A0A075B7D2_HUMAN Loading...

BRISC and BRCA1-A complex member 2

May play a role in homeostasis or cellular differentiation in cells of neural, epithelial and germline origins. May also act as a death receptor-associated anti-apoptotic protein, which inhibits the mitochondrial apoptotic pathway.

AlphaFold DB , UniProt , Accession A0A075B7D2, Species HUMAN (Homo sapiens, Human), Gene BABAM2, Length 166 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	V	61	Low	57.7	Low	114 Å²	114	78.7 Å²	78.7	69%	0.691	42%	0.418	S	S	*	.				0	112.3	0	-173.1	0	0	0	0	107	N3 G4 I16	V1-N3 VanDerWaalsContact C-N 3.25Å; V1-N3 PolarHBondContact O-N 3.18Å; V1-G4 PolarHBondContact O-N 2.71Å; V1-I16 HydrophobicContact CG2-CD1 3.57Å; V1-I16 HydrophobicContact CG2-CG1 4.06Å
2	R	56	Low	57.7	Low	254 Å²	254	78.1 Å²	78.1	96%	0.958	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-25.6	-159	-67.5	177.2	178.8	175.5	-0.9	114.4
3	N	64.4	Low	58.6	Low	81 Å²	81	78.8 Å²	78.8	43%	0.433	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	45.1	178.1	-64.9	-18.9	0	0	0	112	V1 K5 E90 L93	V1-N3 VanDerWaalsContact C-N 3.25Å; V1-N3 PolarHBondContact O-N 3.18Å; N3-K5 PolarHBondContact O-N 2.83Å; N3-E90 PolarHBondContact ND2-OE1 3.34Å; N3-E90 PolarHBondContact ND2-OE2 2.91Å; N3-L93 HydrophobicContact CB-CD2 3.61Å
4	G	57.2	Low	60.4	Low	8 Å²	8	74.1 Å²	74.1	8%	0.082	40%	0.403	C	S	.	.			trans	-70.5	25.1	-170.7	0	0	0	0	0	117.2	V1 L14	V1-G4 PolarHBondContact O-N 2.71Å; G4-L14 WeakPolarHBondContact O-CG 2.97Å; G4-L14 PolarHBondContact O-N 2.63Å
5	K	64.1	Low	62.3	Low	147 Å²	147	78.1 Å²	78.1	64%	0.639	41%	0.409	S	S	*	.			trans	-111.8	100.1	176.7	-64.3	-174.9	179.7	-174.7	0	109.1	N3	N3-K5 PolarHBondContact O-N 2.83Å
6	V	59.9	Low	64.2	Low	20 Å²	20	77.8 Å²	77.8	12%	0.121	41%	0.407	C	S	.	.	S	Bend	trans	-104.2	-21	176.2	174.9	0	0	0	0	111	L14 I39 L93 V96 K97 V100	V6-L14 HydrophobicContact CB-CD2 4.24Å; V6-L14 HydrophobicContact CG2-CD1 3.5Å; V6-L14 VanDerWaalsContact CG2-CD1 3.5Å; V6-L14 HydrophobicContact CG2-CD2 3.86Å; V6-L14 HydrophobicContact CG2-CG 3.99Å; V6-I39 HydrophobicContact CB-CG2 4.22Å; V6-I39 HydrophobicContact CG1-CG2 4.16Å; V6-L93 HydrophobicContact CG2-CD1 3.62Å; V6-V96 HydrophobicContact CB-CG1 4.4Å; V6-V96 HydrophobicContact CG1-CG1 3.66Å; V6-V96 HydrophobicContact CG2-CG1 3.88Å; V6-K97 HydrophobicContact CG1-CG 4.31Å; V6-V100 HydrophobicContact CG1-CB 3.96Å; V6-V100 HydrophobicContact CG1-CG1 4.36Å; V6-V100 HydrophobicContact CG1-CG2 3.55Å
7	G	59.8	Low	65.9	Low	27 Å²	27	75.9 Å²	75.9	28%	0.278	40%	0.4	S	S	.	.	S	Bend	trans	-131.9	-170.4	178.4	0	0	0	0	0	113.6	E135	G7-E135 WeakPolarHBondContact CA-OE1 3.26Å
