A0A077ZNJ7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZNJ7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 179 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	26.8	Very low	26.1	Very low	222 Å²	222	104.9 Å²	104.9	100%	1.094	56%	0.556	S	S	*	*				0	125	0	-67.8	-177.4	-140.7	0	0	108.3
2	K	24.9	Very low	26.3	Very low	206 Å²	206	104.3 Å²	104.3	90%	0.896	55%	0.553	S	S	*	*			trans	-135.2	130.3	168.9	-81.6	-174	176.4	-177.8	0	108.7	L4	K2-L4 PolarHBondContact O-N 3.48Å
3	P	25.2	Very low	26.5	Very low	125 Å²	125	101.2 Å²	101.2	81%	0.812	53%	0.529	S	S	*	.			trans	-80.8	105	-176.6	30.5	-31.2	0	0	0	112
4	L	23	Very low	26.8	Very low	103 Å²	103	101.4 Å²	101.4	54%	0.539	53%	0.531	S	S	.	.				36.1	91.8	119.8	-69.6	-178.5	0	0	0	118.4	K2 K6 K163	K2-L4 PolarHBondContact O-N 3.48Å; L4-K6 PolarHBondContact O-N 3.12Å; L4-K163 VanDerWaalsContact C-CD 3.47Å; L4-K163 VanDerWaalsContact CA-CE 3.5Å; L4-K163 HydrophobicContact CB-CB 3.82Å; L4-K163 HydrophobicContact CB-CD 3.36Å; L4-K163 HydrophobicContact CB-CG 3.44Å; L4-K163 VanDerWaalsContact CB-CG 3.44Å; L4-K163 HydrophobicContact CD1-CB 4.12Å; L4-K163 HydrophobicContact CD1-CD 4.5Å; L4-K163 HydrophobicContact CD1-CG 3.7Å; L4-K163 HydrophobicContact CD2-CD 3.84Å; L4-K163 HydrophobicContact CD2-CG 3.73Å; L4-K163 HydrophobicContact CG-CB 4.41Å; L4-K163 HydrophobicContact CG-CD 3.97Å; L4-K163 HydrophobicContact CG-CG 3.72Å
5	L	22.7	Very low	27.1	Very low	147 Å²	147	97.5 Å²	97.5	77%	0.77	52%	0.516	S	S	*	.			trans	-45	120	163	-59.2	119.1	0	0	0	115.7	K163	L5-K163 VanDerWaalsContact CB-NZ 3.33Å; L5-K163 WeakPolarHBondContact O-CD 3.49Å; L5-K163 WeakPolarHBondContact O-CE 3.32Å; L5-K163 PolarHBondContact O-NZ 3.42Å
6	K	25.7	Very low	27.2	Very low	144 Å²	144	97.4 Å²	97.4	63%	0.626	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-88.8	141.4	175.4	-61	174	-177.2	173.8	0	110.8	L4	L4-K6 PolarHBondContact O-N 3.12Å
7	A	25.5	Very low	27.4	Very low	51 Å²	51	95.4 Å²	95.4	42%	0.421	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-94.9	147.1	-176.4	0	0	0	0	0	112.6
8	P	27.4	Very low	27.7	Very low	71 Å²	71	93.3 Å²	93.3	46%	0.461	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-82.5	142	178.3	31.5	-32.8	0	0	0	113.7	T159	P8-T159 CarbonylContact C-O 3.12Å; P8-T159 PolarHBondContact O-OG1 3.12Å
9	L	28	Very low	27.7	Very low	29 Å²	29	97.2 Å²	97.2	15%	0.152	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-64.9	145.9	167.2	-154.9	89.6	0	0	0	109.4	V59 L60 I139 A158 T159	L9-V59 VanDerWaalsContact O-CG1 3.24Å; L9-V59 WeakPolarHBondContact O-CG1 3.44Å; L9-L60 CarbonylContact C-O 3.44Å; L9-I139 HydrophobicContact CD1-CD1 4.39Å; L9-A158 HydrophobicContact CD1-CB 3.57Å; L9-T159 WeakPolarHBondContact CA-O 3.08Å; L9-T159 PolarHBondContact N-O 3.27Å
10	V	29.1	Very low	27.9	Very low	45 Å²	45	97.3 Å²	97.3	27%	0.273	51%	0.513	S	S	.	.			trans	-134.7	103.2	-177.7	176.2	0	0	0	0	108.7	L12 V59 Y157 T159	V10-L12 HydrophobicContact CG1-CD2 4.46Å; V10-L12 HydrophobicContact CG1-CG 4.42Å; V10-V59 HydrophobicContact CG1-CG2 3.99Å; V10-V59 HydrophobicContact CG2-CG1 4.35Å; V10-Y157 CarbonylContact C-O 3.48Å; V10-Y157 WeakPolarHBondContact O-CB 3.4Å; V10-T159 WeakPolarHBondContact CG2-OG1 3.16Å; V10-T159 PolarHBondContact N-OG1 3.16Å
11	C	28.9	Very low	28.1	Very low	11 Å²	11	95 Å²	95	7%	0.074	51%	0.508	C	S	.	.			trans	-96.9	139.5	165.8	-63.1	0	0	0	0	108.7	L60	C11-L60 HydrophobicContact CB-CD1 3.94Å
12	L	28.6	Very low	28.2	Very low	98 Å²	98	86.7 Å²	86.7	51%	0.513	48%	0.475	S	S	.	.			trans	-112	132.2	175.9	-66.9	169	0	0	0	108.2	V10 I105	V10-L12 HydrophobicContact CG1-CD2 4.46Å; V10-L12 HydrophobicContact CG1-CG 4.42Å; L12-I105 HydrophobicContact CD2-CD1 4.12Å
13	Y	29.1	Very low	28.5	Very low	63 Å²	63	85.5 Å²	85.5	25%	0.247	47%	0.47	C	S	.	.			trans	-98.7	140.6	176.1	-70.7	-86.2	0	0	0	110.5	F58 F146	Y13-F58 HydrophobicContact CD2-CB 3.99Å; Y13-F58 WeakPolarHBondContact CD2-O 3.09Å; Y13-F58 HydrophobicContact CE2-CB 3.94Å; Y13-F146 AromaticContact CE1-CE1 3.66Å; Y13-F146 HydrophobicContact CE1-CE1 3.66Å; Y13-F146 AromaticContact CE1-CZ 3.42Å; Y13-F146 HydrophobicContact CE1-CZ 3.42Å; Y13-F146 VanDerWaalsContact CE1-CZ 3.42Å; Y13-F146 AromaticContact CZ-CE1 3.96Å; Y13-F146 AromaticContact CZ-CZ 3.51Å; Y13-F146 WeakPolarHBondContact OH-CE1 3.46Å; Y13-F146 WeakPolarHBondContact OH-CE2 3.28Å; Y13-F146 WeakPolarHBondContact OH-CZ 3.49Å
14	D	29.5	Very low	28.6	Very low	105 Å²	105	88.3 Å²	88.3	56%	0.561	46%	0.464	S	S	*	.			trans	-97.2	140	167	-177.9	15.4	0	0	0	110.2	T16 R152	D14-T16 PolarHBondContact O-N 3.13Å; D14-R152 PolarHBondContact O-NH2 3.34Å; D14-R152 IonicContact OD2-NH1 3.41Å
15	S	32.2	Very low	29	Very low	42 Å²	42	84.7 Å²	84.7	29%	0.294	45%	0.445	S	S	.	.	S	Bend	trans	-86.1	17.3	-154.6	66.2	0	0	0	0	117.1	S45	S15-S45 WeakPolarHBondContact CB-OG 3.42Å; S15-S45 PolarHBondContact OG-OG 3.25Å
16	T	29.1	Very low	29.2	Very low	97 Å²	97	81.4 Å²	81.4	60%	0.595	45%	0.447	S	S	*	.	S	Bend	trans	-90.4	5.3	-172	54.5	0	0	0	0	116.1	D14 R152	D14-T16 PolarHBondContact O-N 3.13Å; T16-R152 VanDerWaalsContact OG1-CZ 3.31Å; T16-R152 PolarHBondContact OG1-NH1 3.14Å
17	E	30.6	Very low	29.3	Very low	63 Å²	63	77.6 Å²	77.6	29%	0.294	45%	0.449	S	S	.	.			trans	-122.3	46.8	179.9	-71.6	-174.2	137.3	0	0	113.2	E19 Q20 R152	E17-E19 VanDerWaalsContact C-N 3.26Å; E17-E19 PolarHBondContact O-N 3.32Å; E17-Q20 PolarHBondContact O-N 3.13Å; E17-R152 IonicContact OE2-CZ 3.5Å; E17-R152 IonicContact OE2-NE 3.97Å; E17-R152 PolarHBondContact OE2-NE 3.08Å; E17-R152 IonicContact OE2-NH2 3.05Å
18	S	31.6	Very low	29.4	Very low	57 Å²	57	76.7 Å²	76.7	40%	0.399	44%	0.437	S	S	.	.	H	α-helix	trans	-61	-21.4	-176.1	44.1	0	0	0	0	115.5	A22	S18-A22 WeakPolarHBondContact O-CB 2.9Å; S18-A22 PolarHBondContact O-N 2.92Å; S18-A22 VanDerWaalsContact O-N 3.14Å
19	E	29.1	Very low	29.5	Very low	167 Å²	167	80.6 Å²	80.6	78%	0.78	44%	0.442	S	S	*	.	H	α-helix	trans	-77.7	-26.3	-179.7	-76.1	-173.5	160.1	0	0	114.7	E17	E17-E19 VanDerWaalsContact C-N 3.26Å; E17-E19 PolarHBondContact O-N 3.32Å
20	Q	31.4	Very low	29.4	Very low	99 Å²	99	88.3 Å²	88.3	46%	0.463	48%	0.478	S	S	.	.	H	α-helix	trans	-88	-34.2	176.7	-71.2	-170.4	17.1	0	0	112	E17 A22 K23 W24 H149	E17-Q20 PolarHBondContact O-N 3.13Å; Q20-A22 VanDerWaalsContact C-N 3.25Å; Q20-A22 PolarHBondContact O-N 2.81Å; Q20-K23 PolarHBondContact O-N 3.44Å; Q20-K23 VanDerWaalsContact O-N 3.16Å; Q20-W24 PolarHBondContact O-N 3Å; Q20-H149 PolarHBondContact OE1-O 3.34Å
21	A	31.7	Very low	29.4	Very low	50 Å²	50	90 Å²	90	41%	0.413	49%	0.488	S	S	.	.	H	α-helix	trans	-60.5	-37	168.5	0	0	0	0	0	111.5	K23 W24 N25	A21-K23 VanDerWaalsContact C-N 3.29Å; A21-K23 PolarHBondContact O-N 3.18Å; A21-W24 PolarHBondContact O-N 2.93Å; A21-W24 VanDerWaalsContact O-N 3.14Å; A21-N25 VanDerWaalsContact O-CG 3.29Å; A21-N25 PolarHBondContact O-N 2.69Å; A21-N25 VanDerWaalsContact O-N 3.08Å; A21-N25 PolarHBondContact O-ND2 2.84Å
22	A	29.7	Very low	29.4	Very low	47 Å²	47	93.1 Å²	93.1	39%	0.388	50%	0.504	S	S	.	.	H	α-helix	trans	-62.2	-29.9	174.4	0	0	0	0	0	114.1	S18 Q20 N25	S18-A22 WeakPolarHBondContact O-CB 2.9Å; S18-A22 PolarHBondContact O-N 2.92Å; S18-A22 VanDerWaalsContact O-N 3.14Å; Q20-A22 VanDerWaalsContact C-N 3.25Å; Q20-A22 PolarHBondContact O-N 2.81Å; A22-N25 PolarHBondContact O-N 3.43Å
23	K	29.7	Very low	29.4	Very low	182 Å²	182	91.6 Å²	91.6	79%	0.791	50%	0.5	S	S	*	.	H	α-helix	trans	-76.6	-23.9	175.2	-73.6	-178.8	178.7	177.5	0	113.3	Q20 A21	Q20-K23 PolarHBondContact O-N 3.44Å; Q20-K23 VanDerWaalsContact O-N 3.16Å; A21-K23 VanDerWaalsContact C-N 3.29Å; A21-K23 PolarHBondContact O-N 3.18Å
