A0A3Q0KV33_SCHMA Loading...

Smp_203020

AlphaFold DB , UniProt , Accession A0A3Q0KV33, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 127 aa.

						>A0A3Q0KV33_SCHMA|A0A3Q0KV33
MNHKFKSVWSGVVNNFTNSPVSSTVVRPTNPVTMYYSPYLDPSRLRNKTIVSIFNQFNKTPLDKEAINQMPKCPAVPRTLRSLLAVQSRIVSQQLTKTCMNLNSNLCPWSTRDSFAAIGVRLSFGNY
					

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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	33.6	Very low	27.8	Very low	241 Å²	241	135.7 Å²	135.7	100%	1.187	69%	0.692	S	S	*	*				0	117.7	0	-73.7	176.3	-177	0	0	108.6
2	N	26.8	Very low	27.9	Very low	154 Å²	154	130.4 Å²	130.4	82%	0.824	67%	0.67	S	S	*	*			trans	-94.2	106	-174.9	-90.8	-22.9	0	0	0	110.2
3	H	24.5	Very low	28	Very low	170 Å²	170	125.2 Å²	125.2	79%	0.787	65%	0.648	S	S	*	*			trans	-142.1	90.6	157.3	-64.3	-63.8	0	0	0	109
4	K	23.9	Very low	28.1	Very low	200 Å²	200	123.1 Å²	123.1	87%	0.87	64%	0.639	S	S	*	*			trans	-103.3	113.9	167.4	-82.9	-171.9	-179.5	178.1	0	108.7
5	F	26	Very low	28.1	Very low	128 Å²	128	122.6 Å²	122.6	56%	0.561	64%	0.637	S	S	*	*			trans	-152.2	102	-177.9	-88.8	-39.9	0	0	0	108.4	V91	F5-V91 VanDerWaalsContact C-CG1 3.41Å; F5-V91 VanDerWaalsContact CA-CG1 3.49Å; F5-V91 HydrophobicContact CB-CB 4.5Å; F5-V91 HydrophobicContact CB-CG1 3.17Å; F5-V91 HydrophobicContact CD1-CB 4.24Å; F5-V91 HydrophobicContact CD1-CG1 3.67Å; F5-V91 HydrophobicContact CG-CG1 3.65Å
6	K	26.3	Very low	28.3	Very low	191 Å²	191	125.9 Å²	125.9	83%	0.83	65%	0.645	S	S	*	*			trans	-140.1	116.7	176.6	-160.6	176.4	-173.7	179.6	0	109.6
7	S	26.3	Very low	28.2	Very low	54 Å²	54	123.8 Å²	123.8	38%	0.378	64%	0.64	S	S	.	*			trans	-92.4	132.4	177.2	24.6	0	0	0	0	109.5
8	V	27.6	Very low	28.4	Very low	115 Å²	115	125.5 Å²	125.5	70%	0.697	65%	0.65	S	S	*	*			trans	-133.7	130.4	173.7	-175.3	0	0	0	0	108.3
9	W	30.8	Very low	28.5	Very low	108 Å²	108	122.9 Å²	122.9	41%	0.409	64%	0.644	S	S	.	*			trans	-112.7	147.7	-179	-41.8	86.5	0	0	0	108.5	Q87	W9-Q87 WeakPolarHBondContact CZ3-O 2.99Å
10	S	30.1	Very low	28.5	Very low	89 Å²	89	123.2 Å²	123.2	62%	0.622	65%	0.654	S	S	*	*			trans	-139.5	119.1	153.9	74.4	0	0	0	0	109.3
11	G	30.3	Very low	28.6	Very low	43 Å²	43	121.4 Å²	121.4	44%	0.443	65%	0.647	S	S	.	*			trans	-101.3	124.1	163	0	0	0	0	0	107.2	V13	G11-V13 PolarHBondContact O-N 3.19Å
12	V	29	Very low	28.3	Very low	72 Å²	72	114.5 Å²	114.5	44%	0.436	62%	0.622	S	S	.	*			trans	-89.9	104.6	174.5	-178	0	0	0	0	107.5	V21 I50	V12-V21 HydrophobicContact CG1-CG1 4.28Å; V12-I50 HydrophobicContact CB-CD1 4.38Å; V12-I50 HydrophobicContact CG1-CD1 4.08Å; V12-I50 HydrophobicContact CG2-CD1 4.18Å
13	V	28.6	Very low	28.5	Very low	63 Å²	63	111.8 Å²	111.8	38%	0.382	62%	0.616	S	S	.	*			trans	-97.8	108.9	163.6	-179.5	0	0	0	0	105.9	G11 M34	G11-V13 PolarHBondContact O-N 3.19Å; V13-M34 HydrophobicContact CG2-CB 4.39Å; V13-M34 HydrophobicContact CG2-CG 4.32Å
14	N	29.7	Very low	28.7	Very low	96 Å²	96	107.8 Å²	107.8	51%	0.513	60%	0.603	S	S	.	*			trans	-108.2	103.8	166	-139.5	22.7	0	0	0	107.7
15	N	28.4	Very low	29	Very low	115 Å²	115	102.6 Å²	102.6	62%	0.615	59%	0.588	S	S	*	*			trans	-66.2	146	153.3	-85.4	-12.6	0	0	0	107.3	T17	N15-T17 PolarHBondContact O-N 3.29Å
16	F	30.4	Very low	29.3	Very low	176 Å²	176	98.1 Å²	98.1	77%	0.772	57%	0.571	S	S	*	*	S	Bend	trans	-63.8	49	-174.2	-71	-97.1	0	0	0	114.9
17	T	27.3	Very low	29.3	Very low	89 Å²	89	97.1 Å²	97.1	55%	0.546	56%	0.562	S	S	.	*	S	Bend	trans	-125.1	142.5	176.2	56.9	0	0	0	0	109.1	N15 S19	N15-T17 PolarHBondContact O-N 3.29Å; T17-S19 PolarHBondContact O-N 3.15Å
18	N	32.1	Very low	29.4	Very low	155 Å²	155	101.1 Å²	101.1	83%	0.829	59%	0.587	S	S	*	*			trans	-67.9	35.2	-171.7	-75.4	-35.1	0	0	0	114.8
19	S	30.5	Very low	29.4	Very low	76 Å²	76	101.1 Å²	101.1	53%	0.531	59%	0.587	S	S	.	*			trans	-93.7	141	-175.8	-63.6	0	0	0	0	112.2	T17	T17-S19 PolarHBondContact O-N 3.15Å
20	P	28.5	Very low	29.4	Very low	129 Å²	129	101 Å²	101	84%	0.838	59%	0.594	S	S	*	*			trans	-61.9	137	175	23.5	-31.7	0	0	0	111.6	S22	P20-S22 PolarHBondContact O-N 3.27Å
21	V	29.4	Very low	29.2	Very low	86 Å²	86	102.7 Å²	102.7	52%	0.521	60%	0.603	S	S	.	*			trans	-74.3	115.6	-179.7	179.5	0	0	0	0	109.5	V12	V12-V21 HydrophobicContact CG1-CG1 4.28Å
22	S	28.9	Very low	29.2	Very low	95 Å²	95	103.9 Å²	103.9	66%	0.664	60%	0.602	S	S	*	*			trans	-88.7	126.3	167.2	178.3	0	0	0	0	109.6	P20 T24	P20-S22 PolarHBondContact O-N 3.27Å; S22-T24 PolarHBondContact O-N 3.17Å; S22-T24 VanDerWaalsContact O-N 3.14Å
23	S	30.4	Very low	29.2	Very low	98 Å²	98	105.2 Å²	105.2	69%	0.685	61%	0.61	S	S	*	*			trans	-71	103	170.5	56.4	0	0	0	0	109.5
24	T	29.3	Very low	29.3	Very low	85 Å²	85	107 Å²	107	52%	0.521	62%	0.616	S	S	.	*			trans	-85.3	122.7	174.5	-68.9	0	0	0	0	110.3	S22 V26	S22-T24 PolarHBondContact O-N 3.17Å; S22-T24 VanDerWaalsContact O-N 3.14Å; T24-V26 PolarHBondContact O-N 3.44Å; T24-V26 VanDerWaalsContact O-N 3.17Å
25	V	29.8	Very low	29.1	Very low	91 Å²	91	110.7 Å²	110.7	55%	0.552	62%	0.624	S	S	*	*			trans	-67.1	109	163.8	176.4	0	0	0	0	107.7	R27	V25-R27 HydrophobicContact CG1-CG 4.39Å; V25-R27 PolarHBondContact O-N 3.26Å; V25-R27 VanDerWaalsContact O-N 3.16Å
26	V	31.4	Very low	29.2	Very low	35 Å²	35	110.8 Å²	110.8	21%	0.212	62%	0.616	C	S	.	*			trans	-71.9	109	170.3	-176.8	0	0	0	0	107.6	T24 V32 M34	T24-V26 PolarHBondContact O-N 3.44Å; T24-V26 VanDerWaalsContact O-N 3.17Å; V26-V32 HydrophobicContact CG1-CB 4.41Å; V26-V32 HydrophobicContact CG1-CG2 4.09Å; V26-V32 HydrophobicContact CG2-CB 4.35Å; V26-V32 HydrophobicContact CG2-CG2 4.11Å; V26-M34 HydrophobicContact CG2-CE 3.85Å
27	R	26.8	Very low	29	Very low	170 Å²	170	105.1 Å²	105.1	64%	0.642	60%	0.599	S	S	*	*			trans	-82.2	144.3	171.8	-67.4	-175.5	-179.4	-175.5	0.6	108.9	V25 T29 N30	V25-R27 HydrophobicContact CG1-CG 4.39Å; V25-R27 PolarHBondContact O-N 3.26Å; V25-R27 VanDerWaalsContact O-N 3.16Å; R27-T29 PolarHBondContact O-N 3.18Å; R27-N30 PolarHBondContact O-N 2.95Å
28	P	27.9	Very low	29.3	Very low	138 Å²	138	104.3 Å²	104.3	90%	0.896	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-22.8	179	-23.7	32	0	0	0	114.3
29	T	28.7	Very low	29.1	Very low	114 Å²	114	106.5 Å²	106.5	70%	0.699	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-9.3	-178.5	57.1	0	0	0	0	114.2	R27	R27-T29 PolarHBondContact O-N 3.18Å
30	N	29.4	Very low	29.2	Very low	105 Å²	105	106.8 Å²	106.8	56%	0.561	59%	0.588	S	S	*	*	S	Bend	trans	-117.2	100.3	178.6	-84.2	2	0	0	0	109.2	R27 V32	R27-N30 PolarHBondContact O-N 2.95Å; N30-V32 PolarHBondContact O-N 3.13Å
