondContact CA-OG1 3.36Å; W43-T46 PolarHBondContact O-N 3.02Å; W43-T46 PolarHBondContact O-OG1 3.26Å; T46-K50 WeakPolarHBondContact O-CB 3.47Å; T46-K50 VanDerWaalsContact O-CG 3.28Å; T46-K50 WeakPolarHBondContact O-CG 3.22Å; T46-K50 PolarHBondContact O-N 3.43Å
47	A	67	Low	73.2	Confident	31 Å²	31	108 Å²	108	26%	0.256	53%	0.528	S	S	.	.	H	α-helix	trans	-66.8	-47.5	174.8	0	0	0	0	0	111.7	W43 V44 L49 K50 I51	W43-A47 VanDerWaalsContact O-CB 3.28Å; W43-A47 WeakPolarHBondContact O-CB 3.18Å; W43-A47 PolarHBondContact O-N 3.37Å; V44-A47 PolarHBondContact O-N 3.46Å; A47-L49 VanDerWaalsContact C-N 3.34Å; A47-L49 PolarHBondContact O-N 3.35Å; A47-K50 PolarHBondContact O-N 3.18Å; A47-I51 WeakPolarHBondContact O-CG1 3.38Å; A47-I51 PolarHBondContact O-N 2.89Å
48	Q	71.6	Confident	74.2	Confident	119 Å²	119	104.2 Å²	104.2	56%	0.556	53%	0.525	S	S	*	.	H	α-helix	trans	-62.4	-41.2	176.7	-69.4	-66.5	-14.8	0	0	111.6	V44 I51 Y52	V44-Q48 HydrophobicContact CG1-CG 4.16Å; V44-Q48 WeakPolarHBondContact O-CB 3.43Å; V44-Q48 WeakPolarHBondContact O-CG 3.34Å; V44-Q48 PolarHBondContact O-N 2.86Å; Q48-I51 PolarHBondContact O-N 3.41Å; Q48-Y52 WeakPolarHBondContact O-CB 3.42Å; Q48-Y52 PolarHBondContact O-N 2.9Å
49	L	74.9	Confident	75	Confident	109 Å²	109	105.2 Å²	105.2	57%	0.571	52%	0.522	S	S	*	.	H	α-helix	trans	-63.5	-42.1	176	-171.8	68	0	0	0	111.6	T45 A47 I51 Y52 V53	T45-L49 WeakPolarHBondContact O-CB 3.21Å; T45-L49 PolarHBondContact O-N 3.39Å; A47-L49 VanDerWaalsContact C-N 3.34Å; A47-L49 PolarHBondContact O-N 3.35Å; L49-I51 PolarHBondContact O-N 2.83Å; L49-Y52 PolarHBondContact O-N 3Å; L49-V53 HydrophobicContact CD1-CG2 4.38Å; L49-V53 HydrophobicContact CG-CG2 4.33Å; L49-V53 WeakPolarHBondContact O-CB 3.36Å; L49-V53 WeakPolarHBondContact O-CG2 3.28Å; L49-V53 PolarHBondContact O-N 3.47Å
50	K	77.7	Confident	75.8	Confident	156 Å²	156	107.6 Å²	107.6	68%	0.678	53%	0.525	S	S	*	.	H	α-helix	trans	-61	-43.4	174.9	-77.1	176.6	-176.7	-175	0	112	T46 A47 A54	T46-K50 WeakPolarHBondContact O-CB 3.47Å; T46-K50 VanDerWaalsContact O-CG 3.28Å; T46-K50 WeakPolarHBondContact O-CG 3.22Å; T46-K50 PolarHBondContact O-N 3.43Å; A47-K50 PolarHBondContact O-N 3.18Å; K50-A54 WeakPolarHBondContact O-CB 3.49Å; K50-A54 PolarHBondContact O-N 3.47Å
51	I	75.8	Confident	76.6	Confident	104 Å²	104	106.2 Å²	106.2	53%	0.533	53%	0.526	S	S	.	.	H	α-helix	trans	-64.5	-45	177.9	-65.8	164.7	0	0	0	110.5	A47 Q48 L49 A54 K55	A47-I51 WeakPolarHBondContact O-CG1 3.38Å; A47-I51 PolarHBondContact O-N 2.89Å; Q48-I51 PolarHBondContact O-N 3.41Å; L49-I51 PolarHBondContact O-N 2.83Å; I51-A54 PolarHBondContact O-N 2.95Å; I51-K55 WeakPolarHBondContact O-CB 3.33Å; I51-K55 PolarHBondContact O-N 3.31Å
52	Y	77.4	Confident	77.4	Confident	151 Å²	151	106.1 Å²	106.1	59%	0.592	53%	0.526	S	S	*	.	H	α-helix	trans	-63.4	-46.3	178.3	-179.6	-101.9	0	0	0	112.1	Q48 L49 K55 K56	Q48-Y52 WeakPolarHBondContact O-CB 3.42Å; Q48-Y52 PolarHBondContact O-N 2.9Å; L49-Y52 PolarHBondContact O-N 3Å; Y52-K55 PolarHBondContact O-N 2.86Å; Y52-K56 HydrophobicContact CE1-CD 4.42Å; Y52-K56 WeakPolarHBondContact O-CB 3.2Å; Y52-K56 PolarHBondContact O-N 3.29Å
53	V	80.1	Confident	77.9	Confident	67 Å²	67	101.2 Å²	101.2	41%	0.406	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-44.2	176.6	171.9	0	0	0	0	110.6	L49 K55 K56 M57	L49-V53 HydrophobicContact CD1-CG2 4.38Å; L49-V53 HydrophobicContact CG-CG2 4.33Å; L49-V53 WeakPolarHBondContact O-CB 3.36Å; L49-V53 WeakPolarHBondContact O-CG2 3.28Å; L49-V53 PolarHBondContact O-N 3.47Å; V53-K55 PolarHBondContact O-N 2.86Å; V53-K56 PolarHBondContact O-N 3.32Å; V53-M57 HydrophobicContact CG1-CE 4.46Å; V53-M57 HydrophobicContact CG1-CG 4.31Å; V53-M57 WeakPolarHBondContact O-CB 3.43Å; V53-M57 WeakPolarHBondContact O-CG 3.4Å; V53-M57 PolarHBondContact O-N 2.98Å
54	A	77.9	Confident	78.7	Confident	57 Å²	57	96 Å²	96	47%	0.471	50%	0.502	S	S	.	.	H	α-helix	trans	-61.6	-43.6	176.9	0	0	0	0	0	112	K50 I51 M57 A58	K50-A54 WeakPolarHBondContact O-CB 3.49Å; K50-A54 PolarHBondContact O-N 3.47Å; I51-A54 PolarHBondContact O-N 2.95Å; A54-M57 PolarHBondContact O-N 2.95Å; A54-A58 WeakPolarHBondContact O-CB 3.37Å; A54-A58 PolarHBondContact O-N 3.35Å
55	K	82.4	Confident	79.1	Confident	162 Å²	162	100.1 Å²	100.1	70%	0.704	52%	0.516	S	S	*	.	H	α-helix	trans	-65	-40.7	177.1	-168.4	173.5	-176.2	178.7	0	111.8	I51 Y52 V53 A58 H59	I51-K55 WeakPolarHBondContact O-CB 3.33Å; I51-K55 PolarHBondContact O-N 3.31Å; Y52-K55 PolarHBondContact O-N 2.86Å; V53-K55 PolarHBondContact O-N 2.86Å; K55-A58 PolarHBondContact O-N 3.46Å; K55-H59 WeakPolarHBondContact O-CB 3.43Å; K55-H59 PolarHBondContact O-N 3.43Å
56	K	85	Confident	79.2	Confident	133 Å²	133	103.9 Å²	103.9	58%	0.578	52%	0.523	S	S	*	.	H	α-helix	trans	-67.4	-40.6	176.7	-165.4	173.6	-176.6	-178.7	0	111.7	Y52 V53 H59 L60	Y52-K56 HydrophobicContact CE1-CD 4.42Å; Y52-K56 WeakPolarHBondContact O-CB 3.2Å; Y52-K56 PolarHBondContact O-N 3.29Å; V53-K56 PolarHBondContact O-N 3.32Å; K56-H59 PolarHBondContact O-N 3.04Å; K56-L60 WeakPolarHBondContact O-CB 3.26Å; K56-L60 PolarHBondContact O-N 3.45Å
57	M	82.3	Confident	79.2	Confident	119 Å²	119	105.9 Å²	105.9	59%	0.586	53%	0.531	S	S	*	.	H	α-helix	trans	-66.4	-40.6	174.8	-71.8	-140.6	-71.9	0	0	112.2	V53 A54 L60 L61	V53-M57 HydrophobicContact CG1-CE 4.46Å; V53-M57 HydrophobicContact CG1-CG 4.31Å; V53-M57 WeakPolarHBondContact O-CB 3.43Å; V53-M57 WeakPolarHBondContact O-CG 3.4Å; V53-M57 PolarHBondContact O-N 2.98Å; A54-M57 PolarHBondContact O-N 2.95Å; M57-L60 PolarHBondContact O-N 3.02Å; M57-L61 WeakPolarHBondContact O-CB 3.4Å; M57-L61 WeakPolarHBondContact O-CG 3.37Å; M57-L61 PolarHBondContact O-N 3.32Å
58	A	82.5	Confident	79.5	Confident	52 Å²	52	108.8 Å²	108.8	43%	0.43	55%	0.546	S	S	.	.	H	α-helix	trans	-60.3	-46.4	174.2	0	0	0	0	0	111.3	A54 K55 L60 L61 T62	A54-A58 WeakPolarHBondContact O-CB 3.37Å; A54-A58 PolarHBondContact O-N 3.35Å; K55-A58 PolarHBondContact O-N 3.46Å; A58-L60 VanDerWaalsContact C-N 3.34Å; A58-L60 PolarHBondContact O-N 3.34Å; A58-L61 PolarHBondContact O-N 3.44Å; A58-T62 PolarHBondContact O-N 2.9Å; A58-T62 PolarHBondContact O-OG1 2.95Å
59	H	84.5	Confident	79.3	Confident	124 Å²	124	107.9 Å²	107.9	57%	0.574	54%	0.544	S	S	*	.	H	α-helix	trans	-63.2	-39.5	177.1	-164.7	-85	0	0	0	112.5	K55 K56 T62 L63	K55-H59 WeakPolarHBondContact O-CB 3.43Å; K55-H59 PolarHBondContact O-N 3.43Å; K56-H59 PolarHBondContact O-N 3.04Å; H59-T62 PolarHBondContact O-N 3.29Å; H59-L63 WeakPolarHBondContact O-CG 3.46Å; H59-L63 PolarHBondContact O-N 3.3Å