24	W	28.7	Very low	29.4	Very low	183 Å²	183	95.3 Å²	95.3	69%	0.693	53%	0.532	S	S	*	.	H	α-helix	trans	-84.4	-20.1	173.5	-121.8	39.8	0	0	0	112.6	Q20 A21 G26 F100	Q20-W24 PolarHBondContact O-N 3Å; A21-W24 PolarHBondContact O-N 2.93Å; A21-W24 VanDerWaalsContact O-N 3.14Å; W24-G26 PolarHBondContact O-N 3.5Å; W24-G26 VanDerWaalsContact O-N 3.08Å; W24-F100 HydrophobicContact CH2-CE2 4.26Å; W24-F100 HydrophobicContact CH2-CZ 4.04Å; W24-F100 HydrophobicContact CZ3-CE2 4.48Å; W24-F100 HydrophobicContact CZ3-CZ 4.24Å
25	N	31.1	Very low	29.4	Very low	27 Å²	27	93.2 Å²	93.2	14%	0.144	54%	0.535	C	S	.	.	G	3₁₀ helix	trans	-67.2	-2.8	179.6	-80	-22.9	0	0	0	115.9	A21 A22 G27 I28	A21-N25 VanDerWaalsContact O-CG 3.29Å; A21-N25 PolarHBondContact O-N 2.69Å; A21-N25 VanDerWaalsContact O-N 3.08Å; A21-N25 PolarHBondContact O-ND2 2.84Å; A22-N25 PolarHBondContact O-N 3.43Å; N25-G27 PolarHBondContact O-N 2.97Å; N25-I28 PolarHBondContact O-N 2.95Å
26	G	26.1	Very low	29.5	Very low	78 Å²	78	95.2 Å²	95.2	80%	0.804	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-61.7	-18.5	173.4	0	0	0	0	0	114.2	W24	W24-G26 PolarHBondContact O-N 3.5Å; W24-G26 VanDerWaalsContact O-N 3.08Å
27	G	27.5	Very low	29.6	Very low	65 Å²	65	94 Å²	94	67%	0.67	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-105.4	-5.1	176.7	0	0	0	0	0	115.9	N25	N25-G27 PolarHBondContact O-N 2.97Å
28	I	29	Very low	29.6	Very low	32 Å²	32	97.5 Å²	97.5	16%	0.164	56%	0.558	C	S	.	*	T	Hydrogen-bonded Turn	trans	-103.1	-13.1	-171.1	-63.2	174.9	0	0	0	112.3	N25 E30	N25-I28 PolarHBondContact O-N 2.95Å; I28-E30 PolarHBondContact O-N 2.95Å; I28-E30 VanDerWaalsContact O-N 3.09Å
29	R	28.2	Very low	29.6	Very low	152 Å²	152	99.6 Å²	99.6	57%	0.574	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-12.6	-177.2	-84.6	-171.5	169.2	-165.4	-1.4	115.1
30	E	26.8	Very low	29.7	Very low	191 Å²	191	94.9 Å²	94.9	89%	0.893	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	-1.8	-173.4	-66.1	-171	161.8	0	0	115.1	I28	I28-E30 PolarHBondContact O-N 2.95Å; I28-E30 VanDerWaalsContact O-N 3.09Å
31	T	28.9	Very low	29.8	Very low	81 Å²	81	95.1 Å²	95.1	50%	0.497	57%	0.571	S	S	.	*			trans	-126.1	17.8	-168.5	36.3	0	0	0	0	116.1	P33	T31-P33 WeakPolarHBondContact O-CD 3.17Å
32	L	29.4	Very low	29.7	Very low	76 Å²	76	100.9 Å²	100.9	40%	0.398	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-84.3	123	175.3	-78.1	165.5	0	0	0	111.5	S87	L32-S87 WeakPolarHBondContact CD2-OG 3.24Å
33	P	28.4	Very low	29.8	Very low	67 Å²	67	102.6 Å²	102.6	44%	0.435	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-60.3	141.6	172.8	-20	30.9	0	0	0	111.5	T31 G35 L36	T31-P33 WeakPolarHBondContact O-CD 3.17Å; P33-G35 PolarHBondContact O-N 2.78Å; P33-L36 HydrophobicContact CB-CD1 4.49Å; P33-L36 HydrophobicContact CG-CD1 4.34Å
34	P	29.1	Very low	29.7	Very low	141 Å²	141	97.3 Å²	97.3	92%	0.916	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	127.9	174.5	-18.5	29.2	0	0	0	110.8
35	G	30.2	Very low	29.6	Very low	61 Å²	61	91 Å²	91	63%	0.629	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.6	-10.9	172.8	0	0	0	0	0	116.7	P33	P33-G35 PolarHBondContact O-N 2.78Å
36	L	32.7	Very low	29.4	Very low	84 Å²	84	100.1 Å²	100.1	44%	0.44	58%	0.581	S	S	.	*			trans	-89.8	-2.2	-180	-79.9	158.6	0	0	0	114.7	P33	P33-L36 HydrophobicContact CB-CD1 4.49Å; P33-L36 HydrophobicContact CG-CD1 4.34Å
37	A	31.1	Very low	29.4	Very low	70 Å²	70	102.3 Å²	102.3	58%	0.579	58%	0.578	S	S	*	*			trans	-102.4	50	-174.9	0	0	0	0	0	113.1
38	Q	31.3	Very low	29.3	Very low	137 Å²	137	102.6 Å²	102.6	64%	0.64	56%	0.564	S	S	*	*			trans	-98.9	129	178.5	-68	-164.3	13.3	0	0	112.8
39	P	30.6	Very low	29	Very low	102 Å²	102	110.4 Å²	110.4	66%	0.662	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	132.9	171.5	-15.3	28.2	0	0	0	111.4	W53	P39-W53 HydrophobicContact CB-CH2 4.41Å; P39-W53 HydrophobicContact CB-CZ2 3.81Å; P39-W53 HydrophobicContact CG-CZ2 4.19Å
40	G	31.8	Very low	28.9	Very low	68 Å²	68	108.6 Å²	108.6	70%	0.701	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	121.8	5.2	170.3	0	0	0	0	0	117.1
41	N	32.8	Very low	28.8	Very low	103 Å²	103	107.1 Å²	107.1	55%	0.551	60%	0.597	S	S	*	*			trans	-95	122.8	172.7	-93.7	-37.7	0	0	0	110.4	H43 Y44	N41-H43 PolarHBondContact O-N 3.02Å; N41-Y44 HydrophobicContact CB-CD2 4.14Å; N41-Y44 HydrophobicContact CB-CE2 3.65Å; N41-Y44 VanDerWaalsContact O-CD2 3.25Å; N41-Y44 WeakPolarHBondContact O-CD2 3.47Å
42	E	30.5	Very low	28.6	Very low	172 Å²	172	106.2 Å²	106.2	80%	0.804	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	21.1	-169.1	-57.4	-179.3	167.8	0	0	114.8
43	H	30.9	Very low	28.5	Very low	82 Å²	82	106.6 Å²	106.6	38%	0.38	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.9	11.4	-174.4	-67.9	-54.4	0	0	0	114.8	N41 T56 C107	N41-H43 PolarHBondContact O-N 3.02Å; H43-T56 PolarHBondContact O-OG1 3.14Å; H43-C107 PolarHBondContact CE1-O 3.2Å; H43-C107 PolarHBondContact NE2-O 3.49Å
44	Y	27.6	Very low	28.5	Very low	71 Å²	71	106.1 Å²	106.1	28%	0.278	58%	0.583	S	S	.	*			trans	-112.9	125.5	-175.2	-62.3	-79.6	0	0	0	112.4	N41 W53	N41-Y44 HydrophobicContact CB-CD2 4.14Å; N41-Y44 HydrophobicContact CB-CE2 3.65Å; N41-Y44 VanDerWaalsContact O-CD2 3.25Å; N41-Y44 WeakPolarHBondContact O-CD2 3.47Å; Y44-W53 HydrophobicContact CD1-CE3 4.41Å; Y44-W53 AromaticContact CD2-CE3 3.98Å; Y44-W53 HydrophobicContact CD2-CE3 3.98Å; Y44-W53 HydrophobicContact CD2-CZ3 4.09Å; Y44-W53 AromaticContact CG-CE3 3.87Å; Y44-W53 HydrophobicContact CG-CE3 3.87Å; Y44-W53 HydrophobicContact CG-CZ3 4.19Å
45	S	27.5	Very low	28.7	Very low	51 Å²	51	100.2 Å²	100.2	36%	0.357	55%	0.545	S	S	.	.			trans	-89.5	106.2	174.3	-55.8	0	0	0	0	110.5	S15	S15-S45 WeakPolarHBondContact CB-OG 3.42Å; S15-S45 PolarHBondContact OG-OG 3.25Å
46	R	26.1	Very low	29.2	Very low	218 Å²	218	99 Å²	99	82%	0.823	53%	0.525	S	S	*	.			trans	34.4	153.1	150.8	-157.1	176.9	-175	-173.2	2	120.4
47	V	26.2	Very low	29.7	Very low	124 Å²	124	96.6 Å²	96.6	75%	0.752	51%	0.513	S	S	*	.				-134.1	132.1	-102.8	165	0	0	0	0	104.5
48	D	25.4	Very low	30.2	Very low	71 Å²	71	95.2 Å²	95.2	38%	0.38	49%	0.494	S	S	.	.			trans	-93.8	162	162	84	11.1	0	0	0	110.4	D50	D48-D50 PolarHBondContact O-N 3.48Å; D48-D50 PolarHBondContact OD1-N 2.72Å
49	Q	23.6	Very low	30.8	Very low	196 Å²	196	89.5 Å²	89.5	92%	0.916	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	0.3	-167	-69.7	174.2	-23.6	0	0	115
50	D	27	Very low	31.4	Very low	114 Å²	114	86 Å²	86	61%	0.61	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	22.1	-170.7	-58.3	-22.6	0	0	0	113.6	D48 T52	D48-D50 PolarHBondContact O-N 3.48Å; D48-D50 PolarHBondContact OD1-N 2.72Å; D50-T52 VanDerWaalsContact C-N 3.26Å; D50-T52 PolarHBondContact O-N 3.11Å; D50-T52 VanDerWaalsContact O-N 3.12Å; D50-T52 PolarHBondContact O-OG1 2.9Å
51	M	23.5	Very low	32	Very low	161 Å²	161	83.7 Å²	83.7	79%	0.793	42%	0.416	S	S	*	.			trans	57.9	27.4	171.3	-65.6	-110.7	-71.1	0	0	115.4
52	T	25.5	Very low	32.5	Very low	61 Å²	61	82.2 Å²	82.2	37%	0.374	41%	0.405	S	S	.	.			trans	-101.1	115.5	179.9	-42.8	0	0	0	0	111.1	D50	D50-T52 VanDerWaalsContact C-N 3.26Å; D50-T52 PolarHBondContact O-N 3.11Å; D50-T52 VanDerWaalsContact O-N 3.12Å; D50-T52 PolarHBondContact O-OG1 2.9Å
53	W	27.6	Very low	33	Very low	85 Å²	85	74.8 Å²	74.8	32%	0.322	37%	0.371	S	S	.	.			trans	-79.2	131.4	-177	-60	81.8	0	0	0	111.5	P39 Y44	P39-W53 HydrophobicContact CB-CH2 4.41Å; P39-W53 HydrophobicContact CB-CZ2 3.81Å; P39-W53 HydrophobicContact CG-CZ2 4.19Å; Y44-W53 HydrophobicContact CD1-CE3 4.41Å; Y44-W53 AromaticContact CD2-CE3 3.98Å; Y44-W53 HydrophobicContact CD2-CE3 3.98Å; Y44-W53 HydrophobicContact CD2-CZ3 4.09Å; Y44-W53 AromaticContact CG-CE3 3.87Å; Y44-W53 HydrophobicContact CG-CE3 3.87Å; Y44-W53 HydrophobicContact CG-CZ3 4.19Å