31	P	27.1	Very low	29.7	Very low	125 Å²	125	104.3 Å²	104.3	81%	0.812	57%	0.568	S	S	*	*			trans	-62.4	102.4	168.5	24.2	-29.8	0	0	0	108.6	T33	P31-T33 PolarHBondContact O-N 3.23Å
32	V	30.2	Very low	30.1	Very low	69 Å²	69	104.4 Å²	104.4	42%	0.418	57%	0.57	S	S	.	*			trans	-85.2	111.3	171.2	178.3	0	0	0	0	107.2	V26 N30 M34	V26-V32 HydrophobicContact CG1-CB 4.41Å; V26-V32 HydrophobicContact CG1-CG2 4.09Å; V26-V32 HydrophobicContact CG2-CB 4.35Å; V26-V32 HydrophobicContact CG2-CG2 4.11Å; N30-V32 PolarHBondContact O-N 3.13Å; V32-M34 HydrophobicContact CG1-CG 4.28Å; V32-M34 PolarHBondContact O-N 3.13Å; V32-M34 VanDerWaalsContact O-N 3.09Å
33	T	29	Very low	30.7	Very low	99 Å²	99	104.5 Å²	104.5	61%	0.607	57%	0.571	S	S	*	*			trans	-63.1	107.3	167.9	-50.7	0	0	0	0	108.5	P31 Y35	P31-T33 PolarHBondContact O-N 3.23Å; T33-Y35 HydrophobicContact CG2-CD2 4.14Å; T33-Y35 HydrophobicContact CG2-CE1 4.31Å; T33-Y35 HydrophobicContact CG2-CE2 3.55Å
34	M	29.4	Very low	31.2	Very low	100 Å²	100	108 Å²	108	49%	0.493	57%	0.569	S	S	.	*			trans	-94.2	120.3	171.4	-67.7	-174.9	-150.5	0	0	109.4	V13 V26 V32	V13-M34 HydrophobicContact CG2-CB 4.39Å; V13-M34 HydrophobicContact CG2-CG 4.32Å; V26-M34 HydrophobicContact CG2-CE 3.85Å; V32-M34 HydrophobicContact CG1-CG 4.28Å; V32-M34 PolarHBondContact O-N 3.13Å; V32-M34 VanDerWaalsContact O-N 3.09Å
35	Y	27.1	Very low	31.7	Very low	175 Å²	175	105.5 Å²	105.5	69%	0.686	55%	0.552	S	S	*	*			trans	-93	127.7	170.8	-64.8	-87.5	0	0	0	109	T33	T33-Y35 HydrophobicContact CG2-CD2 4.14Å; T33-Y35 HydrophobicContact CG2-CE1 4.31Å; T33-Y35 HydrophobicContact CG2-CE2 3.55Å
36	Y	29.6	Very low	32.2	Very low	116 Å²	116	112 Å²	112	46%	0.455	57%	0.567	S	S	.	*			trans	-113.9	135.4	172.1	173.3	-91	0	0	0	110.6	P38 L83	Y36-P38 VanDerWaalsContact CE1-CA 3.45Å; Y36-P38 HydrophobicContact CE1-CB 3.82Å; Y36-L83 HydrophobicContact CD1-CB 3.26Å; Y36-L83 HydrophobicContact CD1-CD2 4.22Å; Y36-L83 HydrophobicContact CD1-CG 4.25Å; Y36-L83 HydrophobicContact CE1-CB 3.47Å; Y36-L83 VanDerWaalsContact CE1-CB 3.47Å; Y36-L83 HydrophobicContact CE1-CD1 4.35Å; Y36-L83 HydrophobicContact CE1-CD2 3.54Å; Y36-L83 HydrophobicContact CE1-CG 3.95Å; Y36-L83 HydrophobicContact CG-CB 4.25Å
37	S	27.2	Very low	32.5	Very low	58 Å²	58	114 Å²	114	41%	0.406	58%	0.576	S	S	.	*			trans	-108.6	119.3	174.5	-179.7	0	0	0	0	110.4	Y39	S37-Y39 PolarHBondContact O-N 3.3Å
38	P	32.5	Very low	32.8	Very low	72 Å²	72	114.8 Å²	114.8	47%	0.468	58%	0.584	S	S	.	*	S	Bend	trans	-76.6	10.9	-176.8	27.9	-32.5	0	0	0	116.1	Y36 L83	Y36-P38 VanDerWaalsContact CE1-CA 3.45Å; Y36-P38 HydrophobicContact CE1-CB 3.82Å; P38-L83 HydrophobicContact CB-CD1 4.19Å
39	Y	27.7	Very low	33	Very low	201 Å²	201	112.3 Å²	112.3	79%	0.788	57%	0.567	S	S	*	*			trans	-119.4	41.9	-175	-72.2	-79.6	0	0	0	113.7	S37 D41	S37-Y39 PolarHBondContact O-N 3.3Å; Y39-D41 PolarHBondContact O-N 3.22Å
40	L	33.2	Very low	33.3	Very low	81 Å²	81	108.8 Å²	108.8	42%	0.424	54%	0.543	S	S	.	.			trans	-88.4	96	172.5	-74.6	163.3	0	0	0	109.7	P42 L45	L40-P42 WeakPolarHBondContact O-CD 3.48Å; L40-L45 HydrophobicContact CB-CD2 4.22Å; L40-L45 HydrophobicContact CD1-CD2 4.07Å; L40-L45 HydrophobicContact CD2-CD2 4.26Å; L40-L45 HydrophobicContact CG-CD2 4.42Å
41	D	37.8	Very low	33.4	Very low	78 Å²	78	105.6 Å²	105.6	42%	0.417	53%	0.528	S	S	.	.			trans	-48.2	122.8	157	175	-5.5	0	0	0	108.4	Y39 S43 R44	Y39-D41 PolarHBondContact O-N 3.22Å; D41-S43 PolarHBondContact O-N 3.11Å; D41-S43 WeakPolarHBondContact OD1-CB 3.27Å; D41-S43 PolarHBondContact OD1-N 3.06Å; D41-S43 PolarHBondContact OD1-OG 2.62Å; D41-S43 PolarHBondContact OD2-OG 3.21Å; D41-R44 HydrophobicContact CB-CG 4.01Å; D41-R44 WeakPolarHBondContact O-CA 3.28Å; D41-R44 WeakPolarHBondContact O-CB 3.34Å; D41-R44 PolarHBondContact O-N 3.36Å
42	P	38.3	Very low	33.8	Very low	88 Å²	88	102.2 Å²	102.2	57%	0.571	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-52	-27.7	177.6	-26	33.5	0	0	0	113.3	L40 R44 L45	L40-P42 WeakPolarHBondContact O-CD 3.48Å; P42-R44 PolarHBondContact O-N 3.43Å; P42-L45 PolarHBondContact O-N 3.47Å
43	S	42.3	Very low	34.1	Very low	96 Å²	96	102.7 Å²	102.7	67%	0.671	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-64.5	-21.7	174.7	84.6	0	0	0	0	113.4	D41	D41-S43 PolarHBondContact O-N 3.11Å; D41-S43 WeakPolarHBondContact OD1-CB 3.27Å; D41-S43 PolarHBondContact OD1-N 3.06Å; D41-S43 PolarHBondContact OD1-OG 2.62Å; D41-S43 PolarHBondContact OD2-OG 3.21Å
44	R	40.2	Very low	34.4	Very low	173 Å²	173	103 Å²	103	65%	0.653	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-92.8	-7.5	-179.8	-62.4	-173.4	173.4	-156.2	-4.2	113.3	D41 P42 R46	D41-R44 HydrophobicContact CB-CG 4.01Å; D41-R44 WeakPolarHBondContact O-CA 3.28Å; D41-R44 WeakPolarHBondContact O-CB 3.34Å; D41-R44 PolarHBondContact O-N 3.36Å; P42-R44 PolarHBondContact O-N 3.43Å; R44-R46 PolarHBondContact O-N 3.48Å; R44-R46 VanDerWaalsContact O-N 3.15Å
45	L	40.8	Very low	34.7	Very low	31 Å²	31	102 Å²	102	16%	0.162	50%	0.496	C	S	.	.			trans	-78.8	94.7	173.9	-63.5	175.4	0	0	0	109.4	L40 P42 N47 I50 V51 F54	L40-L45 HydrophobicContact CB-CD2 4.22Å; L40-L45 HydrophobicContact CD1-CD2 4.07Å; L40-L45 HydrophobicContact CD2-CD2 4.26Å; L40-L45 HydrophobicContact CG-CD2 4.42Å; P42-L45 PolarHBondContact O-N 3.47Å; L45-N47 PolarHBondContact O-N 3.24Å; L45-N47 VanDerWaalsContact O-N 3.16Å; L45-I50 HydrophobicContact CD1-CG2 4.21Å; L45-I50 HydrophobicContact CD2-CG2 4.1Å; L45-V51 HydrophobicContact CB-CG2 3.56Å; L45-V51 HydrophobicContact CD1-CG2 4.15Å; L45-F54 HydrophobicContact CD1-CD2 4.26Å
46	R	38.9	Very low	35.2	Very low	228 Å²	228	100 Å²	100	86%	0.86	49%	0.493	S	S	*	.			trans	-67.7	-11.7	-179.1	-62.6	-170.1	-170.2	-167.2	4.5	114.4	R44	R44-R46 PolarHBondContact O-N 3.48Å; R44-R46 VanDerWaalsContact O-N 3.15Å
47	N	38.9	Very low	35.5	Very low	77 Å²	77	99.8 Å²	99.8	41%	0.412	49%	0.494	S	S	.	.			trans	-103.3	111.6	-176.3	-168.1	-23.4	0	0	0	111	L45 T49 I50 V51	L45-N47 PolarHBondContact O-N 3.24Å; L45-N47 VanDerWaalsContact O-N 3.16Å; N47-T49 PolarHBondContact O-N 3.17Å; N47-T49 VanDerWaalsContact O-N 3.13Å; N47-T49 WeakPolarHBondContact OD1-CB 3.45Å; N47-T49 PolarHBondContact OD1-N 3.43Å; N47-T49 PolarHBondContact OD1-OG1 3.34Å; N47-I50 HydrophobicContact CB-CB 4.23Å; N47-I50 HydrophobicContact CB-CD1 3.8Å; N47-I50 HydrophobicContact CB-CG1 3.86Å; N47-I50 PolarHBondContact O-N 2.91Å; N47-V51 PolarHBondContact O-N 3.08Å; N47-V51 VanDerWaalsContact O-N 3.12Å