8	L	59.9	Low	67.3	Low	43 Å²	43	76.5 Å²	76.5	23%	0.225	40%	0.403	C	S	.	.	S	Bend	trans	-85.4	-17.2	-176.3	-62.1	173.9	0	0	0	114.1	A10 N133 E135	L8-A10 VanDerWaalsContact C-N 3.26Å; L8-A10 PolarHBondContact O-N 2.65Å; L8-N133 HydrophobicContact CD1-CB 4.34Å; L8-N133 WeakPolarHBondContact CD1-O 3.43Å; L8-N133 HydrophobicContact CD2-CB 4.05Å; L8-E135 HydrophobicContact CB-CG 4.26Å; L8-E135 HydrophobicContact CD1-CB 4.34Å; L8-E135 HydrophobicContact CD1-CG 3.87Å; L8-E135 HydrophobicContact CG-CG 4.12Å; L8-E135 PolarHBondContact N-OE1 3.09Å
9	D	54	Low	68.7	Low	13 Å²	13	78.7 Å²	78.7	7%	0.07	42%	0.415	C	S	.	.			trans	-68.9	87.2	171.6	-177.4	13.4	0	0	0	110.1	T11 N12 P40	D9-T11 PolarHBondContact O-N 2.98Å; D9-T11 PolarHBondContact OD1-N 3.15Å; D9-T11 VanDerWaalsContact OD1-N 3.1Å; D9-T11 PolarHBondContact OD1-OG1 3.14Å; D9-N12 PolarHBondContact OD2-ND2 3.47Å; D9-P40 HydrophobicContact CB-CB 4.1Å
10	A	47.4	Very low	69.9	Low	58 Å²	58	81.6 Å²	81.6	48%	0.479	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-8	179	0	0	0	0	0	113.6	L8	L8-A10 VanDerWaalsContact C-N 3.26Å; L8-A10 PolarHBondContact O-N 2.65Å
11	T	51.3	Low	70.9	Confident	101 Å²	101	80.7 Å²	80.7	62%	0.62	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-21.8	-175.6	65.7	0	0	0	0	113.4	D9	D9-T11 PolarHBondContact O-N 2.98Å; D9-T11 PolarHBondContact OD1-N 3.15Å; D9-T11 VanDerWaalsContact OD1-N 3.1Å; D9-T11 PolarHBondContact OD1-OG1 3.14Å
12	N	58	Low	72.2	Confident	71 Å²	71	77 Å²	77	38%	0.38	41%	0.41	S	S	.	.	S	Bend	trans	-119.9	128.3	178.7	-71	-55	0	0	0	110.9	D9 P40	D9-N12 PolarHBondContact OD2-ND2 3.47Å; N12-P40 HydrophobicContact CB-CB 3.77Å; N12-P40 HydrophobicContact CB-CG 3.38Å; N12-P40 WeakPolarHBondContact O-CG 3.44Å
13	C	68.9	Low	73.8	Confident	87 Å²	87	65.9 Å²	65.9	59%	0.588	37%	0.371	S	S	*	.			trans	-81.2	155	170.3	-58.5	0	0	0	0	110.5	R15	C13-R15 PolarHBondContact O-N 3.47Å
14	L	83.1	Confident	74.8	Confident	14 Å²	14	66.4 Å²	66.4	7%	0.073	38%	0.377	C	S	.	.			trans	-46.7	129.3	165	-69.5	178.9	0	0	0	111	G4 V6 L37 I39	G4-L14 WeakPolarHBondContact O-CG 2.97Å; G4-L14 PolarHBondContact O-N 2.63Å; V6-L14 HydrophobicContact CB-CD2 4.24Å; V6-L14 HydrophobicContact CG2-CD1 3.5Å; V6-L14 VanDerWaalsContact CG2-CD1 3.5Å; V6-L14 HydrophobicContact CG2-CD2 3.86Å; V6-L14 HydrophobicContact CG2-CG 3.99Å; L14-L37 HydrophobicContact CB-CD1 4.29Å; L14-L37 HydrophobicContact CD1-CD1 4.45Å; L14-L37 HydrophobicContact CD2-CD1 4.28Å; L14-L37 HydrophobicContact CD2-CG 4.47Å; L14-I39 HydrophobicContact CD2-CB 4.14Å; L14-I39 HydrophobicContact CD2-CG1 3.86Å; L14-I39 HydrophobicContact CD2-CG2 4.08Å
15	R	89.6	Confident	76.1	Confident	133 Å²	133	72 Å²	72	50%	0.502	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	142.2	174	-67.2	-179	-72.5	-173.8	-3.9	110.1	C13 H38	C13-R15 PolarHBondContact O-N 3.47Å; R15-H38 HydrophobicContact CB-CB 3.97Å; R15-H38 PolarHBondContact N-O 3.19Å; R15-H38 WeakPolarHBondContact O-CB 2.94Å; R15-H38 PolarHBondContact O-N 3.27Å