54	V	28.3	Very low	33.6	Very low	56 Å²	56	74.8 Å²	74.8	34%	0.339	37%	0.371	S	S	.	.			trans	-118	132.3	179.1	-166.7	0	0	0	0	110.1
55	P	33.6	Very low	34.3	Very low	17 Å²	17	72.9 Å²	72.9	11%	0.11	37%	0.368	C	S	.	.			trans	-77.5	138.9	-179.6	30.3	-34.9	0	0	0	113.4	Q102	P55-Q102 HydrophobicContact CB-CG 3.65Å; P55-Q102 HydrophobicContact CG-CG 3.75Å
56	T	39	Very low	34.9	Very low	36 Å²	36	73.9 Å²	73.9	22%	0.221	36%	0.364	C	S	.	.			trans	-99.5	-2.6	-160.7	23.5	0	0	0	0	116.8	H43	H43-T56 PolarHBondContact O-OG1 3.14Å
57	N	44.1	Very low	35.3	Very low	33 Å²	33	67.1 Å²	67.1	18%	0.176	36%	0.355	C	S	.	.			trans	-125.3	128	175.2	-40.5	-73.3	0	0	0	111	Q102 V103 I105	N57-Q102 CarbonylContact O-C 3.55Å; N57-Q102 WeakPolarHBondContact O-CA 3.13Å; N57-V103 HydrophobicContact CB-CB 4.21Å; N57-V103 WeakPolarHBondContact CB-O 3.19Å; N57-V103 PolarHBondContact ND2-O 3.06Å; N57-V103 VanDerWaalsContact ND2-O 3.16Å; N57-V103 PolarHBondContact O-N 3.05Å; N57-I105 HydrophobicContact CB-CD1 4.34Å
58	F	40.7	Very low	35.8	Very low	42 Å²	42	68.1 Å²	68.1	18%	0.184	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	136.6	173	-65.2	-86.3	0	0	0	109.6	Y13 A101 Q102	Y13-F58 HydrophobicContact CD2-CB 3.99Å; Y13-F58 WeakPolarHBondContact CD2-O 3.09Å; Y13-F58 HydrophobicContact CE2-CB 3.94Å; F58-A101 CarbonylContact C-O 3.53Å; F58-A101 WeakPolarHBondContact CA-O 3.45Å; F58-Q102 HydrophobicContact CD1-CB 4.36Å; F58-Q102 HydrophobicContact CE1-CB 4.29Å
59	V	44.7	Very low	36.1	Very low	16 Å²	16	67.6 Å²	67.6	10%	0.097	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	126.1	170.7	164.2	0	0	0	0	108.8	L9 V10 F100 A101 V103	L9-V59 VanDerWaalsContact O-CG1 3.24Å; L9-V59 WeakPolarHBondContact O-CG1 3.44Å; V10-V59 HydrophobicContact CG1-CG2 3.99Å; V10-V59 HydrophobicContact CG2-CG1 4.35Å; V59-F100 WeakPolarHBondContact O-CA 2.96Å; V59-A101 HydrophobicContact CB-CB 4.4Å; V59-A101 PolarHBondContact N-O 2.95Å; V59-A101 PolarHBondContact O-N 3.23Å; V59-V103 HydrophobicContact CB-CG2 3.89Å; V59-V103 HydrophobicContact CG2-CB 4.4Å; V59-V103 HydrophobicContact CG2-CG2 3.34Å
60	L	43.6	Very low	36.3	Very low	30 Å²	30	64.8 Å²	64.8	16%	0.157	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	118	169.1	-83.2	146.9	0	0	0	109.2	L9 C11 V98 F100	L9-L60 CarbonylContact C-O 3.44Å; C11-L60 HydrophobicContact CB-CD1 3.94Å; L60-V98 HydrophobicContact CD2-CG1 3.89Å; L60-F100 HydrophobicContact CD2-CD1 4.04Å; L60-F100 HydrophobicContact CD2-CE1 3.49Å; L60-F100 VanDerWaalsContact CD2-CE1 3.49Å; L60-F100 HydrophobicContact CD2-CZ 3.88Å; L60-F100 HydrophobicContact CG-CD1 4.24Å; L60-F100 HydrophobicContact CG-CE1 3.99Å
61	C	44.3	Very low	36.6	Very low	18 Å²	18	63.3 Å²	63.3	12%	0.122	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	174.7	172.9	63.4	0	0	0	0	110.9	V98 A99	C61-V98 CarbonylContact O-C 3.58Å; C61-V98 WeakPolarHBondContact O-CA 3.28Å; C61-A99 PolarHBondContact N-O 3.03Å; C61-A99 PolarHBondContact O-N 3.19Å; C61-A99 VanDerWaalsContact SG-CB 3.55Å
62	F	43	Very low	36.7	Very low	72 Å²	72	60.6 Å²	60.6	32%	0.316	34%	0.34	S	S	.	.			trans	-85.5	139.1	174.9	-67.8	-81.9	0	0	0	110	H64 C65 Y66 D97	F62-H64 AromaticContact CG-CE1 3.78Å; F62-H64 PolarHBondContact O-N 2.97Å; F62-C65 HydrophobicContact CB-CB 4.46Å; F62-C65 WeakPolarHBondContact O-CA 3.45Å; F62-C65 VanDerWaalsContact O-CB 3.28Å; F62-C65 WeakPolarHBondContact O-CB 3.35Å; F62-C65 PolarHBondContact O-N 3.19Å; F62-Y66 PolarHBondContact O-N 2.65Å; F62-D97 WeakPolarHBondContact CA-O 3.27Å; F62-D97 WeakPolarHBondContact CB-OD1 3.24Å; F62-D97 HydrophobicContact CD1-CB 4.37Å; F62-D97 WeakPolarHBondContact CD1-O 3.17Å; F62-D97 WeakPolarHBondContact CD1-OD2 2.94Å
63	D	41.1	Very low	36.8	Very low	17 Å²	17	62.4 Å²	62.4	9%	0.091	35%	0.352	C	S	.	.	H	α-helix	trans	-62.1	-27.7	177.1	-169.9	57.3	0	0	0	111.8	C65 Y66 A67 R91 D97 A99	D63-C65 PolarHBondContact O-N 2.62Å; D63-Y66 WeakPolarHBondContact O-CB 3.17Å; D63-Y66 PolarHBondContact O-N 3.34Å; D63-A67 PolarHBondContact O-N 2.89Å; D63-R91 VanDerWaalsContact OD1-CG 3.31Å; D63-R91 WeakPolarHBondContact OD1-CG 3.4Å; D63-R91 IonicContact OD1-CZ 4Å; D63-R91 IonicContact OD1-NE 3.68Å; D63-R91 PolarHBondContact OD1-NE 3.46Å; D63-R91 IonicContact OD1-NH2 2.84Å; D63-R91 IonicContact OD2-CZ 3.06Å; D63-R91 IonicContact OD2-NE 3.63Å; D63-R91 PolarHBondContact OD2-NE 2.87Å; D63-R91 VanDerWaalsContact OD2-NE 3.09Å; D63-R91 IonicContact OD2-NH2 3.91Å; D63-R91 PolarHBondContact OD2-NH2 3.37Å; D63-D97 PolarHBondContact N-OD1 2.83Å; D63-D97 VanDerWaalsContact N-OD1 3.12Å; D63-A99 HydrophobicContact CB-CB 4.5Å
64	H	43.2	Very low	36.8	Very low	82 Å²	82	68.7 Å²	68.7	38%	0.38	38%	0.376	S	S	.	.	H	α-helix	trans	-71.9	-17.7	172.1	77.6	-99.8	0	0	0	113.5	F62 D97	F62-H64 AromaticContact CG-CE1 3.78Å; F62-H64 PolarHBondContact O-N 2.97Å; H64-D97 IonicContact CE1-OD1 3.21Å; H64-D97 IonicContact CE1-OD2 3.53Å; H64-D97 PolarHBondContact CE1-OD2 3.23Å; H64-D97 IonicContact CG-OD1 3.86Å; H64-D97 IonicContact CG-OD2 3.96Å; H64-D97 PolarHBondContact N-OD1 3.39Å; H64-D97 IonicContact ND1-OD1 2.65Å; H64-D97 PolarHBondContact ND1-OD1 3.27Å; H64-D97 IonicContact ND1-OD2 3.09Å; H64-D97 PolarHBondContact ND1-OD2 2.79Å
65	C	43.2	Very low	36.6	Very low	30 Å²	30	74 Å²	74	20%	0.203	40%	0.397	C	S	.	.	H	α-helix	trans	-82.3	-18.6	169.2	-64.6	0	0	0	0	111.6	F62 D63 T69	F62-C65 HydrophobicContact CB-CB 4.46Å; F62-C65 WeakPolarHBondContact O-CA 3.45Å; F62-C65 VanDerWaalsContact O-CB 3.28Å; F62-C65 WeakPolarHBondContact O-CB 3.35Å; F62-C65 PolarHBondContact O-N 3.19Å; D63-C65 PolarHBondContact O-N 2.62Å; C65-T69 PolarHBondContact O-OG1 3.21Å
66	Y	39.2	Very low	36.3	Very low	73 Å²	73	79 Å²	79	29%	0.286	42%	0.423	S	S	.	.	H	α-helix	trans	-74.6	-38.7	177.1	173.1	-77.9	0	0	0	112	F62 D63 D68 W88 A99	F62-Y66 PolarHBondContact O-N 2.65Å; D63-Y66 WeakPolarHBondContact O-CB 3.17Å; D63-Y66 PolarHBondContact O-N 3.34Å; Y66-D68 PolarHBondContact O-N 2.84Å; Y66-D68 VanDerWaalsContact O-N 3.09Å; Y66-W88 AromaticContact CD2-CD2 3.76Å; Y66-W88 HydrophobicContact CD2-CD2 3.76Å; Y66-W88 AromaticContact CD2-CE3 3.2Å; Y66-W88 HydrophobicContact CD2-CE3 3.2Å; Y66-W88 AromaticContact CD2-CH2 3.59Å; Y66-W88 HydrophobicContact CD2-CH2 3.59Å; Y66-W88 HydrophobicContact CD2-CZ2 4.13Å; Y66-W88 AromaticContact CD2-CZ3 3.11Å; Y66-W88 HydrophobicContact CD2-CZ3 3.11Å; Y66-W88 HydrophobicContact CE2-CB 4.08Å; Y66-W88 AromaticContact CE2-CD2 3.18Å; Y66-W88 HydrophobicContact CE2-CD2 3.18Å; Y66-W88 AromaticContact CE2-CE2 3.68Å; Y66-W88 AromaticContact CE2-CE3 3.13Å; Y66-W88 HydrophobicContact CE2-CE3 3.13Å; Y66-W88 AromaticContact CE2-CG 3.64Å; Y66-W88 HydrophobicContact CE2-CG 3.64Å; Y66-W88 AromaticContact CE2-CH2 3.95Å; Y66-W88 HydrophobicContact CE2-CH2 3.95Å; Y66-W88 HydrophobicContact CE2-CZ2 4.04Å; Y66-W88 AromaticContact CE2-CZ3 3.54Å; Y66-W88 HydrophobicContact CE2-CZ3 3.54Å; Y66-W88 HydrophobicContact CG-CE3 4.47Å; Y66-W88 HydrophobicContact CG-CH2 4.25Å; Y66-W88 HydrophobicContact CG-CZ3 4.08Å; Y66-A99 HydrophobicContact CD2-CB 4.29Å
67	A	35.1	Very low	35.6	Very low	76 Å²	76	87.9 Å²	87.9	63%	0.628	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-12.4	-174.8	0	0	0	0	0	114.9	D63	D63-A67 PolarHBondContact O-N 2.89Å
68	D	35.3	Very low	34.5	Very low	145 Å²	145	89.3 Å²	89.3	78%	0.775	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.2	9.5	-165.3	-122.9	-1.8	0	0	0	114.5	Y66	Y66-D68 PolarHBondContact O-N 2.84Å; Y66-D68 VanDerWaalsContact O-N 3.09Å
69	T	32.9	Very low	33.7	Very low	59 Å²	59	96.3 Å²	96.3	36%	0.362	50%	0.501	S	S	.	.			trans	-137.8	96.4	-169	62.9	0	0	0	0	115.7	C65 V71	C65-T69 PolarHBondContact O-OG1 3.21Å; T69-V71 VanDerWaalsContact CB-CG2 3.46Å; T69-V71 HydrophobicContact CG2-CG2 4.16Å; T69-V71 PolarHBondContact O-N 2.83Å