48	K	32.8	Very low	35.9	Very low	187 Å²	187	103.8 Å²	103.8	81%	0.813	51%	0.511	S	S	*	.	H	α-helix	trans	-54.7	-30.3	178.2	-68.5	-175.1	178.3	-179.2	0	112.9	S52	K48-S52 WeakPolarHBondContact O-CB 3.4Å; K48-S52 PolarHBondContact O-N 3.09Å
49	T	33.2	Very low	35.9	Very low	86 Å²	86	108.6 Å²	108.6	53%	0.528	53%	0.525	S	S	.	.	H	α-helix	trans	-69.8	-38.8	176.8	-51.5	0	0	0	0	111.8	N47 S52 I53	N47-T49 PolarHBondContact O-N 3.17Å; N47-T49 VanDerWaalsContact O-N 3.13Å; N47-T49 WeakPolarHBondContact OD1-CB 3.45Å; N47-T49 PolarHBondContact OD1-N 3.43Å; N47-T49 PolarHBondContact OD1-OG1 3.34Å; T49-S52 PolarHBondContact O-N 3.49Å; T49-S52 PolarHBondContact O-OG 3.07Å; T49-I53 HydrophobicContact CG2-CD1 4.18Å; T49-I53 WeakPolarHBondContact O-CD1 3.39Å; T49-I53 VanDerWaalsContact O-CG1 3.25Å; T49-I53 WeakPolarHBondContact O-CG1 3.35Å; T49-I53 PolarHBondContact O-N 3.49Å; T49-I53 VanDerWaalsContact O-N 3.13Å
50	I	33.3	Very low	36.3	Very low	39 Å²	39	103 Å²	103	20%	0.2	51%	0.511	C	S	.	.	H	α-helix	trans	-68	-44.6	176.9	-61.3	179.1	0	0	0	109.3	V12 L45 N47 S52 I53 F54	V12-I50 HydrophobicContact CB-CD1 4.38Å; V12-I50 HydrophobicContact CG1-CD1 4.08Å; V12-I50 HydrophobicContact CG2-CD1 4.18Å; L45-I50 HydrophobicContact CD1-CG2 4.21Å; L45-I50 HydrophobicContact CD2-CG2 4.1Å; N47-I50 HydrophobicContact CB-CB 4.23Å; N47-I50 HydrophobicContact CB-CD1 3.8Å; N47-I50 HydrophobicContact CB-CG1 3.86Å; N47-I50 PolarHBondContact O-N 2.91Å; I50-S52 VanDerWaalsContact C-N 3.34Å; I50-S52 PolarHBondContact O-N 3.15Å; I50-I53 PolarHBondContact O-N 2.94Å; I50-F54 HydrophobicContact CG2-CD2 3.7Å; I50-F54 HydrophobicContact CG2-CE2 3.75Å; I50-F54 VanDerWaalsContact O-CD2 3.32Å; I50-F54 WeakPolarHBondContact O-CD2 3.5Å; I50-F54 PolarHBondContact O-N 3.47Å
51	V	33	Very low	36.5	Very low	39 Å²	39	104.5 Å²	104.5	24%	0.236	53%	0.526	C	S	.	.	H	α-helix	trans	-61.2	-39.7	176.3	178	0	0	0	0	112	L45 N47 N55	L45-V51 HydrophobicContact CB-CG2 3.56Å; L45-V51 HydrophobicContact CD1-CG2 4.15Å; N47-V51 PolarHBondContact O-N 3.08Å; N47-V51 VanDerWaalsContact O-N 3.12Å; V51-N55 WeakPolarHBondContact CG1-ND2 3.45Å; V51-N55 VanDerWaalsContact O-CB 3.24Å; V51-N55 WeakPolarHBondContact O-CB 3.37Å; V51-N55 VanDerWaalsContact O-CG 3.22Å; V51-N55 PolarHBondContact O-N 3.17Å; V51-N55 PolarHBondContact O-ND2 3.06Å
52	S	34.5	Very low	36.6	Very low	54 Å²	54	105.3 Å²	105.3	38%	0.378	53%	0.53	S	S	.	.	H	α-helix	trans	-68.7	-38.5	179.4	89.2	0	0	0	0	112.5	K48 T49 I50 N55 Q56	K48-S52 WeakPolarHBondContact O-CB 3.4Å; K48-S52 PolarHBondContact O-N 3.09Å; T49-S52 PolarHBondContact O-N 3.49Å; T49-S52 PolarHBondContact O-OG 3.07Å; I50-S52 VanDerWaalsContact C-N 3.34Å; I50-S52 PolarHBondContact O-N 3.15Å; S52-N55 PolarHBondContact O-N 3.29Å; S52-Q56 WeakPolarHBondContact O-CG 3.43Å; S52-Q56 PolarHBondContact O-N 3.15Å
53	I	37.8	Very low	36.6	Very low	79 Å²	79	105.6 Å²	105.6	41%	0.405	53%	0.527	S	S	.	.	H	α-helix	trans	-63.5	-49.9	175.2	-68.8	166.9	0	0	0	110	T49 I50 N55 Q56 F57	T49-I53 HydrophobicContact CG2-CD1 4.18Å; T49-I53 WeakPolarHBondContact O-CD1 3.39Å; T49-I53 VanDerWaalsContact O-CG1 3.25Å; T49-I53 WeakPolarHBondContact O-CG1 3.35Å; T49-I53 PolarHBondContact O-N 3.49Å; T49-I53 VanDerWaalsContact O-N 3.13Å; I50-I53 PolarHBondContact O-N 2.94Å; I53-N55 VanDerWaalsContact C-N 3.33Å; I53-N55 PolarHBondContact O-N 3.21Å; I53-Q56 PolarHBondContact O-N 3.34Å; I53-F57 HydrophobicContact CG2-CD2 3.89Å; I53-F57 HydrophobicContact CG2-CE2 3.48Å; I53-F57 VanDerWaalsContact CG2-CE2 3.48Å; I53-F57 WeakPolarHBondContact O-CD2 3.42Å; I53-F57 PolarHBondContact O-N 3.36Å; I53-F57 VanDerWaalsContact O-N 3.17Å
54	F	34.9	Very low	36.5	Very low	106 Å²	106	109 Å²	109	47%	0.465	53%	0.53	S	S	.	.	H	α-helix	trans	-59.7	-41.6	175.9	-88.4	-79.4	0	0	0	112.2	L45 I50 Q56 F57 N58	L45-F54 HydrophobicContact CD1-CD2 4.26Å; I50-F54 HydrophobicContact CG2-CD2 3.7Å; I50-F54 HydrophobicContact CG2-CE2 3.75Å; I50-F54 VanDerWaalsContact O-CD2 3.32Å; I50-F54 WeakPolarHBondContact O-CD2 3.5Å; I50-F54 PolarHBondContact O-N 3.47Å; F54-Q56 VanDerWaalsContact C-N 3.33Å; F54-Q56 PolarHBondContact O-N 3.45Å; F54-F57 PolarHBondContact O-N 2.93Å; F54-N58 WeakPolarHBondContact O-CB 3.33Å; F54-N58 PolarHBondContact O-N 2.94Å
55	N	35.5	Very low	36.4	Very low	78 Å²	78	107.1 Å²	107.1	42%	0.417	53%	0.528	S	S	.	.	H	α-helix	trans	-68.8	-27.1	177.7	-77.6	-19.5	0	0	0	113.7	V51 S52 I53 K59	V51-N55 WeakPolarHBondContact CG1-ND2 3.45Å; V51-N55 VanDerWaalsContact O-CB 3.24Å; V51-N55 WeakPolarHBondContact O-CB 3.37Å; V51-N55 VanDerWaalsContact O-CG 3.22Å; V51-N55 PolarHBondContact O-N 3.17Å; V51-N55 PolarHBondContact O-ND2 3.06Å; S52-N55 PolarHBondContact O-N 3.29Å; I53-N55 VanDerWaalsContact C-N 3.33Å; I53-N55 PolarHBondContact O-N 3.21Å; N55-K59 VanDerWaalsContact O-CG 3.24Å; N55-K59 WeakPolarHBondContact O-CG 3.08Å; N55-K59 PolarHBondContact O-N 3.34Å
56	Q	36.3	Very low	36.4	Very low	134 Å²	134	106.7 Å²	106.7	63%	0.626	53%	0.529	S	S	*	.	H	α-helix	trans	-72.5	-40.3	173.7	-78.1	180	8	0	0	111.6	S52 I53 F54 N58 K59 T60	S52-Q56 WeakPolarHBondContact O-CG 3.43Å; S52-Q56 PolarHBondContact O-N 3.15Å; I53-Q56 PolarHBondContact O-N 3.34Å; F54-Q56 VanDerWaalsContact C-N 3.33Å; F54-Q56 PolarHBondContact O-N 3.45Å; Q56-N58 VanDerWaalsContact C-N 3.32Å; Q56-N58 PolarHBondContact O-N 3.43Å; Q56-K59 PolarHBondContact O-N 3.45Å; Q56-T60 PolarHBondContact O-OG1 3.08Å
57	F	35.8	Very low	36.4	Very low	110 Å²	110	99.3 Å²	99.3	48%	0.482	51%	0.506	S	S	.	.	H	α-helix	trans	-64	-38	173.2	-72.9	-64.6	0	0	0	112	I53 F54 K59 I118 V120	I53-F57 HydrophobicContact CG2-CD2 3.89Å; I53-F57 HydrophobicContact CG2-CE2 3.48Å; I53-F57 VanDerWaalsContact CG2-CE2 3.48Å; I53-F57 WeakPolarHBondContact O-CD2 3.42Å; I53-F57 PolarHBondContact O-N 3.36Å; I53-F57 VanDerWaalsContact O-N 3.17Å; F54-F57 PolarHBondContact O-N 2.93Å; F57-K59 VanDerWaalsContact C-N 3.25Å; F57-K59 PolarHBondContact O-N 3.37Å; F57-I118 HydrophobicContact CD1-CG2 4.27Å; F57-I118 HydrophobicContact CE1-CG2 3.9Å; F57-V120 HydrophobicContact CE1-CG2 4.33Å
58	N	35.6	Very low	36.7	Very low	142 Å²	142	102.1 Å²	102.1	76%	0.759	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-14.3	-178.9	-142	22.3	0	0	0	114.2	F54 Q56	F54-N58 WeakPolarHBondContact O-CB 3.33Å; F54-N58 PolarHBondContact O-N 2.94Å; Q56-N58 VanDerWaalsContact C-N 3.32Å; Q56-N58 PolarHBondContact O-N 3.43Å