16	I	91.9	Very high	77.2	Confident	73 Å²	73	72.5 Å²	72.5	37%	0.374	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	129.9	175.8	-63.4	176.1	0	0	0	107.7	V1 L19 F35 K36 L37	V1-I16 HydrophobicContact CG2-CD1 3.57Å; V1-I16 HydrophobicContact CG2-CG1 4.06Å; I16-L19 HydrophobicContact CG2-CD2 4.28Å; I16-L19 HydrophobicContact CG2-CG 4.46Å; I16-F35 HydrophobicContact CD1-CD2 4.49Å; I16-F35 HydrophobicContact CD1-CE2 4.39Å; I16-F35 HydrophobicContact CG1-CD2 4.32Å; I16-F35 HydrophobicContact CG1-CE2 4.47Å; I16-F35 HydrophobicContact CG2-CB 3.81Å; I16-F35 HydrophobicContact CG2-CD2 3.74Å; I16-F35 HydrophobicContact CG2-CG 3.99Å; I16-K36 WeakPolarHBondContact CA-O 3.32Å; I16-L37 HydrophobicContact CG1-CD1 4.03Å
17	T	93.8	Very high	78.3	Confident	46 Å²	46	73.4 Å²	73.4	28%	0.282	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	179.4	179.2	61.9	0	0	0	0	109.8	L19 K36 H38	T17-L19 VanDerWaalsContact C-N 3.27Å; T17-L19 PolarHBondContact O-N 3.18Å; T17-L19 VanDerWaalsContact O-N 3.14Å; T17-K36 PolarHBondContact N-O 3.17Å; T17-K36 PolarHBondContact O-N 3.14Å; T17-H38 PolarHBondContact OG1-CD2 3.29Å; T17-H38 PolarHBondContact OG1-NE2 2.94Å
18	D	92	Very high	79.3	Confident	87 Å²	87	77.6 Å²	77.6	47%	0.465	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	49.6	44.5	173	-60.7	-21.9	0	0	0	114.5	K20 K36	D18-K20 PolarHBondContact O-N 2.94Å; D18-K36 HydrophobicContact CB-CB 3.96Å; D18-K36 WeakPolarHBondContact OD2-CE 2.9Å
19	L	93.3	Very high	80.2	Confident	119 Å²	119	78.5 Å²	78.5	62%	0.623	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.8	118.5	174.5	-73.8	150.2	0	0	0	110	I16 T17 C32 F35	I16-L19 HydrophobicContact CG2-CD2 4.28Å; I16-L19 HydrophobicContact CG2-CG 4.46Å; T17-L19 VanDerWaalsContact C-N 3.27Å; T17-L19 PolarHBondContact O-N 3.18Å; T17-L19 VanDerWaalsContact O-N 3.14Å; L19-C32 VanDerWaalsContact CB-SG 3.5Å; L19-C32 WeakPolarHBondContact CD2-SG 3.47Å; L19-F35 HydrophobicContact CD2-CB 4.26Å
20	K	92.3	Very high	81.4	Confident	136 Å²	136	84.2 Å²	84.2	59%	0.591	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.1	152.3	-178.5	-68	177.4	-173.6	176	0	111	D18 C32 D33 R34	D18-K20 PolarHBondContact O-N 2.94Å; K20-C32 PolarHBondContact N-SG 3.38Å; K20-C32 VanDerWaalsContact N-SG 3.41Å; K20-C32 PolarHBondContact O-SG 2.99Å; K20-D33 PolarHBondContact O-N 3.36Å; K20-R34 HydrophobicContact CB-CB 4.23Å; K20-R34 PolarHBondContact N-O 3.23Å; K20-R34 PolarHBondContact O-N 3.27Å; K20-R34 VanDerWaalsContact O-N 3.08Å