70	T	27.9	Very low	32.7	Very low	137 Å²	137	100.6 Å²	100.6	84%	0.84	54%	0.538	S	S	*	.				-58.3	87.3	130	31.9	0	0	0	0	107.8	T72	T70-T72 PolarHBondContact O-N 3.27Å
71	V	32.1	Very low	31.8	Very low	83 Å²	83	101.3 Å²	101.3	50%	0.503	55%	0.548	S	S	.	.			trans	-73.8	83.3	167.3	-175.2	0	0	0	0	107	T69 M85	T69-V71 VanDerWaalsContact CB-CG2 3.46Å; T69-V71 HydrophobicContact CG2-CG2 4.16Å; T69-V71 PolarHBondContact O-N 2.83Å; V71-M85 HydrophobicContact CB-CE 3.52Å; V71-M85 HydrophobicContact CG1-CE 4.17Å; V71-M85 HydrophobicContact CG2-CE 3.24Å
72	T	27.3	Very low	31	Very low	105 Å²	105	104.6 Å²	104.6	64%	0.644	56%	0.564	S	S	*	*			trans	-62.5	132.1	158.3	36.7	0	0	0	0	107.7	T70 R74	T70-T72 PolarHBondContact O-N 3.27Å; T72-R74 PolarHBondContact O-N 3.24Å
73	P	27	Very low	30.3	Very low	99 Å²	99	107.3 Å²	107.3	64%	0.643	58%	0.577	S	S	*	*			trans	-53.5	115.4	174.4	21.3	-30.9	0	0	0	108.1	E75	P73-E75 PolarHBondContact O-N 3.09Å
74	R	27	Very low	29.8	Very low	217 Å²	217	109.6 Å²	109.6	82%	0.819	59%	0.591	S	S	*	*			trans	-75.8	121.8	164.2	-79.7	-170.3	178.9	-148.1	-1	105.6	T72 N76	T72-R74 PolarHBondContact O-N 3.24Å; R74-N76 PolarHBondContact O-N 3.33Å
75	E	24.8	Very low	29.4	Very low	166 Å²	166	109.3 Å²	109.3	78%	0.776	59%	0.591	S	S	*	*			trans	-49.3	86.1	164.5	-68.7	179.5	162.5	0	0	109.5	P73 R77	P73-E75 PolarHBondContact O-N 3.09Å; E75-R77 PolarHBondContact O-N 3.25Å
76	N	26.8	Very low	28.8	Very low	122 Å²	122	108.4 Å²	108.4	65%	0.652	59%	0.587	S	S	*	*			trans	-81.3	85.1	170.1	-102.5	-14.4	0	0	0	106.6	R74 G78 Y79	R74-N76 PolarHBondContact O-N 3.33Å; N76-G78 PolarHBondContact O-N 3.32Å; N76-Y79 PolarHBondContact O-N 3.06Å
77	R	23.6	Very low	28.6	Very low	224 Å²	224	106 Å²	106	85%	0.845	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-42	102.8	166.7	-62.7	177.1	-179.5	-179.6	-2	109.4	E75	E75-R77 PolarHBondContact O-N 3.25Å
78	G	22.3	Very low	28.5	Very low	62 Å²	62	106.8 Å²	106.8	64%	0.639	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	114.1	-3.7	171.8	0	0	0	0	0	116.9	N76	N76-G78 PolarHBondContact O-N 3.32Å
79	Y	24.1	Very low	28.3	Very low	190 Å²	190	100.8 Å²	100.8	75%	0.745	54%	0.539	S	S	*	.			trans	-127.9	101.7	173.6	-67.3	-86.2	0	0	0	109.7	N76 A81	N76-Y79 PolarHBondContact O-N 3.06Å; Y79-A81 PolarHBondContact O-N 3.02Å
80	A	22.2	Very low	28.3	Very low	106 Å²	106	100 Å²	100	88%	0.876	54%	0.542	S	S	*	.			trans	-78.7	43.1	174	0	0	0	0	0	112.1
81	A	25.7	Very low	28.5	Very low	44 Å²	44	99.8 Å²	99.8	36%	0.364	53%	0.526	S	S	.	.			trans	-94.7	91.4	158	0	0	0	0	0	105.3	Y79 F83	Y79-A81 PolarHBondContact O-N 3.02Å; A81-F83 HydrophobicContact CB-CD2 3.94Å; A81-F83 HydrophobicContact CB-CE2 3.35Å; A81-F83 HydrophobicContact CB-CZ 3.69Å; A81-F83 WeakPolarHBondContact O-CD2 3.37Å; A81-F83 PolarHBondContact O-N 2.83Å
82	D	26.7	Very low	28.3	Very low	87 Å²	87	97 Å²	97	47%	0.465	51%	0.511	S	S	.	.			trans	-74.3	88.3	174.4	-153.8	0.8	0	0	0	107	T84 T104 M106	D82-T84 VanDerWaalsContact C-N 3.32Å; D82-T84 PolarHBondContact O-N 2.94Å; D82-T104 VanDerWaalsContact O-O 3.09Å; D82-M106 HydrophobicContact CB-CE 3.69Å; D82-M106 WeakPolarHBondContact OD2-CE 3.5Å
83	F	29	Very low	28.3	Very low	130 Å²	130	97.9 Å²	97.9	57%	0.57	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	89.4	177.8	-67.3	-84.8	0	0	0	108.4	A81 M85 V103	A81-F83 HydrophobicContact CB-CD2 3.94Å; A81-F83 HydrophobicContact CB-CE2 3.35Å; A81-F83 HydrophobicContact CB-CZ 3.69Å; A81-F83 WeakPolarHBondContact O-CD2 3.37Å; A81-F83 PolarHBondContact O-N 2.83Å; F83-M85 PolarHBondContact O-N 2.81Å; F83-V103 HydrophobicContact CD1-CG1 3.7Å; F83-V103 HydrophobicContact CE1-CG1 4.39Å
84	T	30.6	Very low	28.3	Very low	64 Å²	64	103.6 Å²	103.6	39%	0.393	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	112.5	165.4	-19.3	0	0	0	0	106.9	D82 G86 T104	D82-T84 VanDerWaalsContact C-N 3.32Å; D82-T84 PolarHBondContact O-N 2.94Å; T84-G86 VanDerWaalsContact C-N 3.29Å; T84-G86 PolarHBondContact O-N 3.45Å; T84-T104 PolarHBondContact O-N 2.84Å
85	M	33.9	Very low	28.5	Very low	77 Å²	77	102 Å²	102	38%	0.379	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	95.8	165.7	-70.5	-160.6	-51.9	0	0	107.4	V71 F83 W88 A101 Q102	V71-M85 HydrophobicContact CB-CE 3.52Å; V71-M85 HydrophobicContact CG1-CE 4.17Å; V71-M85 HydrophobicContact CG2-CE 3.24Å; F83-M85 PolarHBondContact O-N 2.81Å; M85-W88 HydrophobicContact CE-CH2 4.29Å; M85-A101 HydrophobicContact CG-CB 4.41Å; M85-A101 HydrophobicContact SD-CB 3.76Å; M85-Q102 CarbonylContact C-O 3.34Å; M85-Q102 WeakPolarHBondContact CA-O 3.43Å
86	G	31.8	Very low	28.9	Very low	11 Å²	11	98.3 Å²	98.3	11%	0.113	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	163.8	167.7	0	0	0	0	0	109.8	T84 Q102	T84-G86 VanDerWaalsContact C-N 3.29Å; T84-G86 PolarHBondContact O-N 3.45Å; G86-Q102 PolarHBondContact N-O 2.77Å; G86-Q102 WeakPolarHBondContact O-CB 3.28Å
87	S	34	Very low	29.5	Very low	21 Å²	21	95.5 Å²	95.5	15%	0.147	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-26.5	139.9	179.9	27.3	0	0	0	0	118	L32 Q102	L32-S87 WeakPolarHBondContact CD2-OG 3.24Å; S87-Q102 VanDerWaalsContact O-CB 3.29Å; S87-Q102 WeakPolarHBondContact O-CB 3.42Å; S87-Q102 PolarHBondContact O-OE1 3.16Å; S87-Q102 PolarHBondContact OG-OE1 3.43Å
88	W	33.6	Very low	30.1	Very low	94 Å²	94	87.2 Å²	87.2	36%	0.356	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	127.5	179.5	-54.4	100.9	0	0	0	112.1	Y66 M85	Y66-W88 AromaticContact CD2-CD2 3.76Å; Y66-W88 HydrophobicContact CD2-CD2 3.76Å; Y66-W88 AromaticContact CD2-CE3 3.2Å; Y66-W88 HydrophobicContact CD2-CE3 3.2Å; Y66-W88 AromaticContact CD2-CH2 3.59Å; Y66-W88 HydrophobicContact CD2-CH2 3.59Å; Y66-W88 HydrophobicContact CD2-CZ2 4.13Å; Y66-W88 AromaticContact CD2-CZ3 3.11Å; Y66-W88 HydrophobicContact CD2-CZ3 3.11Å; Y66-W88 HydrophobicContact CE2-CB 4.08Å; Y66-W88 AromaticContact CE2-CD2 3.18Å; Y66-W88 HydrophobicContact CE2-CD2 3.18Å; Y66-W88 AromaticContact CE2-CE2 3.68Å; Y66-W88 AromaticContact CE2-CE3 3.13Å; Y66-W88 HydrophobicContact CE2-CE3 3.13Å; Y66-W88 AromaticContact CE2-CG 3.64Å; Y66-W88 HydrophobicContact CE2-CG 3.64Å; Y66-W88 AromaticContact CE2-CH2 3.95Å; Y66-W88 HydrophobicContact CE2-CH2 3.95Å; Y66-W88 HydrophobicContact CE2-CZ2 4.04Å; Y66-W88 AromaticContact CE2-CZ3 3.54Å; Y66-W88 HydrophobicContact CE2-CZ3 3.54Å; Y66-W88 HydrophobicContact CG-CE3 4.47Å; Y66-W88 HydrophobicContact CG-CH2 4.25Å; Y66-W88 HydrophobicContact CG-CZ3 4.08Å; M85-W88 HydrophobicContact CE-CH2 4.29Å
89	G	31.5	Very low	30.9	Very low	18 Å²	18	84.3 Å²	84.3	19%	0.186	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	1.1	-171.3	0	0	0	0	0	116.5	F100	G89-F100 PolarHBondContact N-O 3.12Å
90	G	32.8	Very low	31.7	Very low	42 Å²	42	77 Å²	77	43%	0.433	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	144.8	146.3	178.4	0	0	0	0	0	113.2
91	R	30.6	Very low	32.7	Very low	133 Å²	133	72 Å²	72	50%	0.502	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	130	177	-153.5	175.6	-176.8	-165.1	-6.5	107.9	D63 D93	D63-R91 VanDerWaalsContact OD1-CG 3.31Å; D63-R91 WeakPolarHBondContact OD1-CG 3.4Å; D63-R91 IonicContact OD1-CZ 4Å; D63-R91 IonicContact OD1-NE 3.68Å; D63-R91 PolarHBondContact OD1-NE 3.46Å; D63-R91 IonicContact OD1-NH2 2.84Å; D63-R91 IonicContact OD2-CZ 3.06Å; D63-R91 IonicContact OD2-NE 3.63Å; D63-R91 PolarHBondContact OD2-NE 2.87Å; D63-R91 VanDerWaalsContact OD2-NE 3.09Å; D63-R91 IonicContact OD2-NH2 3.91Å; D63-R91 PolarHBondContact OD2-NH2 3.37Å; R91-D93 PolarHBondContact O-N 3.14Å