60	L	82.3	Confident	78.8	Confident	114 Å²	114	107.5 Å²	107.5	60%	0.597	54%	0.543	S	S	*	.	H	α-helix	trans	-65.7	-44	177.3	-159.3	79.4	0	0	0	111.5	K56 M57 A58 L63 V64	K56-L60 WeakPolarHBondContact O-CB 3.26Å; K56-L60 PolarHBondContact O-N 3.45Å; M57-L60 PolarHBondContact O-N 3.02Å; A58-L60 VanDerWaalsContact C-N 3.34Å; A58-L60 PolarHBondContact O-N 3.34Å; L60-L63 PolarHBondContact O-N 2.75Å; L60-V64 WeakPolarHBondContact O-CG2 3.43Å; L60-V64 PolarHBondContact O-N 3.49Å
61	L	84.7	Confident	78	Confident	99 Å²	99	107.1 Å²	107.1	52%	0.518	55%	0.547	S	S	.	.	H	α-helix	trans	-59.7	-47.2	174.9	-79.3	162.3	0	0	0	110.9	M57 A58 L63 V64 F65	M57-L61 WeakPolarHBondContact O-CB 3.4Å; M57-L61 WeakPolarHBondContact O-CG 3.37Å; M57-L61 PolarHBondContact O-N 3.32Å; A58-L61 PolarHBondContact O-N 3.44Å; L61-L63 VanDerWaalsContact C-N 3.32Å; L61-L63 PolarHBondContact O-N 2.96Å; L61-V64 PolarHBondContact O-N 3.48Å; L61-V64 VanDerWaalsContact O-N 3.15Å; L61-F65 HydrophobicContact CD2-CE2 4.39Å; L61-F65 WeakPolarHBondContact O-CD2 3.25Å; L61-F65 PolarHBondContact O-N 3.28Å
62	T	85.9	Confident	77.3	Confident	72 Å²	72	110 Å²	110	44%	0.442	55%	0.552	S	S	.	*	H	α-helix	trans	-56	-47.5	176.6	-57.1	0	0	0	0	111.1	A58 H59 V64 F65 Y66	A58-T62 PolarHBondContact O-N 2.9Å; A58-T62 PolarHBondContact O-OG1 2.95Å; H59-T62 PolarHBondContact O-N 3.29Å; T62-V64 PolarHBondContact O-N 3.39Å; T62-F65 PolarHBondContact O-N 2.85Å; T62-Y66 HydrophobicContact CG2-CD2 3.6Å; T62-Y66 HydrophobicContact CG2-CE2 3.49Å; T62-Y66 VanDerWaalsContact CG2-CE2 3.49Å; T62-Y66 VanDerWaalsContact O-CD2 3.23Å; T62-Y66 WeakPolarHBondContact O-CD2 3.41Å; T62-Y66 PolarHBondContact O-N 3.44Å
63	L	82.5	Confident	76.4	Confident	81 Å²	81	107.5 Å²	107.5	42%	0.424	55%	0.548	S	S	.	.	H	α-helix	trans	-60.9	-42.7	176.4	-71	172.7	0	0	0	112.4	H59 L60 L61 Y66 N67	H59-L63 WeakPolarHBondContact O-CG 3.46Å; H59-L63 PolarHBondContact O-N 3.3Å; L60-L63 PolarHBondContact O-N 2.75Å; L61-L63 VanDerWaalsContact C-N 3.32Å; L61-L63 PolarHBondContact O-N 2.96Å; L63-Y66 PolarHBondContact O-N 3.15Å; L63-N67 WeakPolarHBondContact O-CB 3.2Å; L63-N67 PolarHBondContact O-N 3.01Å; L63-N67 PolarHBondContact O-ND2 3.46Å
64	V	83.3	Confident	75.2	Confident	80 Å²	80	108.5 Å²	108.5	49%	0.485	56%	0.559	S	S	.	*	H	α-helix	trans	-62.1	-45.7	176.5	172.8	0	0	0	0	110.7	L60 L61 T62 Y66 N67 V68	L60-V64 WeakPolarHBondContact O-CG2 3.43Å; L60-V64 PolarHBondContact O-N 3.49Å; L61-V64 PolarHBondContact O-N 3.48Å; L61-V64 VanDerWaalsContact O-N 3.15Å; T62-V64 PolarHBondContact O-N 3.39Å; V64-Y66 PolarHBondContact O-N 3.39Å; V64-N67 PolarHBondContact O-N 3.34Å; V64-V68 HydrophobicContact CG1-CG2 4.16Å; V64-V68 WeakPolarHBondContact O-CB 3.23Å; V64-V68 VanDerWaalsContact O-CG2 3.25Å; V64-V68 WeakPolarHBondContact O-CG2 3.49Å; V64-V68 PolarHBondContact O-N 2.91Å
65	F	79.1	Confident	74.1	Confident	134 Å²	134	110.5 Å²	110.5	59%	0.588	56%	0.558	S	S	*	*	H	α-helix	trans	-60	-45.6	176.3	-85.2	-74.2	0	0	0	112	L61 T62 N67 V68 L69	L61-F65 HydrophobicContact CD2-CE2 4.39Å; L61-F65 WeakPolarHBondContact O-CD2 3.25Å; L61-F65 PolarHBondContact O-N 3.28Å; T62-F65 PolarHBondContact O-N 2.85Å; F65-N67 PolarHBondContact O-N 3.36Å; F65-V68 PolarHBondContact O-N 2.88Å; F65-L69 WeakPolarHBondContact O-CB 3.3Å; F65-L69 PolarHBondContact O-N 3.24Å
66	Y	75.9	Confident	72.9	Confident	156 Å²	156	107.6 Å²	107.6	61%	0.612	55%	0.55	S	S	*	*	H	α-helix	trans	-63.1	-41.4	177.4	-87.6	-77.2	0	0	0	112.7	T62 L63 V64 N70	T62-Y66 HydrophobicContact CG2-CD2 3.6Å; T62-Y66 HydrophobicContact CG2-CE2 3.49Å; T62-Y66 VanDerWaalsContact CG2-CE2 3.49Å; T62-Y66 VanDerWaalsContact O-CD2 3.23Å; T62-Y66 WeakPolarHBondContact O-CD2 3.41Å; T62-Y66 PolarHBondContact O-N 3.44Å; L63-Y66 PolarHBondContact O-N 3.15Å; V64-Y66 PolarHBondContact O-N 3.39Å; Y66-N70 VanDerWaalsContact O-CB 3.3Å; Y66-N70 WeakPolarHBondContact O-CB 3.33Å; Y66-N70 PolarHBondContact O-N 2.84Å
67	N	71.1	Confident	71.9	Confident	104 Å²	104	106 Å²	106	56%	0.556	55%	0.547	S	S	*	.	H	α-helix	trans	-68.8	-42.1	178.2	-76.4	-71.6	0	0	0	111.8	L63 V64 F65 N70 L71	L63-N67 WeakPolarHBondContact O-CB 3.2Å; L63-N67 PolarHBondContact O-N 3.01Å; L63-N67 PolarHBondContact O-ND2 3.46Å; V64-N67 PolarHBondContact O-N 3.34Å; F65-N67 PolarHBondContact O-N 3.36Å; N67-N70 PolarHBondContact O-N 3.43Å; N67-L71 WeakPolarHBondContact O-CB 3.44Å; N67-L71 PolarHBondContact O-N 2.93Å
68	V	72.9	Confident	71	Confident	92 Å²	92	100.6 Å²	100.6	56%	0.558	52%	0.521	S	S	*	.	H	α-helix	trans	-66.4	-42	176.7	173.6	0	0	0	0	111	V64 F65 L71 Y72	V64-V68 HydrophobicContact CG1-CG2 4.16Å; V64-V68 WeakPolarHBondContact O-CB 3.23Å; V64-V68 VanDerWaalsContact O-CG2 3.25Å; V64-V68 WeakPolarHBondContact O-CG2 3.49Å; V64-V68 PolarHBondContact O-N 2.91Å; F65-V68 PolarHBondContact O-N 2.88Å; V68-L71 PolarHBondContact O-N 3.37Å; V68-Y72 PolarHBondContact O-N 3.35Å; V68-Y72 VanDerWaalsContact O-N 3.08Å
69	L	67.8	Low	69.9	Low	100 Å²	100	102.2 Å²	102.2	52%	0.524	53%	0.527	S	S	.	.	H	α-helix	trans	-64	-43.8	175.4	-126.3	83.1	0	0	0	111.4	F65 L71 Y72 I73	F65-L69 WeakPolarHBondContact O-CB 3.3Å; F65-L69 PolarHBondContact O-N 3.24Å; L69-L71 VanDerWaalsContact C-N 3.32Å; L69-L71 PolarHBondContact O-N 3.2Å; L69-Y72 PolarHBondContact O-N 2.9Å; L69-Y72 VanDerWaalsContact O-N 3.14Å; L69-I73 HydrophobicContact CB-CD1 4.31Å; L69-I73 HydrophobicContact CD2-CD1 3.92Å; L69-I73 HydrophobicContact CG-CD1 4.04Å; L69-I73 WeakPolarHBondContact O-CB 3.22Å; L69-I73 WeakPolarHBondContact O-CD1 3.5Å; L69-I73 VanDerWaalsContact O-CG1 3.22Å; L69-I73 WeakPolarHBondContact O-CG1 3.47Å; L69-I73 PolarHBondContact O-N 3.44Å
70	N	63.3	Low	68.6	Low	101 Å²	101	98.9 Å²	98.9	54%	0.54	51%	0.513	S	S	.	.	H	α-helix	trans	-64.5	-36.8	177.3	-89.2	-4.1	0	0	0	112.3	Y66 N67 Y72 I73 S74	Y66-N70 VanDerWaalsContact O-CB 3.3Å; Y66-N70 WeakPolarHBondContact O-CB 3.33Å; Y66-N70 PolarHBondContact O-N 2.84Å; N67-N70 PolarHBondContact O-N 3.43Å; N70-Y72 PolarHBondContact O-N 3.08Å; N70-I73 PolarHBondContact O-N 3.26Å; N70-S74 PolarHBondContact O-N 3.35Å; N70-S74 PolarHBondContact O-OG 3.01Å
71	L	61.6	Low	67.5	Low	148 Å²	148	96 Å²	96	78%	0.775	51%	0.511	S	S	*	.	H	α-helix	trans	-65.3	-32.3	175.4	-142.2	106.4	0	0	0	111.4	N67 V68 L69	N67-L71 WeakPolarHBondContact O-CB 3.44Å; N67-L71 PolarHBondContact O-N 2.93Å; V68-L71 PolarHBondContact O-N 3.37Å; L69-L71 VanDerWaalsContact C-N 3.32Å; L69-L71 PolarHBondContact O-N 3.2Å
72	Y	60.8	Low	66.5	Low	163 Å²	163	93.4 Å²	93.4	64%	0.639	50%	0.502	S	S	*	.	H	α-helix	trans	-81.5	-32.9	178.3	-157.1	-85.2	0	0	0	113	V68 L69 N70 S74 E75	V68-Y72 PolarHBondContact O-N 3.35Å; V68-Y72 VanDerWaalsContact O-N 3.08Å; L69-Y72 PolarHBondContact O-N 2.9Å; L69-Y72 VanDerWaalsContact O-N 3.14Å; N70-Y72 PolarHBondContact O-N 3.08Å; Y72-S74 VanDerWaalsContact C-N 3.25Å; Y72-S74 PolarHBondContact O-N 2.89Å; Y72-E75 WeakPolarHBondContact O-CG 3.44Å