59	K	32.7	Very low	37.2	Very low	174 Å²	174	100 Å²	100	76%	0.757	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-11.7	-177.5	-79.5	179.3	179.6	-171.3	0	114.3	N55 Q56 F57 P61	N55-K59 VanDerWaalsContact O-CG 3.24Å; N55-K59 WeakPolarHBondContact O-CG 3.08Å; N55-K59 PolarHBondContact O-N 3.34Å; Q56-K59 PolarHBondContact O-N 3.45Å; F57-K59 VanDerWaalsContact C-N 3.25Å; F57-K59 PolarHBondContact O-N 3.37Å; K59-P61 WeakPolarHBondContact O-CD 3.46Å
60	T	36.5	Very low	37.7	Very low	82 Å²	82	97.2 Å²	97.2	50%	0.503	50%	0.495	S	S	.	.	S	Bend	trans	-94.4	109.6	175.5	-48.6	0	0	0	0	106.8	Q56 L62	Q56-T60 PolarHBondContact O-OG1 3.08Å; T60-L62 PolarHBondContact O-N 3.26Å; T60-L62 VanDerWaalsContact O-N 3.08Å
61	P	36.8	Very low	38.3	Very low	113 Å²	113	98.4 Å²	98.4	73%	0.734	51%	0.506	S	S	*	.			trans	-56	124.1	175.5	21.8	-30.3	0	0	0	107.7	K59 D63	K59-P61 WeakPolarHBondContact O-CD 3.46Å; P61-D63 PolarHBondContact O-N 3.29Å; P61-D63 VanDerWaalsContact O-N 3.09Å
62	L	40.5	Very low	39.3	Very low	95 Å²	95	106.4 Å²	106.4	50%	0.497	54%	0.538	S	S	.	.			trans	-53.4	121.8	169.1	-71.6	162.6	0	0	0	106.8	T60 K64 I67 A117	T60-L62 PolarHBondContact O-N 3.26Å; T60-L62 VanDerWaalsContact O-N 3.08Å; L62-K64 PolarHBondContact O-N 2.96Å; L62-I67 HydrophobicContact CB-CD1 3.55Å; L62-I67 HydrophobicContact CD1-CD1 4.17Å; L62-I67 HydrophobicContact CG-CD1 4.32Å; L62-A117 VanDerWaalsContact CD2-O 3.27Å; L62-A117 WeakPolarHBondContact CD2-O 3.41Å
63	D	39.3	Very low	39.8	Very low	94 Å²	94	105.4 Å²	105.4	50%	0.503	53%	0.53	S	S	.	.			trans	-61.1	105.5	177.2	-178	-16.1	0	0	0	107.7	P61 E65 A66 I67	P61-D63 PolarHBondContact O-N 3.29Å; P61-D63 VanDerWaalsContact O-N 3.09Å; D63-E65 PolarHBondContact O-N 2.94Å; D63-E65 WeakPolarHBondContact OD1-CA 3.31Å; D63-E65 VanDerWaalsContact OD1-CB 3.27Å; D63-E65 WeakPolarHBondContact OD1-CB 3Å; D63-E65 PolarHBondContact OD1-N 2.93Å; D63-A66 HydrophobicContact CB-CB 3.75Å; D63-A66 WeakPolarHBondContact O-CB 3.23Å; D63-A66 PolarHBondContact O-N 3.27Å; D63-A66 VanDerWaalsContact O-N 3.13Å; D63-A66 PolarHBondContact OD1-N 2.88Å; D63-I67 PolarHBondContact O-N 2.74Å
64	K	38.8	Very low	40.2	Very low	168 Å²	168	105 Å²	105	73%	0.73	53%	0.532	S	S	*	.	H	α-helix	trans	-61	-31	-177.2	-68.6	-177.7	178.9	178.5	0	110.9	L62 I67 N68	L62-K64 PolarHBondContact O-N 2.96Å; K64-I67 PolarHBondContact O-N 3Å; K64-N68 WeakPolarHBondContact O-CB 3.47Å; K64-N68 PolarHBondContact O-N 3.24Å; K64-N68 PolarHBondContact O-ND2 3.37Å; K64-N68 VanDerWaalsContact O-ND2 3.15Å
65	E	37.8	Very low	40.5	Very low	133 Å²	133	104.4 Å²	104.4	62%	0.621	55%	0.547	S	S	*	.	H	α-helix	trans	-71.2	-43	177.4	-159.9	174.6	170.7	0	0	110.4	D63 I67 N68 Q69	D63-E65 PolarHBondContact O-N 2.94Å; D63-E65 WeakPolarHBondContact OD1-CA 3.31Å; D63-E65 VanDerWaalsContact OD1-CB 3.27Å; D63-E65 WeakPolarHBondContact OD1-CB 3Å; D63-E65 PolarHBondContact OD1-N 2.93Å; E65-I67 VanDerWaalsContact C-N 3.34Å; E65-I67 PolarHBondContact O-N 3.48Å; E65-N68 PolarHBondContact O-N 3.49Å; E65-Q69 WeakPolarHBondContact O-CG 3.4Å; E65-Q69 PolarHBondContact O-N 2.89Å; E65-Q69 VanDerWaalsContact O-N 3.17Å
66	A	40.8	Very low	40.8	Very low	23 Å²	23	102.6 Å²	102.6	19%	0.19	54%	0.539	C	S	.	.	H	α-helix	trans	-59.9	-43.3	172.3	0	0	0	0	0	111.7	D63 N68 Q69 M70	D63-A66 HydrophobicContact CB-CB 3.75Å; D63-A66 WeakPolarHBondContact O-CB 3.23Å; D63-A66 PolarHBondContact O-N 3.27Å; D63-A66 VanDerWaalsContact O-N 3.13Å; D63-A66 PolarHBondContact OD1-N 2.88Å; A66-N68 VanDerWaalsContact C-N 3.34Å; A66-N68 PolarHBondContact O-N 3.32Å; A66-Q69 PolarHBondContact O-N 3.36Å; A66-M70 HydrophobicContact CB-CE 4.39Å; A66-M70 WeakPolarHBondContact O-CE 3.35Å; A66-M70 WeakPolarHBondContact O-CG 3.29Å; A66-M70 PolarHBondContact O-N 3.49Å
67	I	39.9	Very low	40.7	Very low	73 Å²	73	100.2 Å²	100.2	37%	0.374	54%	0.535	S	S	.	.	H	α-helix	trans	-59.4	-44.5	176.9	-69.7	168	0	0	0	111.6	L62 D63 K64 E65 Q69 M70	L62-I67 HydrophobicContact CB-CD1 3.55Å; L62-I67 HydrophobicContact CD1-CD1 4.17Å; L62-I67 HydrophobicContact CG-CD1 4.32Å; D63-I67 PolarHBondContact O-N 2.74Å; K64-I67 PolarHBondContact O-N 3Å; E65-I67 VanDerWaalsContact C-N 3.34Å; E65-I67 PolarHBondContact O-N 3.48Å; I67-Q69 PolarHBondContact O-N 3.17Å; I67-M70 HydrophobicContact CB-CE 4.37Å; I67-M70 HydrophobicContact CB-SD 4.5Å; I67-M70 HydrophobicContact CG1-CE 3.97Å; I67-M70 HydrophobicContact CG1-SD 4.39Å; I67-M70 WeakPolarHBondContact O-CB 3.04Å; I67-M70 PolarHBondContact O-N 3.33Å; I67-M70 VanDerWaalsContact O-N 3.15Å
68	N	44.2	Very low	40.7	Very low	136 Å²	136	106 Å²	106	73%	0.727	55%	0.554	S	S	*	*	H	α-helix	trans	-68.7	-22.1	-178.3	-70.2	-23.7	0	0	0	112.9	K64 E65 A66	K64-N68 WeakPolarHBondContact O-CB 3.47Å; K64-N68 PolarHBondContact O-N 3.24Å; K64-N68 PolarHBondContact O-ND2 3.37Å; K64-N68 VanDerWaalsContact O-ND2 3.15Å; E65-N68 PolarHBondContact O-N 3.49Å; A66-N68 VanDerWaalsContact C-N 3.34Å; A66-N68 PolarHBondContact O-N 3.32Å
69	Q	43.8	Very low	40.6	Very low	141 Å²	141	105.1 Å²	105.1	66%	0.659	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-4	176.1	-67	176.4	14.1	0	0	113.3	E65 A66 I67	E65-Q69 WeakPolarHBondContact O-CG 3.4Å; E65-Q69 PolarHBondContact O-N 2.89Å; E65-Q69 VanDerWaalsContact O-N 3.17Å; A66-Q69 PolarHBondContact O-N 3.36Å; I67-Q69 PolarHBondContact O-N 3.17Å
70	M	43.2	Very low	40.6	Very low	28 Å²	28	102 Å²	102	14%	0.138	55%	0.545	C	S	.	.	S	Bend	trans	-70.2	140.7	-179.3	-74.1	165.2	-159	0	0	111.9	A66 I67 K72 W109 A117	A66-M70 HydrophobicContact CB-CE 4.39Å; A66-M70 WeakPolarHBondContact O-CE 3.35Å; A66-M70 WeakPolarHBondContact O-CG 3.29Å; A66-M70 PolarHBondContact O-N 3.49Å; I67-M70 HydrophobicContact CB-CE 4.37Å; I67-M70 HydrophobicContact CB-SD 4.5Å; I67-M70 HydrophobicContact CG1-CE 3.97Å; I67-M70 HydrophobicContact CG1-SD 4.39Å; I67-M70 WeakPolarHBondContact O-CB 3.04Å; I67-M70 PolarHBondContact O-N 3.33Å; I67-M70 VanDerWaalsContact O-N 3.15Å; M70-K72 PolarHBondContact O-N 2.03Å; M70-W109 HydrophobicContact CB-CH2 4.18Å; M70-W109 HydrophobicContact CB-CZ2 3.75Å; M70-W109 HydrophobicContact CG-CH2 4.08Å; M70-W109 HydrophobicContact CG-CZ2 4.11Å; M70-W109 HydrophobicContact SD-CH2 3.37Å; M70-W109 WeakPolarHBondContact SD-CH2 3.32Å; M70-W109 HydrophobicContact SD-CZ2 3.95Å; M70-W109 HydrophobicContact SD-CZ3 4.03Å; M70-A117 HydrophobicContact CE-CB 3.31Å; M70-A117 HydrophobicContact SD-CB 3.45Å; M70-A117 WeakPolarHBondContact SD-CB 3.24Å