92	S	29.6	Very low	33.4	Very low	25 Å²	25	70.4 Å²	70.4	18%	0.175	35%	0.354	C	S	.	.			trans	-78.3	115	163.6	-177.6	0	0	0	0	108.5	Y94 N96	S92-Y94 PolarHBondContact O-N 2.99Å; S92-Y94 VanDerWaalsContact O-N 3.13Å; S92-N96 VanDerWaalsContact OG-CB 3.3Å; S92-N96 WeakPolarHBondContact OG-CB 3.17Å; S92-N96 PolarHBondContact OG-ND2 3.44Å
93	D	26.9	Very low	34	Very low	124 Å²	124	66.7 Å²	66.7	66%	0.663	33%	0.334	S	S	*	.			trans	-12.7	104.3	148.6	42.5	-23	0	0	0	114.6	R91 Q95	R91-D93 PolarHBondContact O-N 3.14Å; D93-Q95 PolarHBondContact O-N 2.91Å
94	Y	27.2	Very low	34.2	Very low	218 Å²	218	62.1 Å²	62.1	86%	0.855	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	20.4	-3.9	164.3	-78.1	-82.4	0	0	0	123	S92	S92-Y94 PolarHBondContact O-N 2.99Å; S92-Y94 VanDerWaalsContact O-N 3.13Å
95	Q	30.6	Very low	34.3	Very low	183 Å²	183	61.5 Å²	61.5	86%	0.855	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.9	-17.7	-177.7	-65.3	-173.9	5.4	0	0	112.3	D93	D93-Q95 PolarHBondContact O-N 2.91Å
96	N	33.5	Very low	33.9	Very low	89 Å²	89	61.9 Å²	61.9	48%	0.476	31%	0.313	S	S	.	.			trans	-116.3	124.6	175.5	-48	-67.2	0	0	0	111.7	S92 V98	S92-N96 VanDerWaalsContact OG-CB 3.3Å; S92-N96 WeakPolarHBondContact OG-CB 3.17Å; S92-N96 PolarHBondContact OG-ND2 3.44Å; N96-V98 PolarHBondContact O-N 3.45Å
97	D	39.2	Very low	33.6	Very low	64 Å²	64	65 Å²	65	34%	0.342	33%	0.332	S	S	.	.			trans	-84	59.6	-179.5	-174.1	24.3	0	0	0	110.8	F62 D63 H64	F62-D97 WeakPolarHBondContact CA-O 3.27Å; F62-D97 WeakPolarHBondContact CB-OD1 3.24Å; F62-D97 HydrophobicContact CD1-CB 4.37Å; F62-D97 WeakPolarHBondContact CD1-O 3.17Å; F62-D97 WeakPolarHBondContact CD1-OD2 2.94Å; D63-D97 PolarHBondContact N-OD1 2.83Å; D63-D97 VanDerWaalsContact N-OD1 3.12Å; H64-D97 IonicContact CE1-OD1 3.21Å; H64-D97 IonicContact CE1-OD2 3.53Å; H64-D97 PolarHBondContact CE1-OD2 3.23Å; H64-D97 IonicContact CG-OD1 3.86Å; H64-D97 IonicContact CG-OD2 3.96Å; H64-D97 PolarHBondContact N-OD1 3.39Å; H64-D97 IonicContact ND1-OD1 2.65Å; H64-D97 PolarHBondContact ND1-OD1 3.27Å; H64-D97 IonicContact ND1-OD2 3.09Å; H64-D97 PolarHBondContact ND1-OD2 2.79Å
98	V	36	Very low	32.9	Very low	49 Å²	49	69.2 Å²	69.2	30%	0.297	36%	0.361	S	S	.	.			trans	-136.5	133.7	-175.8	-175.7	0	0	0	0	110.1	L60 C61 N96	L60-V98 HydrophobicContact CD2-CG1 3.89Å; C61-V98 CarbonylContact O-C 3.58Å; C61-V98 WeakPolarHBondContact O-CA 3.28Å; N96-V98 PolarHBondContact O-N 3.45Å
99	A	39.5	Very low	32.3	Very low	1 Å²	1	69 Å²	69	1%	0.008	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	154.3	176.7	0	0	0	0	0	110.7	C61 D63 Y66	C61-A99 PolarHBondContact N-O 3.03Å; C61-A99 PolarHBondContact O-N 3.19Å; C61-A99 VanDerWaalsContact SG-CB 3.55Å; D63-A99 HydrophobicContact CB-CB 4.5Å; Y66-A99 HydrophobicContact CD2-CB 4.29Å
100	F	41.7	Very low	31.9	Very low	37 Å²	37	75.8 Å²	75.8	16%	0.162	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	120.5	175.2	-61.6	-93.3	0	0	0	109.2	W24 V59 L60 G89	W24-F100 HydrophobicContact CH2-CE2 4.26Å; W24-F100 HydrophobicContact CH2-CZ 4.04Å; W24-F100 HydrophobicContact CZ3-CE2 4.48Å; W24-F100 HydrophobicContact CZ3-CZ 4.24Å; V59-F100 WeakPolarHBondContact O-CA 2.96Å; L60-F100 HydrophobicContact CD2-CD1 4.04Å; L60-F100 HydrophobicContact CD2-CE1 3.49Å; L60-F100 VanDerWaalsContact CD2-CE1 3.49Å; L60-F100 HydrophobicContact CD2-CZ 3.88Å; L60-F100 HydrophobicContact CG-CD1 4.24Å; L60-F100 HydrophobicContact CG-CE1 3.99Å; G89-F100 PolarHBondContact N-O 3.12Å
101	A	41.6	Very low	31.2	Very low	1 Å²	1	86.2 Å²	86.2	1%	0.008	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	120.2	171.6	0	0	0	0	0	108.8	F58 V59 M85 V103	F58-A101 CarbonylContact C-O 3.53Å; F58-A101 WeakPolarHBondContact CA-O 3.45Å; V59-A101 HydrophobicContact CB-CB 4.4Å; V59-A101 PolarHBondContact N-O 2.95Å; V59-A101 PolarHBondContact O-N 3.23Å; M85-A101 HydrophobicContact CG-CB 4.41Å; M85-A101 HydrophobicContact SD-CB 3.76Å; A101-V103 PolarHBondContact O-N 3.09Å
102	Q	42	Very low	30.7	Very low	11 Å²	11	83.2 Å²	83.2	5%	0.051	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	136	168.7	167.6	-164.8	-17.1	0	0	108.3	P55 N57 F58 M85 G86 S87	P55-Q102 HydrophobicContact CB-CG 3.65Å; P55-Q102 HydrophobicContact CG-CG 3.75Å; N57-Q102 CarbonylContact O-C 3.55Å; N57-Q102 WeakPolarHBondContact O-CA 3.13Å; F58-Q102 HydrophobicContact CD1-CB 4.36Å; F58-Q102 HydrophobicContact CE1-CB 4.29Å; M85-Q102 CarbonylContact C-O 3.34Å; M85-Q102 WeakPolarHBondContact CA-O 3.43Å; G86-Q102 PolarHBondContact N-O 2.77Å; G86-Q102 WeakPolarHBondContact O-CB 3.28Å; S87-Q102 VanDerWaalsContact O-CB 3.29Å; S87-Q102 WeakPolarHBondContact O-CB 3.42Å; S87-Q102 PolarHBondContact O-OE1 3.16Å; S87-Q102 PolarHBondContact OG-OE1 3.43Å
103	V	38.3	Very low	30.2	Very low	8 Å²	8	88.9 Å²	88.9	5%	0.048	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	120.5	176.4	178.5	0	0	0	0	109.2	N57 V59 F83 A101 I105	N57-V103 HydrophobicContact CB-CB 4.21Å; N57-V103 WeakPolarHBondContact CB-O 3.19Å; N57-V103 PolarHBondContact ND2-O 3.06Å; N57-V103 VanDerWaalsContact ND2-O 3.16Å; N57-V103 PolarHBondContact O-N 3.05Å; V59-V103 HydrophobicContact CB-CG2 3.89Å; V59-V103 HydrophobicContact CG2-CB 4.4Å; V59-V103 HydrophobicContact CG2-CG2 3.34Å; F83-V103 HydrophobicContact CD1-CG1 3.7Å; F83-V103 HydrophobicContact CE1-CG1 4.39Å; A101-V103 PolarHBondContact O-N 3.09Å; V103-I105 HydrophobicContact CG1-CG1 3.8Å; V103-I105 PolarHBondContact O-N 2.84Å
104	T	33.7	Very low	29.9	Very low	35 Å²	35	89.2 Å²	89.2	22%	0.215	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	111.7	163.5	-53	0	0	0	0	106.9	D82 T84 M106	D82-T104 VanDerWaalsContact O-O 3.09Å; T84-T104 PolarHBondContact O-N 2.84Å; T104-M106 HydrophobicContact CG2-CG 3.98Å
105	I	31.8	Very low	29.6	Very low	50 Å²	50	88.5 Å²	88.5	26%	0.256	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	105.8	168.3	-55.8	177.3	0	0	0	105.8	L12 N57 V103 C107	L12-I105 HydrophobicContact CD2-CD1 4.12Å; N57-I105 HydrophobicContact CB-CD1 4.34Å; V103-I105 HydrophobicContact CG1-CG1 3.8Å; V103-I105 PolarHBondContact O-N 2.84Å; I105-C107 VanDerWaalsContact CG2-SG 3.58Å; I105-C107 PolarHBondContact O-N 2.74Å
106	M	26.7	Very low	29.2	Very low	85 Å²	85	83.3 Å²	83.3	42%	0.419	46%	0.461	S	S	.	.			trans	-85.8	103.5	169.3	-66.9	-168.6	-68.6	0	0	108.6	D82 T104	D82-M106 HydrophobicContact CB-CE 3.69Å; D82-M106 WeakPolarHBondContact OD2-CE 3.5Å; T104-M106 HydrophobicContact CG2-CG 3.98Å
107	C	24.2	Very low	28.6	Very low	78 Å²	78	89.2 Å²	89.2	53%	0.527	48%	0.477	S	S	.	.			trans	-98.8	90.6	169.8	-73.8	0	0	0	0	108.3	H43 I105 P109	H43-C107 PolarHBondContact CE1-O 3.2Å; H43-C107 PolarHBondContact NE2-O 3.49Å; I105-C107 VanDerWaalsContact CG2-SG 3.58Å; I105-C107 PolarHBondContact O-N 2.74Å; C107-P109 VanDerWaalsContact O-CD 3.27Å; C107-P109 WeakPolarHBondContact O-CD 3.29Å
108	C	20.7	Very low	27.7	Very low	109 Å²	109	95.1 Å²	95.1	74%	0.736	50%	0.502	S	S	*	.			trans	-60.1	120.4	172.7	-84.3	0	0	0	0	110.6	F110	C108-F110 HydrophobicContact CB-CD2 4.38Å; C108-F110 PolarHBondContact O-N 2.79Å
109	P	21.3	Very low	27.1	Very low	88 Å²	88	99.6 Å²	99.6	57%	0.571	53%	0.529	S	S	*	.			trans	-84.5	63	172.4	36.2	-32.3	0	0	0	108.7	C107	C107-P109 VanDerWaalsContact O-CD 3.27Å; C107-P109 WeakPolarHBondContact O-CD 3.29Å
110	F	21.4	Very low	26.2	Very low	162 Å²	162	105.6 Å²	105.6	71%	0.711	57%	0.565	S	S	*	*			trans	-129.5	108.4	-178.2	-74.9	-80	0	0	0	112	C108 A112	C108-F110 HydrophobicContact CB-CD2 4.38Å; C108-F110 PolarHBondContact O-N 2.79Å; F110-A112 PolarHBondContact O-N 2.66Å
111	R	19.1	Very low	25.3	Very low	261 Å²	261	109 Å²	109	99%	0.985	59%	0.591	S	S	*	*			trans	-40.5	85	142.7	-107.5	177.7	171.5	179.8	-1.7	108.5
112	A	20.6	Very low	24.5	Very low	69 Å²	69	116.8 Å²	116.8	57%	0.57	63%	0.632	S	S	*	*			trans	-112.5	100.5	166.8	0	0	0	0	0	106.1	F110 L114	F110-A112 PolarHBondContact O-N 2.66Å; A112-L114 VanDerWaalsContact C-N 3.32Å; A112-L114 PolarHBondContact O-N 3.48Å