73	I	59.5	Low	65.6	Low	99 Å²	99	96.1 Å²	96.1	51%	0.508	51%	0.512	S	S	.	.	H	α-helix	trans	-81.4	-6.5	179.4	-62.6	161.2	0	0	0	111.9	L69 N70 E75	L69-I73 HydrophobicContact CB-CD1 4.31Å; L69-I73 HydrophobicContact CD2-CD1 3.92Å; L69-I73 HydrophobicContact CG-CD1 4.04Å; L69-I73 WeakPolarHBondContact O-CB 3.22Å; L69-I73 WeakPolarHBondContact O-CD1 3.5Å; L69-I73 VanDerWaalsContact O-CG1 3.22Å; L69-I73 WeakPolarHBondContact O-CG1 3.47Å; L69-I73 PolarHBondContact O-N 3.44Å; N70-I73 PolarHBondContact O-N 3.26Å; I73-E75 PolarHBondContact O-N 3.48Å
74	S	53.4	Low	64.9	Low	89 Å²	89	94 Å²	94	62%	0.622	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	8.7	171.3	-55.4	0	0	0	0	113	N70 Y72 D76	N70-S74 PolarHBondContact O-N 3.35Å; N70-S74 PolarHBondContact O-OG 3.01Å; Y72-S74 VanDerWaalsContact C-N 3.25Å; Y72-S74 PolarHBondContact O-N 2.89Å; S74-D76 PolarHBondContact O-N 3.43Å; S74-D76 VanDerWaalsContact O-N 3.14Å
75	E	54.7	Low	64.3	Low	99 Å²	99	93.5 Å²	93.5	46%	0.463	51%	0.508	S	S	.	.	S	Bend	trans	-62.4	112.9	162.2	-71.6	-178.7	155.8	0	0	107.5	Y72 I73 I77	Y72-E75 WeakPolarHBondContact O-CG 3.44Å; I73-E75 PolarHBondContact O-N 3.48Å; E75-I77 VanDerWaalsContact C-N 3.31Å; E75-I77 WeakPolarHBondContact O-CG1 2.95Å; E75-I77 PolarHBondContact O-N 3.37Å
76	D	58.4	Low	63.8	Low	100 Å²	100	91.8 Å²	91.8	54%	0.535	50%	0.502	S	S	.	.			trans	-54.8	87.8	-176.9	-66.6	-61	0	0	0	111.9	S74 C78 P84 N106	S74-D76 PolarHBondContact O-N 3.43Å; S74-D76 VanDerWaalsContact O-N 3.14Å; D76-C78 PolarHBondContact O-N 3.24Å; D76-P84 VanDerWaalsContact O-CD 3.28Å; D76-P84 WeakPolarHBondContact O-CD 3.37Å; D76-P84 WeakPolarHBondContact O-CG 3.5Å; D76-N106 HydrophobicContact CB-CB 4.43Å; D76-N106 WeakPolarHBondContact CB-ND2 3.35Å; D76-N106 PolarHBondContact OD2-ND2 3.23Å
77	I	63.2	Low	63.6	Low	101 Å²	101	88.2 Å²	88.2	52%	0.518	50%	0.5	S	S	.	.			trans	-67.2	133.2	175.4	-71.8	161.7	0	0	0	108.1	E75	E75-I77 VanDerWaalsContact C-N 3.31Å; E75-I77 WeakPolarHBondContact O-CG1 2.95Å; E75-I77 PolarHBondContact O-N 3.37Å
78	C	63.2	Low	63.5	Low	5 Å²	5	84.3 Å²	84.3	3%	0.034	48%	0.48	C	S	.	.			trans	-59.3	153.3	175.3	-61.3	0	0	0	0	110.7	D76 D80 G81 S82 C108	D76-C78 PolarHBondContact O-N 3.24Å; C78-D80 WeakPolarHBondContact CB-OD1 2.94Å; C78-D80 PolarHBondContact O-N 3.14Å; C78-G81 WeakPolarHBondContact O-CA 3.1Å; C78-G81 PolarHBondContact O-N 3.45Å; C78-S82 VanDerWaalsContact CB-O 3.27Å; C78-S82 WeakPolarHBondContact CB-O 3.18Å; C78-S82 PolarHBondContact N-O 2.84Å; C78-S82 PolarHBondContact SG-O 2.81Å; C78-C108 VanDerWaalsContact CA-SG 3.54Å; C78-C108 HydrophobicContact CB-CB 3.59Å; C78-C108 WeakPolarHBondContact CB-SG 2.86Å; C78-C108 WeakPolarHBondContact SG-CA 3.09Å; C78-C108 WeakPolarHBondContact SG-CB 3.47Å; C78-C108 CovalentContact SG-SG 2.02Å; C78-C108 PolarHBondContact SG-SG 2.02Å
79	P	59.3	Low	63.5	Low	86 Å²	86	83 Å²	83	56%	0.558	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-18.3	-178.4	24.9	-34.2	0	0	0	113.6	G81 I102	P79-G81 VanDerWaalsContact C-N 3.28Å; P79-I102 VanDerWaalsContact CD-CD1 3.41Å; P79-I102 HydrophobicContact CG-CD1 3.62Å
80	D	57.6	Low	63.5	Low	53 Å²	53	82.8 Å²	82.8	28%	0.283	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-3.7	171.8	63.8	-66.4	0	0	0	113.9	C78 S82	C78-D80 WeakPolarHBondContact CB-OD1 2.94Å; C78-D80 PolarHBondContact O-N 3.14Å; D80-S82 VanDerWaalsContact C-N 3.33Å; D80-S82 WeakPolarHBondContact OD2-CB 3.44Å; D80-S82 PolarHBondContact OD2-N 3.14Å; D80-S82 PolarHBondContact OD2-OG 3.44Å
81	G	60.5	Low	63.8	Low	54 Å²	54	83 Å²	83	56%	0.557	49%	0.486	S	S	*	.	S	Bend	trans	86.2	-3.2	-177	0	0	0	0	0	114.4	C78 P79	C78-G81 WeakPolarHBondContact O-CA 3.1Å; C78-G81 PolarHBondContact O-N 3.45Å; P79-G81 VanDerWaalsContact C-N 3.28Å
82	S	63.5	Low	64.1	Low	45 Å²	45	82.9 Å²	82.9	32%	0.315	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-76.6	153.9	175.9	-60.5	0	0	0	0	112	C78 D80	C78-S82 VanDerWaalsContact CB-O 3.27Å; C78-S82 WeakPolarHBondContact CB-O 3.18Å; C78-S82 PolarHBondContact N-O 2.84Å; C78-S82 PolarHBondContact SG-O 2.81Å; D80-S82 VanDerWaalsContact C-N 3.33Å; D80-S82 WeakPolarHBondContact OD2-CB 3.44Å; D80-S82 PolarHBondContact OD2-N 3.14Å; D80-S82 PolarHBondContact OD2-OG 3.44Å
83	L	66.6	Low	64.2	Low	128 Å²	128	81.2 Å²	81.2	67%	0.67	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-70.8	142.3	170.7	-70.5	97.2	0	0	0	110.3	A85	L83-A85 PolarHBondContact O-N 3.2Å
84	P	67.8	Low	64.7	Low	37 Å²	37	77.5 Å²	77.5	24%	0.24	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-63.1	131.6	174.9	28.4	-34.7	0	0	0	109.5	D76 N106	D76-P84 VanDerWaalsContact O-CD 3.28Å; D76-P84 WeakPolarHBondContact O-CD 3.37Å; D76-P84 WeakPolarHBondContact O-CG 3.5Å; P84-N106 HydrophobicContact CB-CB 3.89Å
85	A	70	Confident	65.6	Low	69 Å²	69	77.1 Å²	77.1	57%	0.57	46%	0.457	S	S	*	.	S	Bend	trans	-75.2	-32.4	-176.1	0	0	0	0	0	112.1	L83 L99 C107	L83-A85 PolarHBondContact O-N 3.2Å; A85-L99 HydrophobicContact CB-CD1 4.1Å; A85-L99 HydrophobicContact CB-CD2 3.62Å; A85-C107 PolarHBondContact N-O 2.96Å
86	E	68.6	Low	66.1	Low	98 Å²	98	80.8 Å²	80.8	46%	0.458	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	166.4	-179	-156.3	172.1	156.5	0	0	109.4	S95 C107	E86-S95 PolarHBondContact OE1-OG 2.75Å; E86-S95 WeakPolarHBondContact OE2-CB 3.42Å; E86-S95 PolarHBondContact OE2-OG 3.45Å; E86-C107 HydrophobicContact CB-CB 4.33Å; E86-C107 WeakPolarHBondContact O-CB 3.36Å; E86-C107 PolarHBondContact O-N 3.38Å
87	S	71.9	Confident	66.4	Low	82 Å²	82	82.2 Å²	82.2	57%	0.573	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	152.3	166	-54.9	0	0	0	0	110.9	Y105	S87-Y105 CarbonylContact C-O 3.59Å; S87-Y105 WeakPolarHBondContact CA-O 3.39Å; S87-Y105 WeakPolarHBondContact CB-O 3.42Å
88	C	69.2	Low	66.4	Low	21 Å²	21	80.4 Å²	80.4	14%	0.142	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-67.2	144	174.6	-55.4	0	0	0	0	111.6	C101 G104 Y105 N106	C88-C101 HydrophobicContact CB-CB 3.93Å; C88-C101 WeakPolarHBondContact CB-SG 3.41Å; C88-C101 WeakPolarHBondContact SG-CA 3.45Å; C88-C101 WeakPolarHBondContact SG-CB 2.92Å; C88-C101 CovalentContact SG-SG 2Å; C88-C101 PolarHBondContact SG-SG 3.43Å; C88-G104 WeakPolarHBondContact CB-O 2.93Å; C88-Y105 PolarHBondContact N-O 3.49Å; C88-N106 VanDerWaalsContact SG-C 3.59Å; C88-N106 PolarHBondContact SG-N 3.41Å
89	T	72.4	Confident	66.6	Low	66 Å²	66	81.2 Å²	81.2	41%	0.405	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-67.9	158	169.1	-37.4	0	0	0	0	109.2	D91 F92 Q93	T89-D91 PolarHBondContact O-N 3.26Å; T89-F92 WeakPolarHBondContact O-CA 2.92Å; T89-F92 PolarHBondContact O-N 2.65Å; T89-Q93 WeakPolarHBondContact CB-O 3.27Å; T89-Q93 PolarHBondContact N-O 3.38Å; T89-Q93 PolarHBondContact OG1-O 3.39Å