21	S	90.9	Very high	83.1	Confident	63 Å²	63	83.2 Å²	83.2	44%	0.441	50%	0.495	S	S	.	.			trans	-94.1	129.8	170	168.5	0	0	0	0	110.1	C23 N31	S21-C23 PolarHBondContact OG-N 3.24Å; S21-C23 VanDerWaalsContact OG-N 3.09Å; S21-C23 PolarHBondContact OG-O 3.09Å; S21-N31 VanDerWaalsContact CA-O 3.29Å; S21-N31 WeakPolarHBondContact CA-O 3.35Å; S21-N31 VanDerWaalsContact CB-O 3.25Å; S21-N31 WeakPolarHBondContact CB-O 2.97Å; S21-N31 PolarHBondContact OG-O 2.87Å
22	G	89.4	Confident	84.9	Confident	37 Å²	37	81.7 Å²	81.7	38%	0.381	49%	0.488	S	S	.	.			trans	-80.7	-15.1	165	0	0	0	0	0	114.4	D33	G22-D33 PolarHBondContact N-OD1 3.3Å
23	C	87.6	Confident	86.7	Confident	20 Å²	20	78.7 Å²	78.7	14%	0.135	47%	0.472	C	S	.	.	S	Bend	trans	-77.7	159.8	178.5	-67.7	0	0	0	0	112.3	S21 T27 N31	S21-C23 PolarHBondContact OG-N 3.24Å; S21-C23 VanDerWaalsContact OG-N 3.09Å; S21-C23 PolarHBondContact OG-O 3.09Å; C23-T27 HydrophobicContact CB-CG2 4.27Å; C23-N31 HydrophobicContact CB-CB 4.1Å
24	T	85.8	Confident	88	Confident	92 Å²	92	78.7 Å²	78.7	56%	0.564	46%	0.46	S	S	*	.			trans	-58.5	149.3	171.2	67.5	0	0	0	0	111	L26 T27	T24-L26 PolarHBondContact O-N 3.19Å; T24-T27 WeakPolarHBondContact O-CB 2.86Å; T24-T27 PolarHBondContact O-N 3.31Å; T24-T27 PolarHBondContact O-OG1 2.92Å; T24-T27 VanDerWaalsContact O-OG1 3.12Å; T24-T27 PolarHBondContact OG1-OG1 3.25Å; T24-T27 VanDerWaalsContact OG1-OG1 3.06Å
25	S	84.6	Confident	88.6	Confident	126 Å²	126	79.4 Å²	79.4	88%	0.881	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-16	178.5	54.9	0	0	0	0	114	T27	S25-T27 VanDerWaalsContact C-N 3.34Å
26	L	87.6	Confident	88.9	Confident	156 Å²	156	74.8 Å²	74.8	82%	0.817	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-12	175.9	-61.2	176.1	0	0	0	113	T24 P28	T24-L26 PolarHBondContact O-N 3.19Å; L26-P28 VanDerWaalsContact O-CD 3.28Å; L26-P28 WeakPolarHBondContact O-CD 3.37Å
27	T	84.1	Confident	89.1	Confident	40 Å²	40	71.7 Å²	71.7	25%	0.245	43%	0.43	C	S	.	.	S	Bend	trans	-71.1	115.6	-179.4	-50.7	0	0	0	0	109.2	C23 T24 S25 N31	C23-T27 HydrophobicContact CB-CG2 4.27Å; T24-T27 WeakPolarHBondContact O-CB 2.86Å; T24-T27 PolarHBondContact O-N 3.31Å; T24-T27 PolarHBondContact O-OG1 2.92Å; T24-T27 VanDerWaalsContact O-OG1 3.12Å; T24-T27 PolarHBondContact OG1-OG1 3.25Å; T24-T27 VanDerWaalsContact OG1-OG1 3.06Å; S25-T27 VanDerWaalsContact C-N 3.34Å; T27-N31 WeakPolarHBondContact CB-ND2 3.45Å; T27-N31 WeakPolarHBondContact CG2-ND2 3.38Å; T27-N31 PolarHBondContact O-ND2 2.96Å
28	P	80.3	Confident	89	Confident	114 Å²	114	70.9 Å²	70.9	74%	0.74	42%	0.423	S	S	*	.			trans	-70.2	152.8	-176.9	28.6	-33.1	0	0	0	111.2	L26 N31	L26-P28 VanDerWaalsContact O-CD 3.28Å; L26-P28 WeakPolarHBondContact O-CD 3.37Å; P28-N31 PolarHBondContact O-ND2 3.1Å
29	G	78.3	Confident	88.9	Confident	62 Å²	62	66.8 Å²	66.8	64%	0.639	40%	0.401	S	S	*	.	S	Bend	trans	84	-177.3	174.2	0	0	0	0	0	115.4	N31	G29-N31 PolarHBondContact O-N 2.62Å; G29-N31 PolarHBondContact O-ND2 2.84Å