113	T	18.7	Very low	23.7	Very low	144 Å²	144	121.5 Å²	121.5	88%	0.883	66%	0.663	S	S	*	*			trans	-46.6	94.2	164.5	42.8	0	0	0	0	110.2
114	L	21.2	Very low	23	Very low	132 Å²	132	126.8 Å²	126.8	69%	0.691	70%	0.698	S	S	*	*			trans	-113.8	96.5	164.6	-77.2	167.3	0	0	0	106.2	A112 G116	A112-L114 VanDerWaalsContact C-N 3.32Å; A112-L114 PolarHBondContact O-N 3.48Å; L114-G116 PolarHBondContact O-N 3.25Å; L114-G116 VanDerWaalsContact O-N 3.13Å
115	Q	19.5	Very low	22.6	Very low	202 Å²	202	128.9 Å²	128.9	94%	0.944	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.8	119.2	169.8	-70.8	174.9	-32.9	0	0	109
116	G	22.2	Very low	22.2	Very low	75 Å²	75	131.1 Å²	131.1	77%	0.773	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	117.9	9.9	169.2	0	0	0	0	0	118.4	L114	L114-G116 PolarHBondContact O-N 3.25Å; L114-G116 VanDerWaalsContact O-N 3.13Å
117	W	21.5	Very low	22.1	Very low	213 Å²	213	137.2 Å²	137.2	81%	0.807	76%	0.756	S	S	*	*			trans	-129.6	123.3	178.1	-60.2	85.9	0	0	0	112.3
118	E	21.2	Very low	22.1	Very low	188 Å²	188	136.7 Å²	136.7	88%	0.879	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-91.4	143.3	175.7	-93.2	-175.3	151.9	0	0	111.7
119	V	22	Very low	22.4	Very low	142 Å²	142	137.4 Å²	137.4	86%	0.861	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-77.1	120.4	173.4	177.2	0	0	0	0	109.1
120	V	21.8	Very low	22.6	Very low	127 Å²	127	137.4 Å²	137.4	77%	0.77	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-101.2	123	172.1	-174.8	0	0	0	0	109.3
121	P	22.4	Very low	22.8	Very low	110 Å²	110	136.5 Å²	136.5	71%	0.714	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-65.2	142.5	176.6	24	-30.1	0	0	0	111.4
122	L	25	Very low	23.2	Very low	163 Å²	163	129.3 Å²	129.3	85%	0.853	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-55.5	139.1	174.1	-75.7	164.8	0	0	0	110.4
123	P	23.8	Very low	23.5	Very low	110 Å²	110	134.2 Å²	134.2	71%	0.714	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-61.1	139.2	171.7	25.2	-31.2	0	0	0	109.3	S125	P123-S125 PolarHBondContact O-N 2.94Å
124	P	24	Very low	23.9	Very low	120 Å²	120	128.8 Å²	128.8	78%	0.779	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-58.6	137.6	177.1	23.1	-31.4	0	0	0	110.2
125	S	25.5	Very low	24.3	Very low	78 Å²	78	124.7 Å²	124.7	55%	0.545	70%	0.699	S	S	.	*	P	Polyproline II helix	trans	-52.7	137.1	172.6	-174.4	0	0	0	0	110.1	P123 K127	P123-S125 PolarHBondContact O-N 2.94Å; S125-K127 PolarHBondContact O-N 3.31Å; S125-K127 VanDerWaalsContact O-N 3.14Å
126	P	23.9	Very low	24.9	Very low	97 Å²	97	117 Å²	117	63%	0.63	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-56	122	175	-17.8	28.8	0	0	0	109.3	S128	P126-S128 PolarHBondContact O-N 3.14Å
127	K	23.6	Very low	25.1	Very low	214 Å²	214	118 Å²	118	93%	0.93	66%	0.655	S	S	*	*	S	Bend	trans	-65.4	5.2	-175.3	-76.4	-174.9	174	-179.4	0	115.1	S125	S125-K127 PolarHBondContact O-N 3.31Å; S125-K127 VanDerWaalsContact O-N 3.14Å
128	S	25	Very low	25.6	Very low	67 Å²	67	112 Å²	112	47%	0.469	64%	0.642	S	S	.	*			trans	-158.1	118.1	176.4	55.3	0	0	0	0	111.3	P126 S130	P126-S128 PolarHBondContact O-N 3.14Å; S128-S130 PolarHBondContact O-N 2.62Å; S128-S130 VanDerWaalsContact O-N 3.11Å
129	I	26.8	Very low	26.3	Very low	123 Å²	123	104.5 Å²	104.5	63%	0.631	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-72	8.1	172.7	-65.7	170.1	0	0	0	111.4	D131 F136	I129-D131 PolarHBondContact O-N 2.9Å; I129-F136 HydrophobicContact CG2-CZ 4.21Å
130	S	25	Very low	26.8	Very low	89 Å²	89	105.6 Å²	105.6	62%	0.622	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-76.7	-18.2	-174.4	58	0	0	0	0	115.4	S128	S128-S130 PolarHBondContact O-N 2.62Å; S128-S130 VanDerWaalsContact O-N 3.11Å
131	D	25.8	Very low	27.5	Very low	142 Å²	142	104.4 Å²	104.4	76%	0.759	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-117.9	12	-169.7	-70	-9.2	0	0	0	114.6	I129	I129-D131 PolarHBondContact O-N 2.9Å
132	L	27.6	Very low	28.3	Very low	110 Å²	110	102.2 Å²	102.2	58%	0.576	57%	0.572	S	S	*	*			trans	-89.6	113.8	169.3	-74.2	163.8	0	0	0	108.5	C134 F136	L132-C134 HydrophobicContact CB-CB 4.36Å; L132-C134 PolarHBondContact O-N 3.3Å; L132-F136 WeakPolarHBondContact O-CE2 3.21Å
133	D	26.3	Very low	28.9	Very low	173 Å²	173	95.5 Å²	95.5	93%	0.925	54%	0.54	S	S	*	.			trans	-64.2	53.2	156.6	-82.2	-38	0	0	0	109.8
134	C	28	Very low	29.4	Very low	29 Å²	29	93.1 Å²	93.1	20%	0.196	53%	0.525	C	S	.	.			trans	-63.6	143.7	171.1	-155.7	0	0	0	0	106.5	L132 F136	L132-C134 HydrophobicContact CB-CB 4.36Å; L132-C134 PolarHBondContact O-N 3.3Å; C134-F136 HydrophobicContact CB-CD1 4.18Å; C134-F136 HydrophobicContact CB-CD2 3.31Å; C134-F136 HydrophobicContact CB-CE1 4.05Å; C134-F136 HydrophobicContact CB-CE2 3.15Å; C134-F136 HydrophobicContact CB-CG 3.84Å; C134-F136 HydrophobicContact CB-CZ 3.54Å; C134-F136 WeakPolarHBondContact O-CA 3.48Å; C134-F136 VanDerWaalsContact O-CB 3.24Å; C134-F136 WeakPolarHBondContact O-CB 3.17Å; C134-F136 WeakPolarHBondContact O-CD2 3.47Å; C134-F136 WeakPolarHBondContact O-CG 3.31Å; C134-F136 PolarHBondContact O-N 2.76Å
135	P	29.7	Very low	30.1	Very low	46 Å²	46	96.1 Å²	96.1	30%	0.299	52%	0.52	S	S	.	.			trans	-61.8	76.8	173.4	28.7	-40.2	0	0	0	111.1	P137 Q161	P135-P137 VanDerWaalsContact C-CD 3.45Å; P135-Q161 VanDerWaalsContact CG-CD 3.42Å; P135-Q161 HydrophobicContact CG-CG 4.15Å; P135-Q161 VanDerWaalsContact CG-NE2 3.31Å
136	F	31.6	Very low	30.6	Very low	42 Å²	42	95.5 Å²	95.5	18%	0.184	51%	0.508	C	S	.	.	H	α-helix	trans	-87.7	-5.9	-157.4	-98.5	-54.2	0	0	0	115.9	I129 L132 C134 I139 R140	I129-F136 HydrophobicContact CG2-CZ 4.21Å; L132-F136 WeakPolarHBondContact O-CE2 3.21Å; C134-F136 HydrophobicContact CB-CD1 4.18Å; C134-F136 HydrophobicContact CB-CD2 3.31Å; C134-F136 HydrophobicContact CB-CE1 4.05Å; C134-F136 HydrophobicContact CB-CE2 3.15Å; C134-F136 HydrophobicContact CB-CG 3.84Å; C134-F136 HydrophobicContact CB-CZ 3.54Å; C134-F136 WeakPolarHBondContact O-CA 3.48Å; C134-F136 VanDerWaalsContact O-CB 3.24Å; C134-F136 WeakPolarHBondContact O-CB 3.17Å; C134-F136 WeakPolarHBondContact O-CD2 3.47Å; C134-F136 WeakPolarHBondContact O-CG 3.31Å; C134-F136 PolarHBondContact O-N 2.76Å; F136-I139 HydrophobicContact CD1-CB 4.29Å; F136-I139 HydrophobicContact CD1-CG2 4.35Å; F136-I139 HydrophobicContact CE1-CG2 4.3Å; F136-R140 HydrophobicContact CB-CG 4.12Å; F136-R140 HydrophobicContact CD1-CG 3.82Å; F136-R140 HydrophobicContact CG-CG 4.3Å; F136-R140 WeakPolarHBondContact O-CA 3.32Å; F136-R140 WeakPolarHBondContact O-CB 3.45Å; F136-R140 VanDerWaalsContact O-CD 3.28Å; F136-R140 WeakPolarHBondContact O-CD 3.25Å; F136-R140 WeakPolarHBondContact O-CG 3.45Å; F136-R140 PolarHBondContact O-N 3.23Å
137	P	26.9	Very low	31	Very low	94 Å²	94	94.1 Å²	94.1	61%	0.61	50%	0.498	S	S	*	.	H	α-helix	trans	-67.5	-42.3	171.8	-20.5	32.2	0	0	0	112.2	P135 N141	P135-P137 VanDerWaalsContact C-CD 3.45Å; P137-N141 WeakPolarHBondContact O-CB 3.47Å; P137-N141 PolarHBondContact O-N 3.13Å; P137-N141 PolarHBondContact O-ND2 2.83Å; P137-N141 VanDerWaalsContact O-ND2 3.14Å
138	V	32.8	Very low	31.4	Very low	89 Å²	89	90.8 Å²	90.8	54%	0.539	49%	0.486	S	S	.	.	H	α-helix	trans	-73.9	-46.4	-176.8	-178.3	0	0	0	0	110.2	N141 C142	V138-N141 PolarHBondContact O-N 3.21Å; V138-N141 VanDerWaalsContact O-N 3.14Å; V138-C142 VanDerWaalsContact O-CB 3.29Å; V138-C142 WeakPolarHBondContact O-CB 3.39Å; V138-C142 PolarHBondContact O-N 3.11Å; V138-C142 PolarHBondContact O-SG 3.43Å