90	A	68.8	Low	67	Low	94 Å²	94	79.6 Å²	79.6	78%	0.777	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-22.5	178.9	0	0	0	0	0	114.1	F92	A90-F92 VanDerWaalsContact C-N 3.29Å; A90-F92 PolarHBondContact O-N 3.01Å
91	D	69.5	Low	67.4	Low	105 Å²	105	78.4 Å²	78.4	56%	0.561	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	17.7	174.8	-58	-71.7	0	0	0	114.1	T89 Q93	T89-D91 PolarHBondContact O-N 3.26Å; D91-Q93 PolarHBondContact O-N 3.38Å
92	F	66.5	Low	67.8	Low	146 Å²	146	78.1 Å²	78.1	64%	0.64	45%	0.452	S	S	*	.	S	Bend	trans	57.1	28.6	-177	-57.4	-82.6	0	0	0	113.6	T89 A90 C101	T89-F92 WeakPolarHBondContact O-CA 2.92Å; T89-F92 PolarHBondContact O-N 2.65Å; A90-F92 VanDerWaalsContact C-N 3.29Å; A90-F92 PolarHBondContact O-N 3.01Å; F92-C101 VanDerWaalsContact O-CB 3.28Å; F92-C101 WeakPolarHBondContact O-CB 3.41Å
93	Q	64.5	Low	67.8	Low	129 Å²	129	82.9 Å²	82.9	60%	0.603	47%	0.474	S	S	*	.			trans	-116.8	148.4	-176.9	-78	174	65.7	0	0	110.7	T89 D91	T89-Q93 WeakPolarHBondContact CB-O 3.27Å; T89-Q93 PolarHBondContact N-O 3.38Å; T89-Q93 PolarHBondContact OG1-O 3.39Å; D91-Q93 PolarHBondContact O-N 3.38Å
94	C	68.2	Low	67.7	Low	21 Å²	21	77.7 Å²	77.7	14%	0.142	45%	0.451	C	S	.	.			trans	-98.2	149	175.4	-60.5	0	0	0	0	110.1	R96 L99 I100 C101 C107	C94-R96 PolarHBondContact O-N 3.25Å; C94-L99 HydrophobicContact CB-CB 3.55Å; C94-L99 HydrophobicContact CB-CD1 4.32Å; C94-I100 VanDerWaalsContact SG-C 3.56Å; C94-C101 PolarHBondContact SG-N 3.01Å; C94-C107 WeakPolarHBondContact CA-SG 3.21Å; C94-C107 HydrophobicContact CB-CB 3.81Å; C94-C107 WeakPolarHBondContact CB-SG 3.49Å; C94-C107 VanDerWaalsContact SG-CA 3.52Å; C94-C107 WeakPolarHBondContact SG-CB 3.28Å; C94-C107 CovalentContact SG-SG 2.02Å; C94-C107 PolarHBondContact SG-SG 2.89Å
95	S	73	Confident	67.5	Low	80 Å²	80	84.2 Å²	84.2	56%	0.559	47%	0.472	S	S	*	.	S	Bend	trans	-55.3	-25.3	178.1	-63.5	0	0	0	0	113.4	E86	E86-S95 PolarHBondContact OE1-OG 2.75Å; E86-S95 WeakPolarHBondContact OE2-CB 3.42Å; E86-S95 PolarHBondContact OE2-OG 3.45Å
96	R	66	Low	67.5	Low	176 Å²	176	82 Å²	82	66%	0.664	45%	0.45	S	S	*	.	S	Bend	trans	-119.5	138.5	177.3	-54.2	-177.6	-179	-176.7	1.1	110.7	C94 S98 L99	C94-R96 PolarHBondContact O-N 3.25Å; R96-S98 PolarHBondContact O-N 3.38Å; R96-L99 HydrophobicContact CB-CD1 3.81Å; R96-L99 HydrophobicContact CB-CG 4.2Å; R96-L99 HydrophobicContact CG-CD1 4.17Å; R96-L99 WeakPolarHBondContact O-CB 3.33Å; R96-L99 PolarHBondContact O-N 3.38Å; R96-L99 VanDerWaalsContact O-N 3.09Å
97	S	64.1	Low	67.5	Low	131 Å²	131	77.3 Å²	77.3	92%	0.916	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-13.3	176.3	51.4	0	0	0	0	114.5	L99	S97-L99 VanDerWaalsContact C-N 3.27Å
98	S	63.6	Low	67.4	Low	62 Å²	62	73.5 Å²	73.5	43%	0.434	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	1.7	173.7	66.6	0	0	0	0	113.6	R96 L110	R96-S98 PolarHBondContact O-N 3.38Å; S98-L110 PolarHBondContact O-N 3.47Å
99	L	67.3	Low	67.1	Low	23 Å²	23	73.9 Å²	73.9	12%	0.12	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	143.1	-178.4	-61.6	163.7	0	0	0	108.9	A85 C94 R96 S97 C107 C108 P109	A85-L99 HydrophobicContact CB-CD1 4.1Å; A85-L99 HydrophobicContact CB-CD2 3.62Å; C94-L99 HydrophobicContact CB-CB 3.55Å; C94-L99 HydrophobicContact CB-CD1 4.32Å; R96-L99 HydrophobicContact CB-CD1 3.81Å; R96-L99 HydrophobicContact CB-CG 4.2Å; R96-L99 HydrophobicContact CG-CD1 4.17Å; R96-L99 WeakPolarHBondContact O-CB 3.33Å; R96-L99 PolarHBondContact O-N 3.38Å; R96-L99 VanDerWaalsContact O-N 3.09Å; S97-L99 VanDerWaalsContact C-N 3.27Å; L99-C107 HydrophobicContact CB-CB 4.2Å; L99-C107 HydrophobicContact CD1-CB 4.41Å; L99-C108 CarbonylContact C-O 3.44Å; L99-C108 VanDerWaalsContact CA-O 3.24Å; L99-C108 WeakPolarHBondContact CA-O 3.22Å; L99-P109 HydrophobicContact CD2-CB 4.14Å
100	I	67.7	Low	66.6	Low	52 Å²	52	74.9 Å²	74.9	27%	0.267	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.7	174.3	-173.1	163.1	0	0	0	110.5	C94 I102 C107 C108 L110 H125	C94-I100 VanDerWaalsContact SG-C 3.56Å; I100-I102 HydrophobicContact CG2-CD1 4.24Å; I100-I102 HydrophobicContact CG2-CG1 4.1Å; I100-I102 PolarHBondContact O-N 2.99Å; I100-C107 CarbonylContact O-C 3.52Å; I100-C107 WeakPolarHBondContact O-CA 3.45Å; I100-C108 PolarHBondContact N-O 3.49Å; I100-C108 PolarHBondContact O-N 3.25Å; I100-L110 HydrophobicContact CB-CD1 3.51Å; I100-L110 HydrophobicContact CG2-CD1 3.51Å; I100-H125 WeakPolarHBondContact CD1-O 2.95Å
101	C	66.4	Low	65.7	Low	27 Å²	27	76.2 Å²	76.2	18%	0.182	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	115.5	175.4	-176.7	0	0	0	0	110.3	C88 F92 C94 G104 N106	C88-C101 HydrophobicContact CB-CB 3.93Å; C88-C101 WeakPolarHBondContact CB-SG 3.41Å; C88-C101 WeakPolarHBondContact SG-CA 3.45Å; C88-C101 WeakPolarHBondContact SG-CB 2.92Å; C88-C101 CovalentContact SG-SG 2Å; C88-C101 PolarHBondContact SG-SG 3.43Å; F92-C101 VanDerWaalsContact O-CB 3.28Å; F92-C101 WeakPolarHBondContact O-CB 3.41Å; C94-C101 PolarHBondContact SG-N 3.01Å; C101-G104 WeakPolarHBondContact SG-CA 2.91Å; C101-N106 CarbonylContact C-O 3.56Å; C101-N106 WeakPolarHBondContact CA-O 3.09Å
102	I	68.1	Low	64.4	Low	48 Å²	48	73.2 Å²	73.2	25%	0.246	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	135.7	176.6	-55.6	-178.4	0	0	0	108.2	P79 I100 G104 Y105 N106 C108	P79-I102 VanDerWaalsContact CD-CD1 3.41Å; P79-I102 HydrophobicContact CG-CD1 3.62Å; I100-I102 HydrophobicContact CG2-CD1 4.24Å; I100-I102 HydrophobicContact CG2-CG1 4.1Å; I100-I102 PolarHBondContact O-N 2.99Å; I102-G104 PolarHBondContact O-N 3.17Å; I102-Y105 PolarHBondContact O-N 3.01Å; I102-N106 PolarHBondContact N-O 3.23Å; I102-N106 PolarHBondContact O-N 2.78Å; I102-C108 HydrophobicContact CD1-CB 3.75Å; I102-C108 HydrophobicContact CG1-CB 4.3Å
103	D	64.2	Low	63.2	Low	146 Å²	146	70.8 Å²	70.8	78%	0.781	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	13.3	-175.2	-68.7	-54.9	0	0	0	115.7	Y105	D103-Y105 VanDerWaalsContact C-N 3.26Å; D103-Y105 WeakPolarHBondContact O-CD2 3.46Å; D103-Y105 PolarHBondContact O-N 2.95Å
104	G	63.8	Low	61.8	Low	18 Å²	18	70.1 Å²	70.1	19%	0.186	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	0	177.3	0	0	0	0	0	115.6	C88 C101 I102	C88-G104 WeakPolarHBondContact CB-O 2.93Å; C101-G104 WeakPolarHBondContact SG-CA 2.91Å; I102-G104 PolarHBondContact O-N 3.17Å
105	Y	64.3	Low	60.2	Low	174 Å²	174	78.3 Å²	78.3	68%	0.682	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.6	-28.3	-176.6	-63.5	-77.5	0	0	0	113.9	S87 C88 I102 D103	S87-Y105 CarbonylContact C-O 3.59Å; S87-Y105 WeakPolarHBondContact CA-O 3.39Å; S87-Y105 WeakPolarHBondContact CB-O 3.42Å; C88-Y105 PolarHBondContact N-O 3.49Å; I102-Y105 PolarHBondContact O-N 3.01Å; D103-Y105 VanDerWaalsContact C-N 3.26Å; D103-Y105 WeakPolarHBondContact O-CD2 3.46Å; D103-Y105 PolarHBondContact O-N 2.95Å