30	P	79.1	Confident	88.7	Confident	133 Å²	133	61.5 Å²	61.5	86%	0.864	37%	0.374	S	S	*	.			trans	-76.8	107.5	-177.6	30.1	-32.4	0	0	0	111.3
31	N	83.4	Confident	88.3	Confident	37 Å²	37	55.1 Å²	55.1	20%	0.198	35%	0.346	C	S	.	.			trans	-120.3	40.6	-176.4	-62	-47.6	0	0	0	112.8	S21 C23 T27 P28 G29 D33	S21-N31 VanDerWaalsContact CA-O 3.29Å; S21-N31 WeakPolarHBondContact CA-O 3.35Å; S21-N31 VanDerWaalsContact CB-O 3.25Å; S21-N31 WeakPolarHBondContact CB-O 2.97Å; S21-N31 PolarHBondContact OG-O 2.87Å; C23-N31 HydrophobicContact CB-CB 4.1Å; T27-N31 WeakPolarHBondContact CB-ND2 3.45Å; T27-N31 WeakPolarHBondContact CG2-ND2 3.38Å; T27-N31 PolarHBondContact O-ND2 2.96Å; P28-N31 PolarHBondContact O-ND2 3.1Å; G29-N31 PolarHBondContact O-N 2.62Å; G29-N31 PolarHBondContact O-ND2 2.84Å; N31-D33 PolarHBondContact O-N 2.89Å
32	C	89.6	Confident	87.8	Confident	69 Å²	69	52.1 Å²	52.1	47%	0.466	33%	0.325	S	S	.	.			trans	-86.9	91.7	-178.5	-168.2	0	0	0	0	111.1	L19 K20	L19-C32 VanDerWaalsContact CB-SG 3.5Å; L19-C32 WeakPolarHBondContact CD2-SG 3.47Å; K20-C32 PolarHBondContact N-SG 3.38Å; K20-C32 VanDerWaalsContact N-SG 3.41Å; K20-C32 PolarHBondContact O-SG 2.99Å
33	D	94.3	Very high	87.1	Confident	8 Å²	8	51.5 Å²	51.5	4%	0.043	32%	0.319	C	S	.	.			trans	-106.2	-6.4	-176.9	56.9	-3.3	0	0	0	114.2	K20 G22 N31 F52 A54	K20-D33 PolarHBondContact O-N 3.36Å; G22-D33 PolarHBondContact N-OD1 3.3Å; N31-D33 PolarHBondContact O-N 2.89Å; D33-F52 HydrophobicContact CB-CB 4.01Å; D33-F52 WeakPolarHBondContact O-CB 3.45Å; D33-F52 PolarHBondContact O-N 3.03Å; D33-A54 HydrophobicContact CB-CB 3.93Å; D33-A54 PolarHBondContact OD2-N 3.37Å
34	R	96.6	Very high	86.8	Confident	88 Å²	88	53.9 Å²	53.9	33%	0.332	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	132.1	-179.3	-60.4	173.1	-162.3	-104.3	-6.1	109.8	K20 I50 I51	K20-R34 HydrophobicContact CB-CB 4.23Å; K20-R34 PolarHBondContact N-O 3.23Å; K20-R34 PolarHBondContact O-N 3.27Å; K20-R34 VanDerWaalsContact O-N 3.08Å; R34-I50 WeakPolarHBondContact CA-O 3.5Å; R34-I51 HydrophobicContact CG-CG1 4.43Å; R34-I51 HydrophobicContact CG-CG2 4.17Å
35	F	96.5	Very high	86.9	Confident	29 Å²	29	51.7 Å²	51.7	13%	0.127	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	160	179.2	61.1	-89	0	0	0	111.2	I16 L19 L37 I50 F52 L92	I16-F35 HydrophobicContact CD1-CD2 4.49Å; I16-F35 HydrophobicContact CD1-CE2 4.39Å; I16-F35 HydrophobicContact CG1-CD2 4.32Å; I16-F35 HydrophobicContact CG1-CE2 4.47Å; I16-F35 HydrophobicContact CG2-CB 3.81Å; I16-F35 HydrophobicContact CG2-CD2 3.74Å; I16-F35 HydrophobicContact CG2-CG 3.99Å; L19-F35 HydrophobicContact CD2-CB 4.26Å; F35-L37 HydrophobicContact CE2-CB 4.32Å; F35-I50 HydrophobicContact CD2-CB 4.33Å; F35-I50 HydrophobicContact CE1-CB 4.17Å; F35-I50 HydrophobicContact CE1-CG2 4.01Å; F35-I50 