71	P	47.3	Very low	40.1	Very low	65 Å²	65	108.3 Å²	108.3	42%	0.422	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-55.8	131	170.9	-20.8	30.5	0	0	0	110.2	C73 W109	P71-C73 PolarHBondContact O-N 3.48Å; P71-W109 PolarHBondContact O-NE1 3.18Å
72	K	52.5	Low	39.7	Very low	207 Å²	207	107.2 Å²	107.2	90%	0.9	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-55.4	129.8	175.5	-72	-175.2	-179.6	178.3	0	109.5	M70	M70-K72 PolarHBondContact O-N 2.03Å
73	C	46.4	Very low	39.2	Very low	32 Å²	32	107 Å²	107	22%	0.216	55%	0.554	C	S	.	*	P	Polyproline II helix	trans	-70.7	132.5	177.7	-152.5	0	0	0	0	109.9	P71 N105 L106 C107	P71-C73 PolarHBondContact O-N 3.48Å; C73-N105 HydrophobicContact CB-CB 3.69Å; C73-N105 WeakPolarHBondContact SG-CB 3.18Å; C73-N105 PolarHBondContact SG-O 3.44Å; C73-N105 VanDerWaalsContact SG-O 3.33Å; C73-L106 PolarHBondContact SG-O 3.15Å; C73-C107 HydrophobicContact CB-CB 4.06Å; C73-C107 WeakPolarHBondContact CB-SG 3.27Å; C73-C107 WeakPolarHBondContact SG-CA 3.14Å; C73-C107 WeakPolarHBondContact SG-CB 3.02Å; C73-C107 PolarHBondContact SG-N 3.37Å; C73-C107 CovalentContact SG-SG 2.03Å; C73-C107 PolarHBondContact SG-SG 3.37Å
74	P	46.7	Very low	38.9	Very low	70 Å²	70	106.7 Å²	106.7	46%	0.455	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-61.8	140.4	171.7	24.9	-30.7	0	0	0	109.9	V76 P108	P74-V76 PolarHBondContact O-N 3.03Å; P74-P108 HydrophobicContact CG-CG 4.43Å
75	A	40.9	Very low	38.6	Very low	95 Å²	95	103.2 Å²	103.2	79%	0.785	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-64.9	124.2	178.4	0	0	0	0	0	110.1
76	V	40.4	Very low	38.4	Very low	39 Å²	39	99.1 Å²	99.1	24%	0.236	54%	0.538	C	S	.	.	P	Polyproline II helix	trans	-102.7	139.5	174.9	-175.9	0	0	0	0	109.3	P74 R78 L80 N105 L106	P74-V76 PolarHBondContact O-N 3.03Å; V76-R78 PolarHBondContact O-N 3.44Å; V76-L80 HydrophobicContact CG1-CB 4.26Å; V76-L80 HydrophobicContact CG1-CD1 3.97Å; V76-N105 PolarHBondContact N-OD1 3.27Å; V76-L106 HydrophobicContact CG2-CB 3.95Å; V76-L106 VanDerWaalsContact CG2-N 3.33Å
77	P	36	Very low	38.1	Very low	85 Å²	85	105.7 Å²	105.7	55%	0.552	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-52.8	132.7	175.2	-27.1	35	0	0	0	112.2	T79 L80	P77-T79 PolarHBondContact O-N 3.19Å; P77-L80 PolarHBondContact O-N 2.94Å; P77-L80 VanDerWaalsContact O-N 3.15Å
78	R	35.7	Very low	37.6	Very low	230 Å²	230	102.8 Å²	102.8	87%	0.868	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	-10.2	-176.6	-71.5	-177.4	174.5	-176.3	-1.2	115.2	V76	V76-R78 PolarHBondContact O-N 3.44Å
79	T	32.4	Very low	37.1	Very low	125 Å²	125	106 Å²	106	77%	0.767	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-10.1	-178.8	48.5	0	0	0	0	113.7	P77	P77-T79 PolarHBondContact O-N 3.19Å
80	L	32.2	Very low	36.5	Very low	109 Å²	109	103.6 Å²	103.6	57%	0.571	54%	0.544	S	S	*	.			trans	-105.7	69.3	179	-64.4	170	0	0	0	110.8	V76 P77 S82	V76-L80 HydrophobicContact CG1-CB 4.26Å; V76-L80 HydrophobicContact CG1-CD1 3.97Å; P77-L80 PolarHBondContact O-N 2.94Å; P77-L80 VanDerWaalsContact O-N 3.15Å; L80-S82 PolarHBondContact O-N 3.4Å
81	R	26.6	Very low	36	Very low	214 Å²	214	104.1 Å²	104.1	81%	0.808	55%	0.548	S	S	*	.			trans	-81.7	97.1	177.6	-65.2	-174.7	-175.8	-163.8	1.8	110.7
82	S	28.8	Very low	35.1	Very low	89 Å²	89	104.4 Å²	104.4	62%	0.622	55%	0.552	S	S	*	*			trans	-144.9	112.7	171.9	-60.5	0	0	0	0	110.7	L80 N101	L80-S82 PolarHBondContact O-N 3.4Å; S82-N101 PolarHBondContact O-ND2 2.95Å
83	L	30.6	Very low	34.2	Very low	92 Å²	92	103 Å²	103	48%	0.482	55%	0.549	S	S	.	.			trans	-78.6	135.3	173.8	-119.8	106.1	0	0	0	110	Y36 P38	Y36-L83 HydrophobicContact CD1-CB 3.26Å; Y36-L83 HydrophobicContact CD1-CD2 4.22Å; Y36-L83 HydrophobicContact CD1-CG 4.25Å; Y36-L83 HydrophobicContact CE1-CB 3.47Å; Y36-L83 VanDerWaalsContact CE1-CB 3.47Å; Y36-L83 HydrophobicContact CE1-CD1 4.35Å; Y36-L83 HydrophobicContact CE1-CD2 3.54Å; Y36-L83 HydrophobicContact CE1-CG 3.95Å; Y36-L83 HydrophobicContact CG-CB 4.25Å; P38-L83 HydrophobicContact CB-CD1 4.19Å
84	L	32.5	Very low	33.7	Very low	86 Å²	86	109.8 Å²	109.8	45%	0.45	58%	0.577	S	S	.	*			trans	-136.1	114.3	175.7	-176.4	71.7	0	0	0	109.6	V86	L84-V86 HydrophobicContact CD1-CG2 4.36Å; L84-V86 HydrophobicContact CD2-CG2 3.5Å; L84-V86 VanDerWaalsContact CD2-CG2 3.5Å; L84-V86 HydrophobicContact CG-CG2 3.61Å
85	A	32.5	Very low	33.4	Very low	96 Å²	96	110.8 Å²	110.8	79%	0.793	58%	0.578	S	S	*	*			trans	-94.9	121.1	161.8	0	0	0	0	0	108
86	V	33.6	Very low	33.4	Very low	46 Å²	46	110.8 Å²	110.8	28%	0.279	57%	0.569	S	S	.	*			trans	-106.3	123.6	179.6	-175.4	0	0	0	0	109.4	L84 T98 C99	L84-V86 HydrophobicContact CD1-CG2 4.36Å; L84-V86 HydrophobicContact CD2-CG2 3.5Å; L84-V86 VanDerWaalsContact CD2-CG2 3.5Å; L84-V86 HydrophobicContact CG-CG2 3.61Å; V86-T98 HydrophobicContact CB-CG2 4.03Å; V86-T98 HydrophobicContact CG1-CG2 3.95Å; V86-T98 HydrophobicContact CG2-CG2 4.44Å; V86-C99 WeakPolarHBondContact CG2-O 3.43Å
87	Q	33.8	Very low	33.3	Very low	161 Å²	161	116.6 Å²	116.6	75%	0.752	59%	0.591	S	S	*	*			trans	-105.8	113.8	164.4	-172.5	175	16.4	0	0	108	W9	W9-Q87 WeakPolarHBondContact CZ3-O 2.99Å
88	S	30.5	Very low	33.7	Very low	13 Å²	13	113.2 Å²	113.2	9%	0.091	57%	0.569	C	S	.	*			trans	-103.1	145.8	172.5	86.8	0	0	0	0	110.2	F115	S88-F115 WeakPolarHBondContact O-CZ 3.2Å; S88-F115 VanDerWaalsContact OG-CE2 3.23Å; S88-F115 WeakPolarHBondContact OG-CE2 3.13Å; S88-F115 WeakPolarHBondContact OG-CZ 3.5Å
89	R	32.8	Very low	33.9	Very low	202 Å²	202	104.9 Å²	104.9	76%	0.762	55%	0.545	S	S	*	.			trans	-134.1	114.9	161.6	-150.1	178.3	-167.5	-164.7	2.8	109.2	V91	R89-V91 PolarHBondContact O-N 3.39Å
90	I	31.3	Very low	34.5	Very low	91 Å²	91	99.5 Å²	99.5	47%	0.467	51%	0.511	S	S	.	.			trans	-67.1	125.3	-176.9	-62.3	167.4	0	0	0	108.9	L95	I90-L95 HydrophobicContact CG1-CD1 4.49Å
91	V	31.5	Very low	35.1	Very low	39 Å²	39	95.4 Å²	95.4	24%	0.236	49%	0.49	C	S	.	.			trans	-131.2	80.2	175.6	178.5	0	0	0	0	105.9	F5 R89	F5-V91 VanDerWaalsContact C-CG1 3.41Å; F5-V91 VanDerWaalsContact CA-CG1 3.49Å; F5-V91 HydrophobicContact CB-CB 4.5Å; F5-V91 HydrophobicContact CB-CG1 3.17Å; F5-V91 HydrophobicContact CD1-CB 4.24Å; F5-V91 HydrophobicContact CD1-CG1 3.67Å; F5-V91 HydrophobicContact CG-CG1 3.65Å; R89-V91 PolarHBondContact O-N 3.39Å
92	S	30.4	Very low	35.9	Very low	72 Å²	72	88.3 Å²	88.3	50%	0.503	47%	0.468	S	S	.	.	S	Bend	trans	65.4	126	-175.1	87	0	0	0	0	116.2
93	Q	31.8	Very low	36.5	Very low	177 Å²	177	91.5 Å²	91.5	83%	0.827	48%	0.478	S	S	*	.	S	Bend	trans	71.9	103.8	166.7	-54.9	-173	-2.4	0	0	118	L95	Q93-L95 PolarHBondContact O-N 2.88Å