106	N	69.8	Low	58.7	Low	22 Å²	22	77.1 Å²	77.1	12%	0.118	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	125.4	-168	-66.7	-60.3	0	0	0	113	D76 P84 C88 C101 I102	D76-N106 HydrophobicContact CB-CB 4.43Å; D76-N106 WeakPolarHBondContact CB-ND2 3.35Å; D76-N106 PolarHBondContact OD2-ND2 3.23Å; P84-N106 HydrophobicContact CB-CB 3.89Å; C88-N106 VanDerWaalsContact SG-C 3.59Å; C88-N106 PolarHBondContact SG-N 3.41Å; C101-N106 CarbonylContact C-O 3.56Å; C101-N106 WeakPolarHBondContact CA-O 3.09Å; I102-N106 PolarHBondContact N-O 3.23Å; I102-N106 PolarHBondContact O-N 2.78Å
107	C	67.9	Low	57.4	Low	0 Å²	0	70.7 Å²	70.7	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	108.6	177.4	-74.7	0	0	0	0	111.3	A85 E86 C94 L99 I100	A85-C107 PolarHBondContact N-O 2.96Å; E86-C107 HydrophobicContact CB-CB 4.33Å; E86-C107 WeakPolarHBondContact O-CB 3.36Å; E86-C107 PolarHBondContact O-N 3.38Å; C94-C107 WeakPolarHBondContact CA-SG 3.21Å; C94-C107 HydrophobicContact CB-CB 3.81Å; C94-C107 WeakPolarHBondContact CB-SG 3.49Å; C94-C107 VanDerWaalsContact SG-CA 3.52Å; C94-C107 WeakPolarHBondContact SG-CB 3.28Å; C94-C107 CovalentContact SG-SG 2.02Å; C94-C107 PolarHBondContact SG-SG 2.89Å; L99-C107 HydrophobicContact CB-CB 4.2Å; L99-C107 HydrophobicContact CD1-CB 4.41Å; I100-C107 CarbonylContact O-C 3.52Å; I100-C107 WeakPolarHBondContact O-CA 3.45Å
108	C	70.5	Confident	56.2	Low	3 Å²	3	70.1 Å²	70.1	2%	0.02	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	140.4	-175.9	-66	0	0	0	0	111.8	C78 L99 I100 I102 L110	C78-C108 VanDerWaalsContact CA-SG 3.54Å; C78-C108 HydrophobicContact CB-CB 3.59Å; C78-C108 WeakPolarHBondContact CB-SG 2.86Å; C78-C108 WeakPolarHBondContact SG-CA 3.09Å; C78-C108 WeakPolarHBondContact SG-CB 3.47Å; C78-C108 CovalentContact SG-SG 2.02Å; C78-C108 PolarHBondContact SG-SG 2.02Å; L99-C108 CarbonylContact C-O 3.44Å; L99-C108 VanDerWaalsContact CA-O 3.24Å; L99-C108 WeakPolarHBondContact CA-O 3.22Å; I100-C108 PolarHBondContact N-O 3.49Å; I100-C108 PolarHBondContact O-N 3.25Å; I102-C108 HydrophobicContact CD1-CB 3.75Å; I102-C108 HydrophobicContact CG1-CB 4.3Å; C108-L110 PolarHBondContact O-N 2.84Å
109	P	63.2	Low	55.1	Low	28 Å²	28	67.6 Å²	67.6	18%	0.182	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	129.3	178.5	29.5	-33.8	0	0	0	111.8	L99 T111	L99-P109 HydrophobicContact CD2-CB 4.14Å; P109-T111 PolarHBondContact O-N 2Å
110	L	61.1	Low	54	Low	88 Å²	88	71.4 Å²	71.4	46%	0.461	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-63.3	-8.9	174.1	-112.9	75.7	0	0	0	113.2	S98 I100 C108 G112 Y113	S98-L110 PolarHBondContact O-N 3.47Å; I100-L110 HydrophobicContact CB-CD1 3.51Å; I100-L110 HydrophobicContact CG2-CD1 3.51Å; C108-L110 PolarHBondContact O-N 2.84Å; L110-G112 PolarHBondContact O-N 3.26Å; L110-G112 VanDerWaalsContact O-N 3.12Å; L110-Y113 PolarHBondContact O-N 2.81Å
111	T	50.4	Low	52.6	Low	122 Å²	122	75.4 Å²	75.4	75%	0.748	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-68.9	-10.7	-167.2	53.8	0	0	0	0	114.9	P109	P109-T111 PolarHBondContact O-N 2Å
112	G	42.2	Very low	51.3	Low	42 Å²	42	77.3 Å²	77.3	43%	0.433	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-88.3	-7.3	176.3	0	0	0	0	0	114.9	L110 P114	L110-G112 PolarHBondContact O-N 3.26Å; L110-G112 VanDerWaalsContact O-N 3.12Å; G112-P114 WeakPolarHBondContact O-CD 3.37Å
113	Y	41.4	Very low	50	Low	95 Å²	95	77.4 Å²	77.4	37%	0.373	45%	0.447	S	S	.	.	S	Bend	trans	-100.2	98.5	-179.1	-78.5	-70	0	0	0	110.4	L110 E115 I116 P128	L110-Y113 PolarHBondContact O-N 2.81Å; Y113-E115 PolarHBondContact O-N 2.86Å; Y113-I116 HydrophobicContact CD1-CD1 3.15Å; Y113-I116 HydrophobicContact CD1-CG1 3.93Å; Y113-I116 HydrophobicContact CD2-CD1 4.42Å; Y113-I116 HydrophobicContact CE1-CD1 3.78Å; Y113-I116 HydrophobicContact CG-CD1 3.5Å; Y113-I116 HydrophobicContact CG-CG1 4.26Å; Y113-P128 HydrophobicContact CE1-CG 3.85Å
114	P	34.2	Very low	49.3	Very low	114 Å²	114	78.2 Å²	78.2	74%	0.74	45%	0.45	S	S	*	.	S	Bend	trans	-62	114.3	173	26.7	-32.7	0	0	0	107.5	G112 I116	G112-P114 WeakPolarHBondContact O-CD 3.37Å; P114-I116 VanDerWaalsContact C-N 3.26Å; P114-I116 PolarHBondContact O-N 3.06Å
115	E	35.7	Very low	48.8	Very low	193 Å²	193	80 Å²	80	90%	0.902	45%	0.453	S	S	*	.			trans	40	50.5	164.6	-61	-174.2	129.4	0	0	114.3	Y113 G117	Y113-E115 PolarHBondContact O-N 2.86Å; E115-G117 PolarHBondContact O-N 2.97Å
116	I	42	Very low	48.1	Very low	55 Å²	55	79.9 Å²	79.9	28%	0.282	45%	0.453	S	S	.	.			trans	-69.7	86.1	156	-43.6	168.7	0	0	0	103.9	Y113 P114 V118 P128	Y113-I116 HydrophobicContact CD1-CD1 3.15Å; Y113-I116 HydrophobicContact CD1-CG1 3.93Å; Y113-I116 HydrophobicContact CD2-CD1 4.42Å; Y113-I116 HydrophobicContact CE1-CD1 3.78Å; Y113-I116 HydrophobicContact CG-CD1 3.5Å; Y113-I116 HydrophobicContact CG-CG1 4.26Å; P114-I116 VanDerWaalsContact C-N 3.26Å; P114-I116 PolarHBondContact O-N 3.06Å; I116-V118 PolarHBondContact O-N 3.46Å; I116-V118 VanDerWaalsContact O-N 3.16Å; I116-P128 HydrophobicContact CD1-CB 4.25Å; I116-P128 HydrophobicContact CD1-CG 4.32Å
117	G	37.3	Very low	47.3	Very low	41 Å²	41	79.9 Å²	79.9	42%	0.423	46%	0.458	S	S	.	.			trans	-44.2	125.3	178.3	0	0	0	0	0	107.2	E115 C119	E115-G117 PolarHBondContact O-N 2.97Å; G117-C119 PolarHBondContact O-N 2.82Å
118	V	40.1	Very low	46.7	Very low	119 Å²	119	82 Å²	82	72%	0.721	47%	0.472	S	S	*	.			trans	-25.6	103.5	165.1	179.9	0	0	0	0	108.3	I116 P120	I116-V118 PolarHBondContact O-N 3.46Å; I116-V118 VanDerWaalsContact O-N 3.16Å; V118-P120 VanDerWaalsContact O-N 3.16Å
119	C	39.8	Very low	46.1	Very low	9 Å²	9	82.8 Å²	82.8	6%	0.061	48%	0.477	C	S	.	.			trans	-57.3	130	175.8	-106.2	0	0	0	0	106	G117 F121 G122 C145	G117-C119 PolarHBondContact O-N 2.82Å; C119-F121 PolarHBondContact O-N 2.85Å; C119-G122 PolarHBondContact O-N 2.93Å; C119-G122 VanDerWaalsContact O-N 3.1Å; C119-C145 HydrophobicContact CB-CB 3.97Å; C119-C145 WeakPolarHBondContact CB-SG 3.45Å; C119-C145 WeakPolarHBondContact SG-CB 3.21Å; C119-C145 CovalentContact SG-SG 2.04Å; C119-C145 PolarHBondContact SG-SG 3.35Å
120	P	44.8	Very low	45.9	Very low	104 Å²	104	86.4 Å²	86.4	68%	0.675	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	2	-156.5	18.6	-31.8	0	0	0	115.9	V118	V118-P120 VanDerWaalsContact O-N 3.16Å
121	F	38.4	Very low	45.8	Very low	136 Å²	136	89.7 Å²	89.7	60%	0.596	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	6	-179.6	-71.9	-77.7	0	0	0	115.1	C119 T123 H141 M150	C119-F121 PolarHBondContact O-N 2.85Å; F121-T123 HydrophobicContact CB-CG2 4.37Å; F121-T123 PolarHBondContact O-N 3.3Å; F121-H141 AromaticContact CD2-NE2 3.83Å; F121-H141 AromaticContact CE2-NE2 3.8Å; F121-M150 HydrophobicContact CB-CE 4.13Å; F121-M150 HydrophobicContact CG-CE 4.3Å