HydrophobicContact CE2-CB 3.86Å; F35-I50 HydrophobicContact CE2-CD1 3.8Å; F35-I50 HydrophobicContact CE2-CG1 4.19Å; F35-I50 HydrophobicContact CE2-CG2 4.31Å; F35-I50 HydrophobicContact CZ-CB 3.76Å; F35-I50 HydrophobicContact CZ-CD1 4.03Å; F35-I50 HydrophobicContact CZ-CG1 4.41Å; F35-I50 HydrophobicContact CZ-CG2 3.71Å; F35-I50 PolarHBondContact N-O 2.83Å; F35-I50 VanDerWaalsContact N-O 3.08Å; F35-I50 PolarHBondContact O-N 3.3Å; F35-F52 AromaticContact CE1-CD2 3.96Å; F35-F52 HydrophobicContact CE1-CD2 3.96Å; F35-F52 AromaticContact CE1-CE2 3.93Å; F35-F52 HydrophobicContact CE1-CE2 3.93Å; F35-F52 HydrophobicContact CZ-CE2 4.22Å; F35-L92 HydrophobicContact CZ-CD2 4.18Å
36	K	96.6	Very high	87.2	Confident	35 Å²	35	46.3 Å²	46.3	15%	0.152	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	122.9	173.2	-174.9	178.2	-63.7	-57.6	0	109.6	I16 T17 D18 K47 W48 D49	I16-K36 WeakPolarHBondContact CA-O 3.32Å; T17-K36 PolarHBondContact N-O 3.17Å; T17-K36 PolarHBondContact O-N 3.14Å; D18-K36 HydrophobicContact CB-CB 3.96Å; D18-K36 WeakPolarHBondContact OD2-CE 2.9Å; K36-K47 HydrophobicContact CD-CB 4.2Å; K36-K47 HydrophobicContact CG-CB 4.44Å; K36-W48 CarbonylContact C-O 3.57Å; K36-W48 WeakPolarHBondContact CA-O 3.27Å; K36-D49 IonicContact NZ-OD1 2.63Å; K36-D49 PolarHBondContact NZ-OD1 3.26Å; K36-D49 IonicContact NZ-OD2 3.72Å; K36-D49 PolarHBondContact NZ-OD2 3.39Å
37	L	94.9	Very high	87.5	Confident	9 Å²	9	43.7 Å²	43.7	5%	0.047	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	124	174.1	-172.6	65.8	0	0	0	109.7	L14 I16 F35 I39 K47 W48 I50 V96	L14-L37 HydrophobicContact CB-CD1 4.29Å; L14-L37 HydrophobicContact CD1-CD1 4.45Å; L14-L37 HydrophobicContact CD2-CD1 4.28Å; L14-L37 HydrophobicContact CD2-CG 4.47Å; I16-L37 HydrophobicContact CG1-CD1 4.03Å; F35-L37 HydrophobicContact CE2-CB 4.32Å; L37-I39 HydrophobicContact CD2-CD1 3.91Å; L37-I39 HydrophobicContact CD2-CG1 3.77Å; L37-I39 HydrophobicContact CG-CD1 4.39Å; L37-I39 HydrophobicContact CG-CG1 3.81Å; L37-K47 WeakPolarHBondContact O-CA 3.45Å; L37-W48 PolarHBondContact N-O 3.2Å; L37-W48 PolarHBondContact O-N 3.38Å; L37-I50 HydrophobicContact CB-CD1 3.75Å; L37-I50 HydrophobicContact CB-CG1 4.25Å; L37-I50 HydrophobicContact CD2-CD1 3.63Å; L37-I50 HydrophobicContact CG-CD1 4.29Å; L37-V96 HydrophobicContact CD2-CG1 4.07Å; L37-V96 HydrophobicContact CD2-CG2 4.15Å
38	H	92.4	Very high	88.1	Confident	28 Å²	28	41.9 Å²	41.9	13%	0.13	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	110.2	172.9	-71.4	-123.7	0	0	0	108.6	R15 T17 T45 L46	R15-H38 HydrophobicContact CB-CB 3.97Å; R15-H38 PolarHBondContact N-O 3.19Å; R15-H38 WeakPolarHBondContact O-CB 2.94Å; R15-H38 PolarHBondContact O-N 3.27Å; T17-H38 PolarHBondContact OG1-CD2 3.29Å; T17-H38 PolarHBondContact OG1-NE2 2.94Å; H38-T45 HydrophobicContact CB-CG2 3.68Å; H38-L46 CarbonylContact C-O 3.57Å; H38-L46 WeakPolarHBondContact CA-O 3.35Å