94	Q	36.8	Very low	36.9	Very low	174 Å²	174	90.1 Å²	90.1	81%	0.813	48%	0.476	S	S	*	.			trans	30.6	78.5	153	-69.1	-173.8	-11.6	0	0	118.5	T96	Q94-T96 HydrophobicContact CB-CG2 4.27Å; Q94-T96 PolarHBondContact O-N 3.33Å
95	L	40.3	Very low	37.3	Very low	91 Å²	91	88.2 Å²	88.2	48%	0.476	47%	0.466	S	S	.	.			trans	-77.1	107.9	151.2	-75	168.2	0	0	0	108	I90 Q93 T111	I90-L95 HydrophobicContact CG1-CD1 4.49Å; Q93-L95 PolarHBondContact O-N 2.88Å; L95-T111 PolarHBondContact O-OG1 3Å
96	T	40.2	Very low	38	Very low	95 Å²	95	87.5 Å²	87.5	58%	0.583	45%	0.449	S	S	*	.			trans	-92.1	-14.3	-176.4	48.7	0	0	0	0	113.3	Q94	Q94-T96 HydrophobicContact CB-CG2 4.27Å; Q94-T96 PolarHBondContact O-N 3.33Å
97	K	38.4	Very low	38.7	Very low	161 Å²	161	85.4 Å²	85.4	70%	0.7	44%	0.436	S	S	*	.			trans	-141.2	134.9	-176.8	-63	-174.4	179.5	-179.7	0	111.4
98	T	44.6	Very low	39.5	Very low	15 Å²	15	81.7 Å²	81.7	9%	0.092	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	128	169.6	-64.7	0	0	0	0	107.2	V86 W109 T111 S114	V86-T98 HydrophobicContact CB-CG2 4.03Å; V86-T98 HydrophobicContact CG1-CG2 3.95Å; V86-T98 HydrophobicContact CG2-CG2 4.44Å; T98-W109 CarbonylContact C-O 3.54Å; T98-W109 PolarHBondContact N-O 3.16Å; T98-W109 CarbonylContact O-C 3.6Å; T98-W109 PolarHBondContact O-N 2.78Å; T98-T111 VanDerWaalsContact OG1-CA 3.29Å; T98-T111 WeakPolarHBondContact OG1-CA 3.12Å; T98-T111 VanDerWaalsContact OG1-CB 3.32Å; T98-T111 WeakPolarHBondContact OG1-CB 3.49Å; T98-T111 WeakPolarHBondContact OG1-CG2 3.45Å; T98-T111 PolarHBondContact OG1-OG1 2.97Å; T98-S114 VanDerWaalsContact CB-OG 3.31Å; T98-S114 WeakPolarHBondContact CB-OG 3.32Å; T98-S114 VanDerWaalsContact CG2-CB 3.48Å; T98-S114 WeakPolarHBondContact CG2-OG 3.32Å; T98-S114 PolarHBondContact O-OG 3.37Å
99	C	40.1	Very low	40.7	Very low	54 Å²	54	81.6 Å²	81.6	37%	0.365	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	132.9	176.8	-60.5	0	0	0	0	109.3	V86 L106 C107	V86-C99 WeakPolarHBondContact CG2-O 3.43Å; C99-L106 HydrophobicContact CB-CD1 3.96Å; C99-L106 HydrophobicContact CB-CG 4.44Å; C99-C107 WeakPolarHBondContact CA-O 3.24Å
100	M	46.1	Very low	41.5	Very low	12 Å²	12	73.7 Å²	73.7	6%	0.059	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	136.5	172.3	-171	-178.9	-49	0	0	109.2	L102 C107 W109 S114 A117 I118	M100-L102 HydrophobicContact CG-CG 4.09Å; M100-L102 HydrophobicContact SD-CD1 3.93Å; M100-L102 HydrophobicContact SD-CD2 3.92Å; M100-L102 HydrophobicContact SD-CG 3.81Å; M100-C107 PolarHBondContact N-O 3.13Å; M100-C107 VanDerWaalsContact N-O 3.15Å; M100-C107 WeakPolarHBondContact O-CB 3.35Å; M100-C107 PolarHBondContact O-N 3.41Å; M100-W109 HydrophobicContact CB-CE3 3.92Å; M100-W109 HydrophobicContact CB-CZ3 4.16Å; M100-W109 HydrophobicContact CE-CE3 3.99Å; M100-W109 HydrophobicContact CE-CZ3 3.84Å; M100-W109 HydrophobicContact CG-CZ3 4.44Å; M100-W109 HydrophobicContact SD-CE3 4.26Å; M100-W109 HydrophobicContact SD-CZ3 3.68Å; M100-S114 WeakPolarHBondContact CE-O 3.48Å; M100-A117 HydrophobicContact CE-CB 3.66Å; M100-A117 HydrophobicContact SD-CB 4.03Å; M100-I118 HydrophobicContact CE-CD1 3.47Å; M100-I118 VanDerWaalsContact CE-CD1 3.47Å; M100-I118 HydrophobicContact CE-CG1 3.41Å; M100-I118 VanDerWaalsContact CE-CG1 3.41Å; M100-I118 HydrophobicContact SD-CG1 4.09Å
101	N	44.8	Very low	42.3	Very low	23 Å²	23	69.7 Å²	69.7	12%	0.123	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	114	171.2	-165.5	-32	0	0	0	109.6	S82 S104 N105	S82-N101 PolarHBondContact O-ND2 2.95Å; N101-S104 VanDerWaalsContact OD1-C 3.22Å; N101-S104 WeakPolarHBondContact OD1-CA 3.38Å; N101-S104 PolarHBondContact OD1-N 3.26Å; N101-N105 CarbonylContact C-O 3.46Å; N101-N105 WeakPolarHBondContact CA-O 3.33Å; N101-N105 PolarHBondContact OD1-N 3.2Å; N101-N105 PolarHBondContact OD1-O 3.25Å
102	L	43.1	Very low	43.1	Very low	66 Å²	66	77.6 Å²	77.6	35%	0.346	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	129.2	175.1	-72.9	171.6	0	0	0	110	M100 S104 N105 W109	M100-L102 HydrophobicContact CG-CG 4.09Å; M100-L102 HydrophobicContact SD-CD1 3.93Å; M100-L102 HydrophobicContact SD-CD2 3.92Å; M100-L102 HydrophobicContact SD-CG 3.81Å; L102-S104 PolarHBondContact O-N 3.44Å; L102-S104 VanDerWaalsContact O-N 3.12Å; L102-N105 PolarHBondContact N-O 3.12Å; L102-N105 WeakPolarHBondContact O-CB 3.34Å; L102-N105 PolarHBondContact O-N 2.86Å; L102-W109 HydrophobicContact CD1-CH2 3Å; L102-W109 HydrophobicContact CD1-CZ2 3.93Å; L102-W109 HydrophobicContact CD1-CZ3 3.36Å; L102-W109 HydrophobicContact CG-CH2 4.32Å; L102-W109 HydrophobicContact CG-CZ3 4.4Å
103	N	40.5	Very low	44	Very low	155 Å²	155	76.5 Å²	76.5	83%	0.829	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	34.4	179.1	-62.2	-31.4	0	0	0	113.3	N105	N103-N105 VanDerWaalsContact C-N 3.27Å; N103-N105 PolarHBondContact O-N 3.45Å
104	S	39.4	Very low	44.9	Very low	64 Å²	64	68.2 Å²	68.2	45%	0.448	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	8.7	-174.9	-42.2	0	0	0	0	115.7	N101 L102	N101-S104 VanDerWaalsContact OD1-C 3.22Å; N101-S104 WeakPolarHBondContact OD1-CA 3.38Å; N101-S104 PolarHBondContact OD1-N 3.26Å; L102-S104 PolarHBondContact O-N 3.44Å; L102-S104 VanDerWaalsContact O-N 3.12Å
105	N	40.4	Very low	45.4	Very low	45 Å²	45	61.1 Å²	61.1	24%	0.241	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	127.9	172.2	-61.8	-44	0	0	0	109.7	C73 V76 N101 L102 N103 C107	C73-N105 HydrophobicContact CB-CB 3.69Å; C73-N105 WeakPolarHBondContact SG-CB 3.18Å; C73-N105 PolarHBondContact SG-O 3.44Å; C73-N105 VanDerWaalsContact SG-O 3.33Å; V76-N105 PolarHBondContact N-OD1 3.27Å; N101-N105 CarbonylContact C-O 3.46Å; N101-N105 WeakPolarHBondContact CA-O 3.33Å; N101-N105 PolarHBondContact OD1-N 3.2Å; N101-N105 PolarHBondContact OD1-O 3.25Å; L102-N105 PolarHBondContact N-O 3.12Å; L102-N105 WeakPolarHBondContact O-CB 3.34Å; L102-N105 PolarHBondContact O-N 2.86Å; N103-N105 VanDerWaalsContact C-N 3.27Å; N103-N105 PolarHBondContact O-N 3.45Å; N105-C107 PolarHBondContact O-N 2.95Å; N105-C107 PolarHBondContact O-SG 3.39Å
106	L	46.8	Very low	45.5	Very low	82 Å²	82	59.1 Å²	59.1	43%	0.429	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	111	172.7	-172.8	72.6	0	0	0	108.7	C73 V76 C99 P108	C73-L106 PolarHBondContact SG-O 3.15Å; V76-L106 HydrophobicContact CG2-CB 3.95Å; V76-L106 VanDerWaalsContact CG2-N 3.33Å; C99-L106 HydrophobicContact CB-CD1 3.96Å; C99-L106 HydrophobicContact CB-CG 4.44Å; L106-P108 WeakPolarHBondContact O-CD 3.49Å