122	G	39	Very low	46.1	Very low	67 Å²	67	86 Å²	86	69%	0.691	50%	0.504	S	S	*	.			trans	63.2	15.4	173.1	0	0	0	0	0	114.5	C119	C119-G122 PolarHBondContact O-N 2.93Å; C119-G122 VanDerWaalsContact O-N 3.1Å
123	T	40.8	Very low	46.8	Very low	50 Å²	50	90.3 Å²	90.3	31%	0.307	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-81.5	132.1	-179.5	51.9	0	0	0	0	110.5	F121 H125 M150	F121-T123 HydrophobicContact CB-CG2 4.37Å; F121-T123 PolarHBondContact O-N 3.3Å; T123-H125 PolarHBondContact O-CE1 3.04Å; T123-H125 VanDerWaalsContact O-CE1 3.28Å; T123-H125 PolarHBondContact O-N 2Å; T123-H125 PolarHBondContact O-ND1 3.48Å; T123-M150 HydrophobicContact CG2-CE 4.23Å
124	L	47.7	Very low	47.7	Very low	162 Å²	162	87.1 Å²	87.1	85%	0.848	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-50.4	123.2	178.9	-154.3	78.6	0	0	0	110.9
125	H	54	Low	48.9	Very low	56 Å²	56	85.6 Å²	85.6	26%	0.259	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-83.1	134.2	-171.7	-61.7	19.2	0	0	0	110.5	I100 T123	I100-H125 WeakPolarHBondContact CD1-O 2.95Å; T123-H125 PolarHBondContact O-CE1 3.04Å; T123-H125 VanDerWaalsContact O-CE1 3.28Å; T123-H125 PolarHBondContact O-N 2Å; T123-H125 PolarHBondContact O-ND1 3.48Å
126	Y	50.3	Low	50	Low	171 Å²	171	85.1 Å²	85.1	67%	0.671	50%	0.495	S	S	*	.			trans	-86.7	-25.6	163.2	-77.8	-86.9	0	0	0	112	M138	Y126-M138 HydrophobicContact CD1-CE 3.83Å; Y126-M138 HydrophobicContact CD1-SD 4.46Å; Y126-M138 HydrophobicContact CD2-CE 3.37Å; Y126-M138 HydrophobicContact CD2-SD 3.52Å; Y126-M138 VanDerWaalsContact CD2-SD 3.52Å; Y126-M138 HydrophobicContact CE1-CE 3.87Å; Y126-M138 HydrophobicContact CE2-CE 3.4Å; Y126-M138 VanDerWaalsContact CE2-CE 3.4Å; Y126-M138 HydrophobicContact CE2-SD 4.14Å; Y126-M138 HydrophobicContact CG-CE 3.58Å; Y126-M138 HydrophobicContact CG-SD 3.7Å
127	G	53.6	Low	50.5	Low	22 Å²	22	89 Å²	89	23%	0.227	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.1	174.9	177.8	0	0	0	0	0	112.9	C146	G127-C146 WeakPolarHBondContact O-CB 3.14Å; G127-C146 PolarHBondContact O-N 2.74Å
128	P	55.1	Low	51.5	Low	46 Å²	46	89.1 Å²	89.1	30%	0.299	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	156.3	172.8	31	-35.1	0	0	0	111.6	Y113 I116 V130 Q144	Y113-P128 HydrophobicContact CE1-CG 3.85Å; I116-P128 HydrophobicContact CD1-CB 4.25Å; I116-P128 HydrophobicContact CD1-CG 4.32Å; P128-V130 PolarHBondContact O-N 2.02Å; P128-Q144 VanDerWaalsContact CA-O 3.23Å; P128-Q144 WeakPolarHBondContact CA-O 3.36Å
129	C	56.8	Low	52.5	Low	19 Å²	19	89 Å²	89	13%	0.128	50%	0.497	C	S	.	.			trans	-74.4	127.6	175.5	-51.1	0	0	0	0	111.3	C134 C140 Q144 C145	C129-C134 VanDerWaalsContact SG-SG 3.66Å; C129-C140 HydrophobicContact CB-CB 3.85Å; C129-C140 WeakPolarHBondContact CB-SG 2.97Å; C129-C140 WeakPolarHBondContact SG-CA 3.28Å; C129-C140 WeakPolarHBondContact SG-CB 2.94Å; C129-C140 CovalentContact SG-SG 2Å; C129-C140 PolarHBondContact SG-SG 2.86Å; C129-Q144 PolarHBondContact N-O 3.24Å; C129-C145 PolarHBondContact SG-N 3.18Å; C129-C145 PolarHBondContact SG-O 2.92Å
130	V	58.3	Low	53.4	Low	104 Å²	104	90 Å²	90	63%	0.63	51%	0.505	S	S	*	.	B	Isolated β-bridge	trans	-93.9	113.3	174.5	-174.1	0	0	0	0	107.6	P128 G132 L133	P128-V130 PolarHBondContact O-N 2.02Å; V130-G132 PolarHBondContact O-N 3.46Å; V130-L133 PolarHBondContact N-O 3.44Å; V130-L133 PolarHBondContact O-N 3.23Å
131	N	59.4	Low	54.1	Low	156 Å²	156	89 Å²	89	83%	0.834	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	33.9	-175.6	-65.9	-36.6	0	0	0	114.2	L133	N131-L133 PolarHBondContact O-N 2.89Å
132	G	56.2	Low	54.9	Low	46 Å²	46	87 Å²	87	47%	0.474	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	6.6	-177.5	0	0	0	0	0	114.5	V130 C140	V130-G132 PolarHBondContact O-N 3.46Å; G132-C140 WeakPolarHBondContact O-CB 3.44Å
133	L	57.7	Low	55.5	Low	132 Å²	132	86.2 Å²	86.2	69%	0.691	49%	0.485	S	S	*	.	B	Isolated β-bridge	trans	-110.9	146.5	178.4	-67.3	157	0	0	0	109.9	V130 N131	V130-L133 PolarHBondContact N-O 3.44Å; V130-L133 PolarHBondContact O-N 3.23Å; N131-L133 PolarHBondContact O-N 2.89Å
134	C	60.3	Low	56.1	Low	27 Å²	27	89.4 Å²	89.4	18%	0.182	50%	0.497	C	S	.	.			trans	-121.8	157.8	178.1	-68	0	0	0	0	109.3	C129 M138 C140 C146	C129-C134 VanDerWaalsContact SG-SG 3.66Å; C134-M138 HydrophobicContact CB-CB 3.77Å; C134-C140 VanDerWaalsContact SG-CA 3.6Å; C134-C146 WeakPolarHBondContact CA-SG 2.95Å; C134-C146 HydrophobicContact CB-CB 3.61Å; C134-C146 WeakPolarHBondContact CB-SG 3.3Å; C134-C146 WeakPolarHBondContact SG-CA 3.23Å; C134-C146 WeakPolarHBondContact SG-CB 3.46Å; C134-C146 CovalentContact SG-SG 2.02Å; C134-C146 PolarHBondContact SG-SG 3.19Å
135	P	58.6	Low	56.5	Low	83 Å²	83	81.9 Å²	81.9	54%	0.539	46%	0.458	S	S	.	.	S	Bend	trans	-56.2	153.6	171.5	22.9	-31.5	0	0	0	111.2	M138	P135-M138 HydrophobicContact CG-SD 4.2Å; P135-M138 WeakPolarHBondContact O-CB 3.01Å; P135-M138 PolarHBondContact O-N 2.91Å
136	E	59	Low	56.6	Low	182 Å²	182	79.4 Å²	79.4	85%	0.85	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.5	139.8	-165.1	-76.2	-175.8	118.6	0	0	114.5	M138	E136-M138 PolarHBondContact O-N 2.79Å
137	N	53	Low	56.9	Low	138 Å²	138	71.8 Å²	71.8	74%	0.738	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	2.8	-177.5	-58.1	-32.6	0	0	0	116.8
138	M	58.4	Low	56.7	Low	42 Å²	42	74.5 Å²	74.5	21%	0.207	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	148.7	173.3	-58	-174.5	-171.7	0	0	111.3	Y126 C134 P135 E136 G147	Y126-M138 HydrophobicContact CD1-CE 3.83Å; Y126-M138 HydrophobicContact CD1-SD 4.46Å; Y126-M138 HydrophobicContact CD2-CE 3.37Å; Y126-M138 HydrophobicContact CD2-SD 3.52Å; Y126-M138 VanDerWaalsContact CD2-SD 3.52Å; Y126-M138 HydrophobicContact CE1-CE 3.87Å; Y126-M138 HydrophobicContact CE2-CE 3.4Å; Y126-M138 VanDerWaalsContact CE2-CE 3.4Å; Y126-M138 HydrophobicContact CE2-SD 4.14Å; Y126-M138 HydrophobicContact CG-CE 3.58Å; Y126-M138 HydrophobicContact CG-SD 3.7Å; C134-M138 HydrophobicContact CB-CB 3.77Å; P135-M138 HydrophobicContact CG-SD 4.2Å; P135-M138 WeakPolarHBondContact O-CB 3.01Å; P135-M138 PolarHBondContact O-N 2.91Å; E136-M138 PolarHBondContact O-N 2.79Å; M138-G147 WeakPolarHBondContact CA-O 2.92Å; M138-G147 WeakPolarHBondContact CB-O 3.45Å
139	H	61.4	Low	56.3	Low	116 Å²	116	77.8 Å²	77.8	54%	0.537	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	141.3	174.8	-93.8	56.1	0	0	0	110.4	H141 G147 Q149	H139-H141 PolarHBondContact O-N 3.44Å; H139-G147 PolarHBondContact N-O 2.53Å; H139-G147 PolarHBondContact O-N 3.45Å; H139-Q149 HydrophobicContact CB-CG 4.45Å; H139-Q149 WeakPolarHBondContact ND1-CG 3.24Å