39	I	90.2	Very high	88.9	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	113.1	-179.2	-51.3	169.6	0	0	0	108.2	V6 L14 L37 Y41 T45 L46 W48 V96 V100	V6-I39 HydrophobicContact CB-CG2 4.22Å; V6-I39 HydrophobicContact CG1-CG2 4.16Å; L14-I39 HydrophobicContact CD2-CB 4.14Å; L14-I39 HydrophobicContact CD2-CG1 3.86Å; L14-I39 HydrophobicContact CD2-CG2 4.08Å; L37-I39 HydrophobicContact CD2-CD1 3.91Å; L37-I39 HydrophobicContact CD2-CG1 3.77Å; L37-I39 HydrophobicContact CG-CD1 4.39Å; L37-I39 HydrophobicContact CG-CG1 3.81Å; I39-Y41 PolarHBondContact O-N 3.05Å; I39-T45 CarbonylContact O-C 3.55Å; I39-T45 WeakPolarHBondContact O-CA 3.46Å; I39-L46 HydrophobicContact CB-CB 4.22Å; I39-L46 PolarHBondContact N-O 3.5Å; I39-L46 PolarHBondContact O-N 3.19Å; I39-W48 HydrophobicContact CD1-CD2 3.89Å; I39-W48 HydrophobicContact CD1-CE3 3.48Å; I39-W48 VanDerWaalsContact CD1-CE3 3.48Å; I39-W48 HydrophobicContact CD1-CH2 4.38Å; I39-W48 HydrophobicContact CD1-CZ3 3.74Å; I39-V96 HydrophobicContact CD1-CG1 3.95Å; I39-V100 HydrophobicContact CD1-CG2 4.12Å; I39-V100 HydrophobicContact CG2-CG2 4.13Å
40	P	87.5	Confident	89.7	Confident	8 Å²	8	35.6 Å²	35.6	5%	0.052	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	127.9	169.8	-20.2	35	0	0	0	109.8	D9 N12	D9-P40 HydrophobicContact CB-CB 4.1Å; N12-P40 HydrophobicContact CB-CB 3.77Å; N12-P40 HydrophobicContact CB-CG 3.38Å; N12-P40 WeakPolarHBondContact O-CG 3.44Å
41	Y	84.8	Confident	90.6	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.008	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	123.5	-177.4	-177.2	-92.2	0	0	0	110	I39 G43 E44 L46 V100 Y103 H104 Q107 E135 I136	I39-Y41 PolarHBondContact O-N 3.05Å; Y41-G43 PolarHBondContact O-N 3.03Å; Y41-E44 PolarHBondContact N-O 2.96Å; Y41-E44 CarbonylContact O-C 3.57Å; Y41-E44 PolarHBondContact O-N 3.46Å; Y41-L46 HydrophobicContact CD1-CD1 4.43Å; Y41-L46 HydrophobicContact CG-CD1 4.02Å; Y41-L46 HydrophobicContact CG-CG 4.39Å; Y41-V100 HydrophobicContact CD2-CG1 3.87Å; Y41-V100 HydrophobicContact CE2-CG1 3.94Å; Y41-Y103 HydrophobicContact CD1-CD1 4.09Å; Y41-Y103 AromaticContact CD1-CE1 3.82Å; Y41-Y103 HydrophobicContact CD1-CE1 3.82Å; Y41-Y103 AromaticContact CE1-CD1 3.78Å; Y41-Y103 HydrophobicContact CE1-CD1 3.78Å; Y41-Y103 AromaticContact CE1-CE1 3.7Å; Y41-Y103 HydrophobicContact CE1-CE1 3.7Å; Y41-Y103 HydrophobicContact CE2-CD1 4.43Å; Y41-Y103 AromaticContact CZ-CD1 3.98Å; Y41-H104 VanDerWaalsContact OH-CA 3.28Å; Y41-H104 WeakPolarHBondContact OH-CA 3.08Å; Y41-H104 VanDerWaalsContact OH-CB 3.3Å; Y41-H104 WeakPolarHBondContact OH-CB 3.37Å; Y41-H104 PolarHBondContact OH-ND1 3.44Å; Y41-Q107 HydrophobicContact CE1-CG 4.39Å; Y41-E135 WeakPolarHBondContact CA-OE2 3.42Å; Y41-E135 HydrophobicContact CD2-CG 4Å; Y41-E135 HydrophobicContact CE2-CB 4.23Å; Y41-E135 HydrophobicContact CE2-CG 3.62Å; Y41-I136 VanDerWaalsContact CE1-O 3.27Å; Y41-I136 WeakPolarHBondContact CE1-O 3.43Å; Y41-I136 PolarHBondContact OH-O 3.05Å