107	C	48.6	Very low	45.7	Very low	1 Å²	1	55.1 Å²	55.1	1%	0.007	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	111.9	-176	-46.9	0	0	0	0	109.1	C73 C99 M100 N105 W109	C73-C107 HydrophobicContact CB-CB 4.06Å; C73-C107 WeakPolarHBondContact CB-SG 3.27Å; C73-C107 WeakPolarHBondContact SG-CA 3.14Å; C73-C107 WeakPolarHBondContact SG-CB 3.02Å; C73-C107 PolarHBondContact SG-N 3.37Å; C73-C107 CovalentContact SG-SG 2.03Å; C73-C107 PolarHBondContact SG-SG 3.37Å; C99-C107 WeakPolarHBondContact CA-O 3.24Å; M100-C107 PolarHBondContact N-O 3.13Å; M100-C107 VanDerWaalsContact N-O 3.15Å; M100-C107 WeakPolarHBondContact O-CB 3.35Å; M100-C107 PolarHBondContact O-N 3.41Å; N105-C107 PolarHBondContact O-N 2.95Å; N105-C107 PolarHBondContact O-SG 3.39Å; C107-W109 HydrophobicContact CB-CD2 3.53Å; C107-W109 VanDerWaalsContact CB-CE2 3.41Å; C107-W109 HydrophobicContact CB-CE3 4.09Å; C107-W109 HydrophobicContact CB-CG 3.82Å; C107-W109 HydrophobicContact CB-CZ2 3.97Å; C107-W109 PolarHBondContact O-N 3.32Å
108	P	51.5	Low	46.1	Very low	83 Å²	83	49.7 Å²	49.7	54%	0.539	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	69.3	177	34.3	-34.6	0	0	0	108.9	P74 L106	P74-P108 HydrophobicContact CG-CG 4.43Å; L106-P108 WeakPolarHBondContact O-CD 3.49Å
109	W	54.8	Low	45.7	Very low	12 Å²	12	50.4 Å²	50.4	5%	0.045	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	156.7	-176.9	-75.4	-16.2	0	0	0	111.2	M70 P71 T98 M100 L102 C107 D113 S114 A117	M70-W109 HydrophobicContact CB-CH2 4.18Å; M70-W109 HydrophobicContact CB-CZ2 3.75Å; M70-W109 HydrophobicContact CG-CH2 4.08Å; M70-W109 HydrophobicContact CG-CZ2 4.11Å; M70-W109 HydrophobicContact SD-CH2 3.37Å; M70-W109 WeakPolarHBondContact SD-CH2 3.32Å; M70-W109 HydrophobicContact SD-CZ2 3.95Å; M70-W109 HydrophobicContact SD-CZ3 4.03Å; P71-W109 PolarHBondContact O-NE1 3.18Å; T98-W109 CarbonylContact C-O 3.54Å; T98-W109 PolarHBondContact N-O 3.16Å; T98-W109 CarbonylContact O-C 3.6Å; T98-W109 PolarHBondContact O-N 2.78Å; M100-W109 HydrophobicContact CB-CE3 3.92Å; M100-W109 HydrophobicContact CB-CZ3 4.16Å; M100-W109 HydrophobicContact CE-CE3 3.99Å; M100-W109 HydrophobicContact CE-CZ3 3.84Å; M100-W109 HydrophobicContact CG-CZ3 4.44Å; M100-W109 HydrophobicContact SD-CE3 4.26Å; M100-W109 HydrophobicContact SD-CZ3 3.68Å; L102-W109 HydrophobicContact CD1-CH2 3Å; L102-W109 HydrophobicContact CD1-CZ2 3.93Å; L102-W109 HydrophobicContact CD1-CZ3 3.36Å; L102-W109 HydrophobicContact CG-CH2 4.32Å; L102-W109 HydrophobicContact CG-CZ3 4.4Å; C107-W109 HydrophobicContact CB-CD2 3.53Å; C107-W109 VanDerWaalsContact CB-CE2 3.41Å; C107-W109 HydrophobicContact CB-CE3 4.09Å; C107-W109 HydrophobicContact CB-CG 3.82Å; C107-W109 HydrophobicContact CB-CZ2 3.97Å; C107-W109 PolarHBondContact O-N 3.32Å; W109-D113 HydrophobicContact CB-CB 3.98Å; W109-D113 HydrophobicContact CG-CB 4.28Å; W109-S114 WeakPolarHBondContact CB-OG 3.47Å; W109-A117 HydrophobicContact CE3-CB 3.98Å; W109-A117 HydrophobicContact CH2-CB 3.81Å; W109-A117 HydrophobicContact CZ3-CB 3.2Å
110	S	50.8	Low	45.5	Very low	36 Å²	36	50.1 Å²	50.1	25%	0.252	28%	0.279	S	S	.	.			trans	-63.2	157.9	165.3	75.4	0	0	0	0	108.6	R112 D113 S114	S110-R112 PolarHBondContact O-N 2.99Å; S110-R112 PolarHBondContact OG-N 3.12Å; S110-D113 WeakPolarHBondContact CB-OD2 3.25Å; S110-D113 PolarHBondContact N-OD2 2.73Å; S110-D113 PolarHBondContact O-N 3.02Å; S110-D113 VanDerWaalsContact O-N 3.11Å; S110-D113 PolarHBondContact OG-N 3.13Å; S110-D113 PolarHBondContact OG-OD1 3.26Å; S110-D113 PolarHBondContact OG-OD2 3.17Å; S110-S114 PolarHBondContact O-N 3.14Å; S110-S114 PolarHBondContact O-OG 3.09Å
111	T	48.5	Very low	44.6	Very low	7 Å²	7	60.5 Å²	60.5	4%	0.043	32%	0.317	C	S	.	.	H	α-helix	trans	-55.1	-37.8	173.3	-61.8	0	0	0	0	111.4	L95 T98 S114 F115	L95-T111 PolarHBondContact O-OG1 3Å; T98-T111 VanDerWaalsContact OG1-CA 3.29Å; T98-T111 WeakPolarHBondContact OG1-CA 3.12Å; T98-T111 VanDerWaalsContact OG1-CB 3.32Å; T98-T111 WeakPolarHBondContact OG1-CB 3.49Å; T98-T111 WeakPolarHBondContact OG1-CG2 3.45Å; T98-T111 PolarHBondContact OG1-OG1 2.97Å; T111-S114 PolarHBondContact O-N 2.83Å; T111-F115 HydrophobicContact CG2-CD2 3.66Å; T111-F115 HydrophobicContact CG2-CE2 3.38Å; T111-F115 WeakPolarHBondContact O-CD2 3.32Å; T111-F115 PolarHBondContact O-N 2.91Å
112	R	48	Very low	44	Very low	205 Å²	205	63 Å²	63	77%	0.774	33%	0.33	S	S	*	.	H	α-helix	trans	-60	-49.4	173.9	-179.7	-176.3	177.4	-175.7	-1.8	112.2	S110 S114 F115 A116	S110-R112 PolarHBondContact O-N 2.99Å; S110-R112 PolarHBondContact OG-N 3.12Å; R112-S114 VanDerWaalsContact C-N 3.32Å; R112-S114 PolarHBondContact O-N 2.97Å; R112-F115 PolarHBondContact O-N 3.36Å; R112-A116 PolarHBondContact O-N 3.03Å
113	D	49.7	Very low	43.2	Very low	49 Å²	49	65.2 Å²	65.2	26%	0.262	35%	0.351	S	S	.	.	H	α-helix	trans	-68.9	-35	-177.3	-54.4	-34.6	0	0	0	111.3	W109 S110 A116 A117	W109-D113 HydrophobicContact CB-CB 3.98Å; W109-D113 HydrophobicContact CG-CB 4.28Å; S110-D113 WeakPolarHBondContact CB-OD2 3.25Å; S110-D113 PolarHBondContact N-OD2 2.73Å; S110-D113 PolarHBondContact O-N 3.02Å; S110-D113 VanDerWaalsContact O-N 3.11Å; S110-D113 PolarHBondContact OG-N 3.13Å; S110-D113 PolarHBondContact OG-OD1 3.26Å; S110-D113 PolarHBondContact OG-OD2 3.17Å; D113-A116 PolarHBondContact O-N 2.96Å; D113-A117 WeakPolarHBondContact O-CB 3.35Å; D113-A117 PolarHBondContact O-N 2.8Å
114	S	50.3	Low	42.6	Very low	2 Å²	2	66.5 Å²	66.5	1%	0.014	35%	0.35	C	S	.	.	H	α-helix	trans	-64.3	-39.7	172.3	-64	0	0	0	0	112.5	T98 M100 W109 S110 T111 R112 A117 I118	T98-S114 VanDerWaalsContact CB-OG 3.31Å; T98-S114 WeakPolarHBondContact CB-OG 3.32Å; T98-S114 VanDerWaalsContact CG2-CB 3.48Å; T98-S114 WeakPolarHBondContact CG2-OG 3.32Å; T98-S114 PolarHBondContact O-OG 3.37Å; M100-S114 WeakPolarHBondContact CE-O 3.48Å; W109-S114 WeakPolarHBondContact CB-OG 3.47Å; S110-S114 PolarHBondContact O-N 3.14Å; S110-S114 PolarHBondContact O-OG 3.09Å; T111-S114 PolarHBondContact O-N 2.83Å; R112-S114 VanDerWaalsContact C-N 3.32Å; R112-S114 PolarHBondContact O-N 2.97Å; S114-A117 PolarHBondContact O-N 3.31Å; S114-I118 PolarHBondContact O-N 3.15Å; S114-I118 VanDerWaalsContact O-N 3.08Å