140	C	59.2	Low	55.8	Low	32 Å²	32	82.2 Å²	82.2	22%	0.216	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	108.1	173.5	-174.7	0	0	0	0	109.9	C129 G132 C134 G143 C145	C129-C140 HydrophobicContact CB-CB 3.85Å; C129-C140 WeakPolarHBondContact CB-SG 2.97Å; C129-C140 WeakPolarHBondContact SG-CA 3.28Å; C129-C140 WeakPolarHBondContact SG-CB 2.94Å; C129-C140 CovalentContact SG-SG 2Å; C129-C140 PolarHBondContact SG-SG 2.86Å; G132-C140 WeakPolarHBondContact O-CB 3.44Å; C134-C140 VanDerWaalsContact SG-CA 3.6Å; C140-G143 WeakPolarHBondContact SG-CA 3.43Å; C140-C145 CarbonylContact C-O 3.56Å; C140-C145 WeakPolarHBondContact CA-O 3.38Å
141	H	58.5	Low	54.8	Low	81 Å²	81	82.4 Å²	82.4	38%	0.375	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	119.2	176	-156.5	67.2	0	0	0	109.5	F121 H139 G143 Q144 C145	F121-H141 AromaticContact CD2-NE2 3.83Å; F121-H141 AromaticContact CE2-NE2 3.8Å; H139-H141 PolarHBondContact O-N 3.44Å; H141-G143 PolarHBondContact O-N 3.48Å; H141-G143 VanDerWaalsContact O-N 3.12Å; H141-Q144 PolarHBondContact O-N 2.02Å; H141-Q144 VanDerWaalsContact O-N 3.12Å; H141-C145 PolarHBondContact N-O 2.81Å; H141-C145 PolarHBondContact O-N 2.85Å
142	S	54.7	Low	53.7	Low	95 Å²	95	80 Å²	80	66%	0.664	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	27.2	-179.8	-59.5	0	0	0	0	115.5	Q144	S142-Q144 PolarHBondContact O-N 3.4Å
143	G	52.2	Low	52.7	Low	50 Å²	50	87.5 Å²	87.5	52%	0.515	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	0.5	179.9	0	0	0	0	0	114.5	C140 H141	C140-G143 WeakPolarHBondContact SG-CA 3.43Å; H141-G143 PolarHBondContact O-N 3.48Å; H141-G143 VanDerWaalsContact O-N 3.12Å
144	Q	54	Low	51.8	Low	117 Å²	117	85.7 Å²	85.7	55%	0.547	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	-41.4	-167.3	-69.1	-179.8	7.5	0	0	113.8	P128 C129 H141 S142	P128-Q144 VanDerWaalsContact CA-O 3.23Å; P128-Q144 WeakPolarHBondContact CA-O 3.36Å; C129-Q144 PolarHBondContact N-O 3.24Å; H141-Q144 PolarHBondContact O-N 2.02Å; H141-Q144 VanDerWaalsContact O-N 3.12Å; S142-Q144 PolarHBondContact O-N 3.4Å
145	C	55	Low	50.5	Low	5 Å²	5	93 Å²	93	3%	0.034	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141.8	-175.5	-45.5	0	0	0	0	113.1	C119 C129 C140 H141	C119-C145 HydrophobicContact CB-CB 3.97Å; C119-C145 WeakPolarHBondContact CB-SG 3.45Å; C119-C145 WeakPolarHBondContact SG-CB 3.21Å; C119-C145 CovalentContact SG-SG 2.04Å; C119-C145 PolarHBondContact SG-SG 3.35Å; C129-C145 PolarHBondContact SG-N 3.18Å; C129-C145 PolarHBondContact SG-O 2.92Å; C140-C145 CarbonylContact C-O 3.56Å; C140-C145 WeakPolarHBondContact CA-O 3.38Å; H141-C145 PolarHBondContact N-O 2.81Å; H141-C145 PolarHBondContact O-N 2.85Å
146	C	57.1	Low	49.4	Very low	4 Å²	4	94.8 Å²	94.8	3%	0.027	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119	170.4	-64.4	0	0	0	0	111.1	G127 C134	G127-C146 WeakPolarHBondContact O-CB 3.14Å; G127-C146 PolarHBondContact O-N 2.74Å; C134-C146 WeakPolarHBondContact CA-SG 2.95Å; C134-C146 HydrophobicContact CB-CB 3.61Å; C134-C146 WeakPolarHBondContact CB-SG 3.3Å; C134-C146 WeakPolarHBondContact SG-CA 3.23Å; C134-C146 WeakPolarHBondContact SG-CB 3.46Å; C134-C146 CovalentContact SG-SG 2.02Å; C134-C146 PolarHBondContact SG-SG 3.19Å
147	G	55.4	Low	48.4	Very low	11 Å²	11	92 Å²	92	11%	0.113	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	163.5	176.1	0	0	0	0	0	112.3	M138 H139	M138-G147 WeakPolarHBondContact CA-O 2.92Å; M138-G147 WeakPolarHBondContact CB-O 3.45Å; H139-G147 PolarHBondContact N-O 2.53Å; H139-G147 PolarHBondContact O-N 3.45Å
148	P	51.4	Low	47.6	Very low	78 Å²	78	90.2 Å²	90.2	51%	0.506	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	147.9	173	25.7	-32.8	0	0	0	110.2	M150	P148-M150 PolarHBondContact O-N 2.7Å
149	Q	46.3	Very low	46.4	Very low	116 Å²	116	95.3 Å²	95.3	54%	0.542	55%	0.552	S	S	.	*			trans	-56.5	96.6	177.7	-70.2	-173	59.7	0	0	110.6	H139 S151	H139-Q149 HydrophobicContact CB-CG 4.45Å; H139-Q149 WeakPolarHBondContact ND1-CG 3.24Å; Q149-S151 PolarHBondContact O-N 3.18Å
150	M	45.1	Very low	45.2	Very low	112 Å²	112	94.2 Å²	94.2	55%	0.552	56%	0.563	S	S	*	*			trans	-72.9	83.1	159.6	-76.6	-168.5	-82	0	0	106.6	F121 T123 P148 S152	F121-M150 HydrophobicContact CB-CE 4.13Å; F121-M150 HydrophobicContact CG-CE 4.3Å; T123-M150 HydrophobicContact CG2-CE 4.23Å; P148-M150 PolarHBondContact O-N 2.7Å; M150-S152 PolarHBondContact O-N 3.19Å
151	S	38.6	Very low	44.1	Very low	108 Å²	108	98.2 Å²	98.2	76%	0.755	59%	0.591	S	S	*	*			trans	-53.6	110.2	165.7	-173.9	0	0	0	0	107.2	Q149	Q149-S151 PolarHBondContact O-N 3.18Å
152	S	35.8	Very low	43	Very low	105 Å²	105	99.4 Å²	99.4	73%	0.734	61%	0.608	S	S	*	*	S	Bend	trans	-64.7	132.7	175	25.4	0	0	0	0	108.5	M150	M150-S152 PolarHBondContact O-N 3.19Å
153	K	34.5	Very low	42.2	Very low	203 Å²	203	100.1 Å²	100.1	88%	0.883	62%	0.62	S	S	*	*			trans	91.3	72.9	175.4	-61.2	178.6	171.9	179.6	0	117.9
154	A	39.8	Very low	41.4	Very low	94 Å²	94	102.9 Å²	102.9	78%	0.777	63%	0.627	S	S	*	*				-148.6	108.5	122.5	0	0	0	0	0	105.2
155	F	33.6	Very low	40.7	Very low	182 Å²	182	101.1 Å²	101.1	80%	0.798	63%	0.628	S	S	*	*			cis	39.5	86.6	41	-146.6	-106.3	0	0	0	108.5
156	L	34.2	Very low	40.1	Very low	119 Å²	119	106.7 Å²	106.7	62%	0.623	66%	0.662	S	S	*	*				-164.5	138.5	63.8	-82.1	160.7	0	0	0	110.8
157	T	38.3	Very low	39.4	Very low	123 Å²	123	113.8 Å²	113.8	76%	0.755	69%	0.692	S	S	*	*			trans	36.6	96.2	147.7	55.3	0	0	0	0	118
158	A	36.9	Very low	38.6	Very low	102 Å²	102	120.3 Å²	120.3	84%	0.843	71%	0.714	S	S	*	*			trans	-132.6	101.2	142.7	0	0	0	0	0	106.7
159	D	33.5	Very low	38.2	Very low	149 Å²	149	118.9 Å²	118.9	80%	0.797	71%	0.709	S	S	*	*			trans	-44.5	149.8	170	-70.1	-74.6	0	0	0	112.1
160	A	36.2	Very low	37.8	Very low	92 Å²	92	116.1 Å²	116.1	76%	0.76	71%	0.712	S	S	*	*	S	Bend	trans	-9.1	140.5	167.8	0	0	0	0	0	117.5
161	S	35.7	Very low	37.6	Very low	116 Å²	116	115.4 Å²	115.4	81%	0.811	71%	0.71	S	S	*	*			trans	88.9	60.2	164.8	72.6	0	0	0	0	117.1
162	S	35.4	Very low	37.7	Very low	106 Å²	106	116.2 Å²	116.2	74%	0.741	71%	0.705	S	S	*	*			trans	-152.2	80.9	143.6	-80.8	0	0	0	0	109.9	V164	S162-V164 PolarHBondContact O-N 3.12Å
163	A	37.6	Very low	38.3	Very low	110 Å²	110	120.2 Å²	120.2	91%	0.909	71%	0.705	S	S	*	*			trans	-64.5	62.2	154.4	0	0	0	0	0	109.1	S165	A163-S165 VanDerWaalsContact C-N 3.29Å; A163-S165 PolarHBondContact O-N 3.31Å
164	V	35.8	Very low	38.8	Very low	108 Å²	108	115.4 Å²	115.4	66%	0.655	69%	0.69	S	S	*	*			trans	-92.1	85.4	165.4	-178.9	0	0	0	0	105.3	S162 T166	S162-V164 PolarHBondContact O-N 3.12Å; V164-T166 PolarHBondContact O-N 2.79Å
165	S	39.3	Very low	39.3	Very low	81 Å²	81	114.6 Å²	114.6	57%	0.566	68%	0.675	S	S	*	*			trans	-16	120.4	157.2	-175.3	0	0	0	0	112.2	A163 K167	A163-S165 VanDerWaalsContact C-N 3.29Å; A163-S165 PolarHBondContact O-N 3.31Å; S165-K167 PolarHBondContact O-N 3.12Å