139	I	34.5	Very low	31.8	Very low	29 Å²	29	93.8 Å²	93.8	15%	0.149	49%	0.492	C	S	.	.	H	α-helix	trans	-68.1	-38.1	177.4	-62.2	170.2	0	0	0	111.1	L9 F136 N141 C142 A143 A158	L9-I139 HydrophobicContact CD1-CD1 4.39Å; F136-I139 HydrophobicContact CD1-CB 4.29Å; F136-I139 HydrophobicContact CD1-CG2 4.35Å; F136-I139 HydrophobicContact CE1-CG2 4.3Å; I139-N141 VanDerWaalsContact C-N 3.25Å; I139-N141 PolarHBondContact O-N 2.75Å; I139-C142 PolarHBondContact O-N 3.42Å; I139-A143 WeakPolarHBondContact O-CB 3.4Å; I139-A143 PolarHBondContact O-N 3.1Å; I139-A158 HydrophobicContact CD1-CB 3.84Å
140	R	33.1	Very low	31.9	Very low	166 Å²	166	89.1 Å²	89.1	63%	0.626	47%	0.469	S	S	*	.	H	α-helix	trans	-69.6	-18.5	172.4	-68.8	171.5	-175.8	177.1	4.1	113.5	F136 P144	F136-R140 HydrophobicContact CB-CG 4.12Å; F136-R140 HydrophobicContact CD1-CG 3.82Å; F136-R140 HydrophobicContact CG-CG 4.3Å; F136-R140 WeakPolarHBondContact O-CA 3.32Å; F136-R140 WeakPolarHBondContact O-CB 3.45Å; F136-R140 VanDerWaalsContact O-CD 3.28Å; F136-R140 WeakPolarHBondContact O-CD 3.25Å; F136-R140 WeakPolarHBondContact O-CG 3.45Å; F136-R140 PolarHBondContact O-N 3.23Å; R140-P144 WeakPolarHBondContact O-CD 3.41Å; R140-P144 WeakPolarHBondContact O-CG 3.29Å
141	N	37.2	Very low	32	Very low	102 Å²	102	95.4 Å²	95.4	55%	0.545	48%	0.479	S	S	.	.	H	α-helix	trans	-91.2	-33.9	173.7	-77.2	-22.4	0	0	0	112.2	P137 V138 I139 R145	P137-N141 WeakPolarHBondContact O-CB 3.47Å; P137-N141 PolarHBondContact O-N 3.13Å; P137-N141 PolarHBondContact O-ND2 2.83Å; P137-N141 VanDerWaalsContact O-ND2 3.14Å; V138-N141 PolarHBondContact O-N 3.21Å; V138-N141 VanDerWaalsContact O-N 3.14Å; I139-N141 VanDerWaalsContact C-N 3.25Å; I139-N141 PolarHBondContact O-N 2.75Å; N141-R145 WeakPolarHBondContact O-CD 3.3Å; N141-R145 VanDerWaalsContact O-CG 3.3Å; N141-R145 WeakPolarHBondContact O-CG 3.41Å
142	C	37.9	Very low	32.3	Very low	63 Å²	63	92.4 Å²	92.4	43%	0.426	46%	0.457	S	S	.	.	H	α-helix	trans	-77	-42.8	178.3	-70.4	0	0	0	0	111.4	V138 I139 R145 F146	V138-C142 VanDerWaalsContact O-CB 3.29Å; V138-C142 WeakPolarHBondContact O-CB 3.39Å; V138-C142 PolarHBondContact O-N 3.11Å; V138-C142 PolarHBondContact O-SG 3.43Å; I139-C142 PolarHBondContact O-N 3.42Å; C142-R145 PolarHBondContact O-N 3.41Å; C142-F146 WeakPolarHBondContact O-CB 2.86Å; C142-F146 PolarHBondContact O-N 2.71Å
143	A	37.9	Very low	32.5	Very low	22 Å²	22	95.2 Å²	95.2	18%	0.182	47%	0.473	C	S	.	.	H	α-helix	trans	-59.5	-48.6	-177.1	0	0	0	0	0	112.7	I139 R145 F146 T147 I156	I139-A143 WeakPolarHBondContact O-CB 3.4Å; I139-A143 PolarHBondContact O-N 3.1Å; A143-R145 PolarHBondContact O-N 3.2Å; A143-F146 CarbonylContact O-C 3.56Å; A143-F146 WeakPolarHBondContact O-CB 3.2Å; A143-F146 PolarHBondContact O-N 3Å; A143-F146 VanDerWaalsContact O-N 3.11Å; A143-T147 WeakPolarHBondContact O-CB 3.06Å; A143-T147 VanDerWaalsContact O-CG2 3.28Å; A143-T147 WeakPolarHBondContact O-CG2 3.29Å; A143-T147 PolarHBondContact O-N 3.37Å; A143-T147 PolarHBondContact O-OG1 2.86Å; A143-T147 VanDerWaalsContact O-OG1 3.1Å; A143-I156 HydrophobicContact CB-CD1 3.52Å
144	P	34	Very low	32.8	Very low	61 Å²	61	89.5 Å²	89.5	40%	0.396	44%	0.441	S	S	.	.	H	α-helix	trans	-65.2	-36.9	178	-23.4	35.7	0	0	0	113.6	R140 F146 T147 Q148	R140-P144 WeakPolarHBondContact O-CD 3.41Å; R140-P144 WeakPolarHBondContact O-CG 3.29Å; P144-F146 PolarHBondContact O-N 3.38Å; P144-T147 VanDerWaalsContact CA-OG1 3.29Å; P144-T147 WeakPolarHBondContact CA-OG1 3.3Å; P144-T147 PolarHBondContact O-OG1 3.21Å; P144-Q148 WeakPolarHBondContact O-CB 2.79Å; P144-Q148 WeakPolarHBondContact O-CG 3.34Å; P144-Q148 PolarHBondContact O-N 3.37Å
145	R	39.2	Very low	33.2	Very low	182 Å²	182	93.4 Å²	93.4	69%	0.687	46%	0.46	S	S	*	.	H	α-helix	trans	-66	-30.8	175	-70.5	179.5	-179.5	-165.3	-0.3	111.5	N141 C142 A143 H149	N141-R145 WeakPolarHBondContact O-CD 3.3Å; N141-R145 VanDerWaalsContact O-CG 3.3Å; N141-R145 WeakPolarHBondContact O-CG 3.41Å; C142-R145 PolarHBondContact O-N 3.41Å; A143-R145 PolarHBondContact O-N 3.2Å; R145-H149 PolarHBondContact O-CD2 3.16Å
146	F	35	Very low	33.5	Very low	65 Å²	65	94.3 Å²	94.3	29%	0.285	46%	0.462	S	S	.	.	H	α-helix	trans	-81.7	-42.4	178.5	-162.2	-98.9	0	0	0	111.9	Y13 C142 A143 P144 Q148 H149 V150 M154	Y13-F146 AromaticContact CE1-CE1 3.66Å; Y13-F146 HydrophobicContact CE1-CE1 3.66Å; Y13-F146 AromaticContact CE1-CZ 3.42Å; Y13-F146 HydrophobicContact CE1-CZ 3.42Å; Y13-F146 VanDerWaalsContact CE1-CZ 3.42Å; Y13-F146 AromaticContact CZ-CE1 3.96Å; Y13-F146 AromaticContact CZ-CZ 3.51Å; Y13-F146 WeakPolarHBondContact OH-CE1 3.46Å; Y13-F146 WeakPolarHBondContact OH-CE2 3.28Å; Y13-F146 WeakPolarHBondContact OH-CZ 3.49Å; C142-F146 WeakPolarHBondContact O-CB 2.86Å; C142-F146 PolarHBondContact O-N 2.71Å; A143-F146 CarbonylContact O-C 3.56Å; A143-F146 WeakPolarHBondContact O-CB 3.2Å; A143-F146 PolarHBondContact O-N 3Å; A143-F146 VanDerWaalsContact O-N 3.11Å; P144-F146 PolarHBondContact O-N 3.38Å; F146-Q148 VanDerWaalsContact C-N 3.28Å; F146-Q148 PolarHBondContact O-N 3.32Å; F146-H149 PolarHBondContact O-N 3.08Å; F146-V150 HydrophobicContact CE1-CG2 4.12Å; F146-M154 HydrophobicContact CD1-CE 3.52Å; F146-M154 HydrophobicContact CD1-SD 4.17Å; F146-M154 HydrophobicContact CE1-CE 3.69Å; F146-M154 HydrophobicContact CE1-SD 3.74Å
147	T	33.9	Very low	33.7	Very low	68 Å²	68	97.4 Å²	97.4	42%	0.417	47%	0.473	S	S	.	.	H	α-helix	trans	-71.9	-18.1	176.8	59.4	0	0	0	0	113.1	A143 P144 H149 V150 M154	A143-T147 WeakPolarHBondContact O-CB 3.06Å; A143-T147 VanDerWaalsContact O-CG2 3.28Å; A143-T147 WeakPolarHBondContact O-CG2 3.29Å; A143-T147 PolarHBondContact O-N 3.37Å; A143-T147 PolarHBondContact O-OG1 2.86Å; A143-T147 VanDerWaalsContact O-OG1 3.1Å; P144-T147 VanDerWaalsContact CA-OG1 3.29Å; P144-T147 WeakPolarHBondContact CA-OG1 3.3Å; P144-T147 PolarHBondContact O-OG1 3.21Å; T147-H149 PolarHBondContact O-N 3.14Å; T147-H149 VanDerWaalsContact O-N 3.16Å; T147-V150 PolarHBondContact O-N 3.35Å; T147-V150 VanDerWaalsContact O-O 3.07Å; T147-M154 HydrophobicContact CG2-CE 3.87Å
148	Q	32	Very low	34	Very low	145 Å²	145	94.9 Å²	94.9	68%	0.678	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-21.8	169.1	-85.1	168.5	13.1	0	0	112.9	P144 F146	P144-Q148 WeakPolarHBondContact O-CB 2.79Å; P144-Q148 WeakPolarHBondContact O-CG 3.34Å; P144-Q148 PolarHBondContact O-N 3.37Å; F146-Q148 VanDerWaalsContact C-N 3.28Å; F146-Q148 PolarHBondContact O-N 3.32Å
149	H	33.5	Very low	33.9	Very low	129 Å²	129	93.7 Å²	93.7	60%	0.597	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	-1.9	-179.6	-60.8	-61.6	0	0	0	113.7	Q20 R145 F146 T147	Q20-H149 PolarHBondContact OE1-O 3.34Å; R145-H149 PolarHBondContact O-CD2 3.16Å; F146-H149 PolarHBondContact O-N 3.08Å; T147-H149 PolarHBondContact O-N 3.14Å; T147-H149 VanDerWaalsContact O-N 3.16Å
150	V	29.1	Very low	33.6	Very low	25 Å²	25	94 Å²	94	15%	0.152	46%	0.464	C	S	.	.			trans	-120.9	122.7	-176	-176.1	0	0	0	0	110	F146 T147 R152 M154	F146-V150 HydrophobicContact CE1-CG2 4.12Å; T147-V150 PolarHBondContact O-N 3.35Å; T147-V150 VanDerWaalsContact O-O 3.07Å; V150-R152 VanDerWaalsContact C-N 3.26Å; V150-R152 HydrophobicContact CG1-CG 3.66Å; V150-R152 PolarHBondContact O-N 3.44Å; V150-M154 HydrophobicContact CB-CE 3.46Å; V150-M154 VanDerWaalsContact CB-CE 3.46Å; V150-M154 HydrophobicContact CB-SD 3.97Å; V150-M154 HydrophobicContact CG1-CE 3.7Å; V150-M154 HydrophobicContact CG1-CG 3.85Å; V150-M154 HydrophobicContact CG1-SD 3.62Å; V150-M154 HydrophobicContact CG2-CE 3.49Å; V150-M154 VanDerWaalsContact CG2-CE 3.49Å; V150-M154 HydrophobicContact CG2-SD 3.77Å
151	R	26.8	Very low	33.4	Very low	222 Å²	222	92.5 Å²	92.5	84%	0.838	46%	0.464	S	S	*	.	S	Bend	trans	-86.9	11.8	-173	-67	-171.4	176.6	-166.4	0.5	114.2