115	F	46.4	Very low	41.9	Very low	26 Å²	26	66.1 Å²	66.1	11%	0.114	36%	0.356	C	S	.	.	H	α-helix	trans	-67.8	-40	174.9	-81.7	-59.6	0	0	0	112.7	S88 T111 R112 A117 I118 G119 V120 L122	S88-F115 WeakPolarHBondContact O-CZ 3.2Å; S88-F115 VanDerWaalsContact OG-CE2 3.23Å; S88-F115 WeakPolarHBondContact OG-CE2 3.13Å; S88-F115 WeakPolarHBondContact OG-CZ 3.5Å; T111-F115 HydrophobicContact CG2-CD2 3.66Å; T111-F115 HydrophobicContact CG2-CE2 3.38Å; T111-F115 WeakPolarHBondContact O-CD2 3.32Å; T111-F115 PolarHBondContact O-N 2.91Å; R112-F115 PolarHBondContact O-N 3.36Å; F115-A117 VanDerWaalsContact C-N 3.26Å; F115-A117 PolarHBondContact O-N 3.15Å; F115-I118 PolarHBondContact O-N 2.86Å; F115-G119 PolarHBondContact O-N 3.16Å; F115-V120 HydrophobicContact CD1-CB 3.88Å; F115-V120 HydrophobicContact CD1-CG1 4.15Å; F115-V120 HydrophobicContact CD1-CG2 4.19Å; F115-V120 HydrophobicContact CE1-CG1 4.44Å; F115-V120 PolarHBondContact O-N 3.18Å; F115-L122 HydrophobicContact CD1-CD1 4.4Å; F115-L122 HydrophobicContact CD2-CD1 4.21Å; F115-L122 HydrophobicContact CE1-CD1 4.2Å; F115-L122 HydrophobicContact CE2-CD1 4.01Å; F115-L122 HydrophobicContact CG-CD1 4.39Å; F115-L122 HydrophobicContact CZ-CD1 3.98Å
116	A	43	Very low	41.1	Very low	49 Å²	49	71.7 Å²	71.7	41%	0.405	39%	0.386	S	S	.	.	H	α-helix	trans	-60.1	-39.4	173.4	0	0	0	0	0	111.2	R112 D113 G119	R112-A116 PolarHBondContact O-N 3.03Å; D113-A116 PolarHBondContact O-N 2.96Å; A116-G119 PolarHBondContact O-N 3.27Å; A116-G119 VanDerWaalsContact O-N 3.17Å
117	A	43.8	Very low	40.2	Very low	11 Å²	11	82 Å²	82	9%	0.091	42%	0.421	C	S	.	.	H	α-helix	trans	-74.3	-29.3	-179.5	0	0	0	0	0	116	L62 M70 M100 W109 D113 S114 F115 G119	L62-A117 VanDerWaalsContact CD2-O 3.27Å; L62-A117 WeakPolarHBondContact CD2-O 3.41Å; M70-A117 HydrophobicContact CE-CB 3.31Å; M70-A117 HydrophobicContact SD-CB 3.45Å; M70-A117 WeakPolarHBondContact SD-CB 3.24Å; M100-A117 HydrophobicContact CE-CB 3.66Å; M100-A117 HydrophobicContact SD-CB 4.03Å; W109-A117 HydrophobicContact CE3-CB 3.98Å; W109-A117 HydrophobicContact CH2-CB 3.81Å; W109-A117 HydrophobicContact CZ3-CB 3.2Å; D113-A117 WeakPolarHBondContact O-CB 3.35Å; D113-A117 PolarHBondContact O-N 2.8Å; S114-A117 PolarHBondContact O-N 3.31Å; F115-A117 VanDerWaalsContact C-N 3.26Å; F115-A117 PolarHBondContact O-N 3.15Å; A117-G119 PolarHBondContact O-N 3.29Å
118	I	47.3	Very low	39.8	Very low	47 Å²	47	86 Å²	86	24%	0.241	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-3.9	171.1	-65.8	152.8	0	0	0	110.8	F57 M100 S114 F115 V120	F57-I118 HydrophobicContact CD1-CG2 4.27Å; F57-I118 HydrophobicContact CE1-CG2 3.9Å; M100-I118 HydrophobicContact CE-CD1 3.47Å; M100-I118 VanDerWaalsContact CE-CD1 3.47Å; M100-I118 HydrophobicContact CE-CG1 3.41Å; M100-I118 VanDerWaalsContact CE-CG1 3.41Å; M100-I118 HydrophobicContact SD-CG1 4.09Å; S114-I118 PolarHBondContact O-N 3.15Å; S114-I118 VanDerWaalsContact O-N 3.08Å; F115-I118 PolarHBondContact O-N 2.86Å; I118-V120 HydrophobicContact CB-CG2 3.87Å; I118-V120 HydrophobicContact CG2-CG2 3.45Å; I118-V120 VanDerWaalsContact CG2-CG2 3.45Å; I118-V120 PolarHBondContact O-N 3.49Å
119	G	35.8	Very low	39.2	Very low	29 Å²	29	86.2 Å²	86.2	30%	0.299	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	23.4	-175.1	0	0	0	0	0	112.7	F115 A116 A117 R121	F115-G119 PolarHBondContact O-N 3.16Å; A116-G119 PolarHBondContact O-N 3.27Å; A116-G119 VanDerWaalsContact O-N 3.17Å; A117-G119 PolarHBondContact O-N 3.29Å; G119-R121 PolarHBondContact O-N 3.36Å
120	V	35.4	Very low	38.3	Very low	49 Å²	49	90.3 Å²	90.3	30%	0.297	46%	0.458	S	S	.	.			trans	-78.8	107.3	179	-175.7	0	0	0	0	109.3	F57 F115 I118 L122	F57-V120 HydrophobicContact CE1-CG2 4.33Å; F115-V120 HydrophobicContact CD1-CB 3.88Å; F115-V120 HydrophobicContact CD1-CG1 4.15Å; F115-V120 HydrophobicContact CD1-CG2 4.19Å; F115-V120 HydrophobicContact CE1-CG1 4.44Å; F115-V120 PolarHBondContact O-N 3.18Å; I118-V120 HydrophobicContact CB-CG2 3.87Å; I118-V120 HydrophobicContact CG2-CG2 3.45Å; I118-V120 VanDerWaalsContact CG2-CG2 3.45Å; I118-V120 PolarHBondContact O-N 3.49Å; V120-L122 HydrophobicContact CG1-CD2 4.37Å; V120-L122 HydrophobicContact CG1-CG 4.23Å; V120-L122 PolarHBondContact O-N 3.27Å; V120-L122 VanDerWaalsContact O-N 3.13Å
121	R	28.8	Very low	37.6	Very low	230 Å²	230	93.5 Å²	93.5	87%	0.868	47%	0.47	S	S	*	.			trans	-76.3	94.8	165.7	-155.3	177.5	-171	-171.1	2.9	109.1	G119 S123	G119-R121 PolarHBondContact O-N 3.36Å; R121-S123 PolarHBondContact O-N 3.49Å
122	L	30.6	Very low	36.9	Very low	76 Å²	76	98.9 Å²	98.9	40%	0.398	50%	0.497	S	S	.	.			trans	-74.1	101.3	160.3	-70.6	173.9	0	0	0	107.1	F115 V120 F124	F115-L122 HydrophobicContact CD1-CD1 4.4Å; F115-L122 HydrophobicContact CD2-CD1 4.21Å; F115-L122 HydrophobicContact CE1-CD1 4.2Å; F115-L122 HydrophobicContact CE2-CD1 4.01Å; F115-L122 HydrophobicContact CG-CD1 4.39Å; F115-L122 HydrophobicContact CZ-CD1 3.98Å; V120-L122 HydrophobicContact CG1-CD2 4.37Å; V120-L122 HydrophobicContact CG1-CG 4.23Å; V120-L122 PolarHBondContact O-N 3.27Å; V120-L122 VanDerWaalsContact O-N 3.13Å; L122-F124 HydrophobicContact CB-CE2 4.04Å; L122-F124 HydrophobicContact CB-CZ 4.11Å; L122-F124 HydrophobicContact CD1-CZ 4.36Å; L122-F124 VanDerWaalsContact O-CD2 3.28Å; L122-F124 WeakPolarHBondContact O-CD2 3.47Å; L122-F124 PolarHBondContact O-N 2.71Å; L122-F124 VanDerWaalsContact O-N 3.15Å
123	S	26.5	Very low	36.2	Very low	111 Å²	111	91.8 Å²	91.8	78%	0.776	48%	0.478	S	S	*	.			trans	-71.3	106.8	171.8	-139.6	0	0	0	0	108.4	R121 G125	R121-S123 PolarHBondContact O-N 3.49Å; S123-G125 PolarHBondContact O-N 2.64Å
124	F	28	Very low	35.2	Very low	182 Å²	182	94.9 Å²	94.9	80%	0.798	49%	0.494	S	S	*	.			trans	-80.6	96.4	171.8	-62.5	-83	0	0	0	108.2	L122	L122-F124 HydrophobicContact CB-CE2 4.04Å; L122-F124 HydrophobicContact CB-CZ 4.11Å; L122-F124 HydrophobicContact CD1-CZ 4.36Å; L122-F124 VanDerWaalsContact O-CD2 3.28Å; L122-F124 WeakPolarHBondContact O-CD2 3.47Å; L122-F124 PolarHBondContact O-N 2.71Å; L122-F124 VanDerWaalsContact O-N 3.15Å
125	G	24.7	Very low	34	Very low	56 Å²	56	102 Å²	102	58%	0.577	53%	0.531	S	S	*	.			trans	-83.4	123.6	165.5	0	0	0	0	0	109.1	S123 Y127	S123-G125 PolarHBondContact O-N 2.64Å; G125-Y127 PolarHBondContact O-N 2.75Å
126	N	24	Very low	33	Very low	163 Å²	163	108.3 Å²	108.3	87%	0.872	57%	0.566	S	S	*	*			trans	-58.8	112.6	169.7	-71.9	-33.1	0	0	0	109.7
127	Y	28.2	Very low	32.1	Very low	297 Å²	297	113.7 Å²	113.7	100%	1.165	58%	0.58	S	S	*	*			trans	-144.4	0	163.5	-72.5	-76.4	0	0	0	109.3	G125	G125-Y127 PolarHBondContact O-N 2.75Å

Retrieved 127 of 127 residues in 85.2 ms (Link to these results)

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