166	T	41.5	Very low	39.9	Very low	122 Å²	122	113.3 Å²	113.3	75%	0.748	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-59.8	17.4	174.4	-20.4	0	0	0	0	113.6	V164 Y168 A169	V164-T166 PolarHBondContact O-N 2.79Å; T166-Y168 PolarHBondContact O-N 2.96Å; T166-A169 HydrophobicContact CG2-CB 3.95Å; T166-A169 PolarHBondContact O-N 2.04Å
167	K	42.7	Very low	40.5	Very low	152 Å²	152	113.8 Å²	113.8	66%	0.661	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-54.5	-15.3	173.5	-158.3	174.1	-173.4	176.3	0	113.2	S165	S165-K167 PolarHBondContact O-N 3.12Å
168	Y	39.5	Very low	40.8	Very low	148 Å²	148	112.4 Å²	112.4	58%	0.58	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-104.5	-0.7	178.9	-61.3	-75.1	0	0	0	115.4	T166 G170 L171 L172	T166-Y168 PolarHBondContact O-N 2.96Å; Y168-G170 VanDerWaalsContact C-N 3.34Å; Y168-L171 HydrophobicContact CD1-CB 4.4Å; Y168-L171 HydrophobicContact CD1-CD1 3.73Å; Y168-L171 HydrophobicContact CE1-CD1 3.94Å; Y168-L171 PolarHBondContact O-N 3.28Å; Y168-L172 PolarHBondContact O-N 3.21Å
169	A	41.1	Very low	41.5	Very low	48 Å²	48	110.5 Å²	110.5	40%	0.397	64%	0.636	S	S	.	*	H	α-helix	trans	-67.2	-37.8	172.6	0	0	0	0	0	111.2	T166 L172 Y173	T166-A169 HydrophobicContact CG2-CB 3.95Å; T166-A169 PolarHBondContact O-N 2.04Å; A169-L172 PolarHBondContact O-N 3.12Å; A169-Y173 WeakPolarHBondContact O-CD2 2.96Å
170	G	38.9	Very low	42.3	Very low	59 Å²	59	109 Å²	109	61%	0.608	63%	0.627	S	S	*	*	H	α-helix	trans	-68.2	-36.2	174.6	0	0	0	0	0	113.6	Y168 L172	Y168-G170 VanDerWaalsContact C-N 3.34Å; G170-L172 VanDerWaalsContact C-N 3.35Å
171	L	40.1	Very low	43	Very low	96 Å²	96	110 Å²	110	50%	0.503	62%	0.619	S	S	.	*	H	α-helix	trans	-73	-26.4	175.7	-81.1	164	0	0	0	112.5	Y168 Y173 D174 V175	Y168-L171 HydrophobicContact CD1-CB 4.4Å; Y168-L171 HydrophobicContact CD1-CD1 3.73Å; Y168-L171 HydrophobicContact CE1-CD1 3.94Å; Y168-L171 PolarHBondContact O-N 3.28Å; L171-Y173 VanDerWaalsContact C-N 3.35Å; L171-D174 PolarHBondContact O-N 2.73Å; L171-V175 WeakPolarHBondContact O-CG2 3.14Å; L171-V175 PolarHBondContact O-N 3.32Å
172	L	41.6	Very low	43.6	Very low	126 Å²	126	110.9 Å²	110.9	66%	0.66	61%	0.614	S	S	*	*	H	α-helix	trans	-73.3	-26.5	178.1	-131.3	81.2	0	0	0	113.4	Y168 A169 G170 K176	Y168-L172 PolarHBondContact O-N 3.21Å; A169-L172 PolarHBondContact O-N 3.12Å; G170-L172 VanDerWaalsContact C-N 3.35Å; L172-K176 PolarHBondContact O-N 2.99Å
173	Y	48.7	Very low	44.4	Very low	188 Å²	188	113.2 Å²	113.2	74%	0.737	62%	0.617	S	S	*	*	H	α-helix	trans	-73.1	-33.8	173.2	-76.6	-76.8	0	0	0	111.8	A169 L171	A169-Y173 WeakPolarHBondContact O-CD2 2.96Å; L171-Y173 VanDerWaalsContact C-N 3.35Å
174	D	44.4	Very low	45	Very low	103 Å²	103	112.1 Å²	112.1	55%	0.551	60%	0.603	S	S	*	*	H	α-helix	trans	-75.1	-35.1	176.1	-144.6	-91.6	0	0	0	112.2	L171 K176 E177 L178	L171-D174 PolarHBondContact O-N 2.73Å; D174-K176 VanDerWaalsContact C-N 3.29Å; D174-K176 PolarHBondContact O-N 3.09Å; D174-E177 PolarHBondContact O-N 3.18Å; D174-L178 PolarHBondContact O-N 3.03Å
175	V	49.5	Very low	45.6	Very low	77 Å²	77	115.7 Å²	115.7	47%	0.467	61%	0.612	S	S	.	*	H	α-helix	trans	-69.8	-27.9	176.6	-179	0	0	0	0	111.7	L171 L178 S179	L171-V175 WeakPolarHBondContact O-CG2 3.14Å; L171-V175 PolarHBondContact O-N 3.32Å; V175-L178 PolarHBondContact O-N 2.8Å; V175-S179 WeakPolarHBondContact O-CB 3.48Å; V175-S179 PolarHBondContact O-N 3.29Å; V175-S179 PolarHBondContact O-OG 3.02Å
176	K	47	Very low	45.7	Very low	155 Å²	155	115.1 Å²	115.1	67%	0.674	62%	0.62	S	S	*	*	H	α-helix	trans	-74.3	-31.4	178.2	-162	164	179.7	176.9	0	112.6	L172 D174	L172-K176 PolarHBondContact O-N 2.99Å; D174-K176 VanDerWaalsContact C-N 3.29Å; D174-K176 PolarHBondContact O-N 3.09Å
177	E	46.8	Very low	45.3	Very low	129 Å²	129	119.4 Å²	119.4	60%	0.603	65%	0.652	S	S	*	*	H	α-helix	trans	-71.1	-42	168.2	-92.6	-82.8	110.6	0	0	111.3	D174 S179 L180 L181	D174-E177 PolarHBondContact O-N 3.18Å; E177-S179 VanDerWaalsContact C-N 3.3Å; E177-S179 PolarHBondContact O-N 3.23Å; E177-L180 PolarHBondContact O-N 2.72Å; E177-L181 PolarHBondContact O-N 3.05Å
178	L	45.2	Very low	45.4	Very low	94 Å²	94	117.8 Å²	117.8	49%	0.492	65%	0.652	S	S	.	*	H	α-helix	trans	-64.9	-31.6	176	-109.5	92.4	0	0	0	113.5	D174 V175 L180 L181 L182	D174-L178 PolarHBondContact O-N 3.03Å; V175-L178 PolarHBondContact O-N 2.8Å; L178-L180 VanDerWaalsContact C-N 3.31Å; L178-L180 PolarHBondContact O-N 2.93Å; L178-L181 PolarHBondContact O-N 2.68Å; L178-L182 PolarHBondContact O-N 3.1Å
179	S	50.3	Low	45.7	Very low	61 Å²	61	116.2 Å²	116.2	43%	0.427	66%	0.656	S	S	.	*	H	α-helix	trans	-70.8	-27.4	178.9	-58	0	0	0	0	112.7	V175 E177	V175-S179 WeakPolarHBondContact O-CB 3.48Å; V175-S179 PolarHBondContact O-N 3.29Å; V175-S179 PolarHBondContact O-OG 3.02Å; E177-S179 VanDerWaalsContact C-N 3.3Å; E177-S179 PolarHBondContact O-N 3.23Å
180	L	50.3	Low	46	Very low	119 Å²	119	120 Å²	120	62%	0.623	67%	0.67	S	S	*	*	H	α-helix	trans	-77.9	-33.9	176.4	-98.6	151.2	0	0	0	112	E177 L178	E177-L180 PolarHBondContact O-N 2.72Å; L178-L180 VanDerWaalsContact C-N 3.31Å; L178-L180 PolarHBondContact O-N 2.93Å
181	L	50.7	Low	46.4	Very low	112 Å²	112	123.6 Å²	123.6	59%	0.586	67%	0.674	S	S	*	*	H	α-helix	trans	-71	-36.1	175.7	-79.8	162	0	0	0	113	E177 L178 L183 S184	E177-L181 PolarHBondContact O-N 3.05Å; L178-L181 PolarHBondContact O-N 2.68Å; L181-L183 VanDerWaalsContact C-N 3.27Å; L181-L183 PolarHBondContact O-N 2.82Å; L181-S184 PolarHBondContact O-N 3.16Å; L181-S184 PolarHBondContact O-OG 3.03Å
182	L	49.1	Very low	46.8	Very low	135 Å²	135	125.3 Å²	125.3	71%	0.707	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-14.3	180	-70.7	172	0	0	0	114.2	L178	L178-L182 PolarHBondContact O-N 3.1Å
183	L	52.5	Low	47.2	Very low	154 Å²	154	125.3 Å²	125.3	81%	0.806	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-4.9	175.2	-80.4	163.9	0	0	0	113.7	L181	L181-L183 VanDerWaalsContact C-N 3.27Å; L181-L183 PolarHBondContact O-N 2.82Å
184	S	49.5	Very low	47.1	Very low	88 Å²	88	120.8 Å²	120.8	62%	0.615	68%	0.683	S	S	*	*	S	Bend	trans	-97.6	-11.5	175.9	54.5	0	0	0	0	115.2	L181	L181-S184 PolarHBondContact O-N 3.16Å; L181-S184 PolarHBondContact O-OG 3.03Å
185	E	48.5	Very low	47.3	Very low	182 Å²	182	122.2 Å²	122.2	85%	0.85	69%	0.693	S	S	*	*	S	Bend	trans	-119.9	63.3	179.7	-65.7	-169.7	118.8	0	0	111.5
186	G	42.4	Very low	47.1	Very low	70 Å²	70	125.9 Å²	125.9	72%	0.722	71%	0.711	S	S	*	*			trans	-154.2	81.2	175	0	0	0	0	0	111.6
187	C	32.6	Very low	47.1	Very low	212 Å²	212	123.3 Å²	123.3	100%	1.432	72%	0.715	S	S	*	*			trans	-56.1	0	163.7	-69.6	0	0	0	0	112.9

Retrieved 187 of 187 residues in 125.8 ms (Link to these results)

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