152	R	30.8	Very low	32.9	Very low	79 Å²	79	95.9 Å²	95.9	30%	0.298	48%	0.476	S	S	.	.	S	Bend	trans	-140	155.6	-175	54.7	177.6	168	160.2	-0.6	111.2	D14 T16 E17 V150 M154	D14-R152 PolarHBondContact O-NH2 3.34Å; D14-R152 IonicContact OD2-NH1 3.41Å; T16-R152 VanDerWaalsContact OG1-CZ 3.31Å; T16-R152 PolarHBondContact OG1-NH1 3.14Å; E17-R152 IonicContact OE2-CZ 3.5Å; E17-R152 IonicContact OE2-NE 3.97Å; E17-R152 PolarHBondContact OE2-NE 3.08Å; E17-R152 IonicContact OE2-NH2 3.05Å; V150-R152 VanDerWaalsContact C-N 3.26Å; V150-R152 HydrophobicContact CG1-CG 3.66Å; V150-R152 PolarHBondContact O-N 3.44Å; R152-M154 PolarHBondContact O-N 3.19Å
153	D	32.4	Very low	32.4	Very low	169 Å²	169	96.4 Å²	96.4	90%	0.904	47%	0.471	S	S	*	.			trans	-58.4	133.8	171.4	-62.4	-35.1	0	0	0	109.5
154	M	33.7	Very low	31.9	Very low	52 Å²	52	104.4 Å²	104.4	26%	0.256	50%	0.502	S	S	.	.			trans	-126	133.3	178	-75.5	-173.1	-67.1	0	0	109.7	F146 T147 V150 R152	F146-M154 HydrophobicContact CD1-CE 3.52Å; F146-M154 HydrophobicContact CD1-SD 4.17Å; F146-M154 HydrophobicContact CE1-CE 3.69Å; F146-M154 HydrophobicContact CE1-SD 3.74Å; T147-M154 HydrophobicContact CG2-CE 3.87Å; V150-M154 HydrophobicContact CB-CE 3.46Å; V150-M154 VanDerWaalsContact CB-CE 3.46Å; V150-M154 HydrophobicContact CB-SD 3.97Å; V150-M154 HydrophobicContact CG1-CE 3.7Å; V150-M154 HydrophobicContact CG1-CG 3.85Å; V150-M154 HydrophobicContact CG1-SD 3.62Å; V150-M154 HydrophobicContact CG2-CE 3.49Å; V150-M154 VanDerWaalsContact CG2-CE 3.49Å; V150-M154 HydrophobicContact CG2-SD 3.77Å; R152-M154 PolarHBondContact O-N 3.19Å
155	D	36.1	Very low	31.5	Very low	112 Å²	112	111.9 Å²	111.9	60%	0.599	52%	0.522	S	S	*	.			trans	-81.2	117.4	167.4	-69.5	-29.8	0	0	0	109.6	Y157	D155-Y157 HydrophobicContact CB-CD2 4.11Å; D155-Y157 HydrophobicContact CB-CE2 3.35Å; D155-Y157 PolarHBondContact OD2-OH 3.39Å
156	I	36.1	Very low	30.8	Very low	64 Å²	64	112.9 Å²	112.9	33%	0.328	53%	0.526	S	S	.	.			trans	-97	108.2	174	-60.5	175.9	0	0	0	107.9	A143	A143-I156 HydrophobicContact CB-CD1 3.52Å
157	Y	34.8	Very low	30.4	Very low	108 Å²	108	118.6 Å²	118.6	42%	0.424	55%	0.554	S	S	.	*			trans	-90.1	108.6	175.3	-65.4	-84.4	0	0	0	110	V10 D155 T159	V10-Y157 CarbonylContact C-O 3.48Å; V10-Y157 WeakPolarHBondContact O-CB 3.4Å; D155-Y157 HydrophobicContact CB-CD2 4.11Å; D155-Y157 HydrophobicContact CB-CE2 3.35Å; D155-Y157 PolarHBondContact OD2-OH 3.39Å; Y157-T159 PolarHBondContact O-N 3.09Å
158	A	33.6	Very low	29.9	Very low	41 Å²	41	118 Å²	118	34%	0.339	56%	0.561	S	S	.	*			trans	-92.3	96.8	174.2	0	0	0	0	0	110.3	L9 I139	L9-A158 HydrophobicContact CD1-CB 3.57Å; I139-A158 HydrophobicContact CD1-CB 3.84Å
159	T	31.2	Very low	29.6	Very low	64 Å²	64	122.4 Å²	122.4	39%	0.393	57%	0.571	S	S	.	*			trans	-98.9	114.3	174.3	58	0	0	0	0	109.6	P8 L9 V10 Y157	P8-T159 CarbonylContact C-O 3.12Å; P8-T159 PolarHBondContact O-OG1 3.12Å; L9-T159 WeakPolarHBondContact CA-O 3.08Å; L9-T159 PolarHBondContact N-O 3.27Å; V10-T159 WeakPolarHBondContact CG2-OG1 3.16Å; V10-T159 PolarHBondContact N-OG1 3.16Å; Y157-T159 PolarHBondContact O-N 3.09Å
160	G	28.1	Very low	29.1	Very low	36 Å²	36	128.3 Å²	128.3	37%	0.371	59%	0.588	S	S	.	*			trans	118.5	106.8	167.2	0	0	0	0	0	116.4
161	Q	27.5	Very low	29	Very low	134 Å²	134	135.3 Å²	135.3	63%	0.626	62%	0.624	S	S	*	*			trans	-152.8	24.4	153.2	-124.6	-161.8	19.6	0	0	112.9	P135 K163	P135-Q161 VanDerWaalsContact CG-CD 3.42Å; P135-Q161 HydrophobicContact CG-CG 4.15Å; P135-Q161 VanDerWaalsContact CG-NE2 3.31Å; Q161-K163 VanDerWaalsContact C-N 3.34Å; Q161-K163 PolarHBondContact O-N 3.42Å
162	Q	27.4	Very low	28.9	Very low	172 Å²	172	135.5 Å²	135.5	80%	0.804	63%	0.625	S	S	*	*			trans	-79.6	86.2	177.9	-65.9	-161.1	-9.1	0	0	109.4
163	K	26.8	Very low	28.6	Very low	74 Å²	74	143.2 Å²	143.2	32%	0.322	65%	0.654	S	S	.	*	S	Bend	trans	170.2	83.1	146.2	-90.6	148.7	168.1	179.8	0	112.3	L4 L5 Q161	L4-K163 VanDerWaalsContact C-CD 3.47Å; L4-K163 VanDerWaalsContact CA-CE 3.5Å; L4-K163 HydrophobicContact CB-CB 3.82Å; L4-K163 HydrophobicContact CB-CD 3.36Å; L4-K163 HydrophobicContact CB-CG 3.44Å; L4-K163 VanDerWaalsContact CB-CG 3.44Å; L4-K163 HydrophobicContact CD1-CB 4.12Å; L4-K163 HydrophobicContact CD1-CD 4.5Å; L4-K163 HydrophobicContact CD1-CG 3.7Å; L4-K163 HydrophobicContact CD2-CD 3.84Å; L4-K163 HydrophobicContact CD2-CG 3.73Å; L4-K163 HydrophobicContact CG-CB 4.41Å; L4-K163 HydrophobicContact CG-CD 3.97Å; L4-K163 HydrophobicContact CG-CG 3.72Å; L5-K163 VanDerWaalsContact CB-NZ 3.33Å; L5-K163 WeakPolarHBondContact O-CD 3.49Å; L5-K163 WeakPolarHBondContact O-CE 3.32Å; L5-K163 PolarHBondContact O-NZ 3.42Å; Q161-K163 VanDerWaalsContact C-N 3.34Å; Q161-K163 PolarHBondContact O-N 3.42Å
164	K	27.4	Very low	28.3	Very low	191 Å²	191	140.8 Å²	140.8	83%	0.83	65%	0.645	S	S	*	*			trans	-177.2	65.2	148.9	-103.1	-178.4	-177.8	-173	0	109.3
165	W	27.1	Very low	27.9	Very low	218 Å²	218	142.4 Å²	142.4	83%	0.826	66%	0.661	S	S	*	*			trans	-129.3	74.9	161.5	-79.8	79.8	0	0	0	107.6
166	R	23.8	Very low	27.5	Very low	203 Å²	203	142 Å²	142	77%	0.766	67%	0.667	S	S	*	*			trans	-91	133.4	151.9	-83.8	-174.6	170.6	-153.6	-5.3	105
167	E	25.8	Very low	27	Very low	185 Å²	185	145.7 Å²	145.7	86%	0.864	69%	0.688	S	S	*	*	S	Bend	trans	84.5	113.3	178.6	-59	172	173.6	0	0	115.9
168	G	24.3	Very low	26.8	Very low	55 Å²	55	146.2 Å²	146.2	57%	0.567	70%	0.702	S	S	*	*	S	Bend	trans	91.3	67.7	149.7	0	0	0	0	0	118.3
169	R	25.3	Very low	26.7	Very low	237 Å²	237	153.9 Å²	153.9	89%	0.894	75%	0.751	S	S	*	*				155.9	125.4	129.4	-83.9	176.6	-96.6	-166.6	-3.6	112
170	R	23.9	Very low	26.5	Very low	253 Å²	253	158.4 Å²	158.4	96%	0.955	77%	0.769	S	S	*	*			trans	-80.8	109.8	174.7	-146.9	179.8	-175.3	-177.7	0.2	107.2
171	L	26.1	Very low	26.4	Very low	173 Å²	173	164.8 Å²	164.8	91%	0.906	79%	0.79	S	S	*	*			trans	-87.7	112.8	167.9	-75.8	171.9	0	0	0	108.7
172	R	24.7	Very low	26.4	Very low	226 Å²	226	166.6 Å²	166.6	85%	0.853	80%	0.799	S	S	*	*			trans	-77.9	123.4	-177.9	-165.7	178.8	-175.1	176.6	0.5	107.9	V174	R172-V174 PolarHBondContact O-N 3.49Å; R172-V174 VanDerWaalsContact O-N 3.13Å
173	R	25.5	Very low	26.3	Very low	241 Å²	241	166.2 Å²	166.2	91%	0.909	80%	0.798	S	S	*	*			trans	-67.8	110.8	159.8	-171.3	174.5	-178.6	176.5	-0.5	106.1	S175	R173-S175 PolarHBondContact O-N 3.18Å
174	V	25.7	Very low	26.3	Very low	118 Å²	118	172 Å²	172	72%	0.715	83%	0.828	S	S	*	*			trans	-65.9	118.1	167.9	-173.3	0	0	0	0	105.3	R172 S176	R172-V174 PolarHBondContact O-N 3.49Å; R172-V174 VanDerWaalsContact O-N 3.13Å; V174-S176 PolarHBondContact O-N 3.25Å
175	S	25.1	Very low	26.2	Very low	85 Å²	85	170.7 Å²	170.7	59%	0.594	83%	0.828	S	S	*	*			trans	-63.5	117.7	160.6	57	0	0	0	0	105.7	R173 D177	R173-S175 PolarHBondContact O-N 3.18Å; S175-D177 PolarHBondContact O-N 3.24Å; S175-D177 VanDerWaalsContact O-N 3.12Å
176	S	27.7	Very low	26.1	Very low	103 Å²	103	167.4 Å²	167.4	72%	0.72	83%	0.828	S	S	*	*			trans	-80.9	74.7	158.2	56.4	0	0	0	0	106.6	V174 V178	V174-S176 PolarHBondContact O-N 3.25Å; S176-V178 VanDerWaalsContact C-N 3.28Å; S176-V178 PolarHBondContact O-N 2.92Å
177	D	24.8	Very low	26.3	Very low	142 Å²	142	164.6 Å²	164.6	76%	0.759	83%	0.833	S	S	*	*			trans	-78.8	93.6	140.8	-65.6	-45.2	0	0	0	104.3	S175	S175-D177 PolarHBondContact O-N 3.24Å; S175-D177 VanDerWaalsContact O-N 3.12Å
178	V	30.2	Very low	26.4	Very low	120 Å²	120	162.9 Å²	162.9	73%	0.727	83%	0.83	S	S	*	*			trans	-133.1	97.4	168	-175.5	0	0	0	0	106.3	S176	S176-V178 VanDerWaalsContact C-N 3.28Å; S176-V178 PolarHBondContact O-N 2.92Å
179	C	33.2	Very low	26.6	Very low	202 Å²	202	172.7 Å²	172.7	100%	1.365	85%	0.854	S	S	*	*			trans	75.1	0	-176.9	-62.2	0	0	0	0	116.9

Retrieved 179 of 179 residues in 23.4 ms (Link to these results)

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