42	A	79.5	Confident	91.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.2	36.5	177.4	0	0	0	0	0	114.5	E44 E135 F148	A42-E44 PolarHBondContact O-N 3.41Å; A42-E135 HydrophobicContact CB-CB 4.06Å; A42-E135 PolarHBondContact N-OE2 3.42Å; A42-F148 HydrophobicContact CB-CD2 4.25Å; A42-F148 WeakPolarHBondContact O-CD2 3.37Å; A42-F148 WeakPolarHBondContact O-CE2 3.47Å
43	G	75.4	Confident	91.5	Very high	24 Å²	24	30.7 Å²	30.7	25%	0.247	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.4	3.7	179.3	0	0	0	0	0	115.8	Y41 R146 F148	Y41-G43 PolarHBondContact O-N 3.03Å; G43-R146 PolarHBondContact O-NH1 3.35Å; G43-F148 VanDerWaalsContact N-CZ 3.28Å
44	E	82.3	Confident	91.4	Very high	71 Å²	71	32.2 Å²	32.2	33%	0.332	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	178.4	168.8	-66.4	-59.8	155.4	0	0	109.6	Y41 A42 Y137 R146	Y41-E44 PolarHBondContact N-O 2.96Å; Y41-E44 CarbonylContact O-C 3.57Å; Y41-E44 PolarHBondContact O-N 3.46Å; A42-E44 PolarHBondContact O-N 3.41Å; E44-Y137 HydrophobicContact CG-CD1 4.23Å; E44-Y137 HydrophobicContact CG-CE1 4.27Å; E44-R146 IonicContact OE1-CZ 3.79Å; E44-R146 IonicContact OE1-NH1 3.2Å; E44-R146 PolarHBondContact OE1-NH1 3.15Å; E44-R146 IonicContact OE1-NH2 2.98Å; E44-R146 PolarHBondContact OE1-NH2 2.98Å
45	T	87.3	Confident	91.1	Very high	46 Å²	46	33.8 Å²	33.8	28%	0.282	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	111	174.2	-60.9	0	0	0	0	109.4	H38 I39	H38-T45 HydrophobicContact CB-CG2 3.68Å; I39-T45 CarbonylContact O-C 3.55Å; I39-T45 WeakPolarHBondContact O-CA 3.46Å
46	L	90.8	Very high	91	Very high	12 Å²	12	38.2 Å²	38.2	6%	0.063	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	133.3	169.4	-47.2	178.8	0	0	0	108.4	H38 I39 Y41 W48 Y103	H38-L46 CarbonylContact C-O 3.57Å; H38-L46 WeakPolarHBondContact CA-O 3.35Å; I39-L46 HydrophobicContact CB-CB 4.22Å; I39-L46 PolarHBondContact N-O 3.5Å; I39-L46 PolarHBondContact O-N 3.19Å; Y41-L46 HydrophobicContact CD1-CD1 4.43Å; Y41-L46 HydrophobicContact CG-CD1 4.02Å; Y41-L46 HydrophobicContact CG-CG 4.39Å; L46-W48 HydrophobicContact CD1-CZ2 3.85Å; L46-Y103 HydrophobicContact CD1-CD1 3.85Å; L46-Y103 HydrophobicContact CD1-CE1 3.89Å; L46-Y103 HydrophobicContact CD1-CG 4.25Å; L46-Y103 HydrophobicContact CD2-CD1 4.46Å; L46-Y103 HydrophobicContact CD2-CE1 3.66Å; L46-Y103 HydrophobicContact CD2-CE2 4.37Å; L46-Y103 WeakPolarHBondContact CD2-OH 3.37Å; L46-Y103 HydrophobicContact CG-CE1 4.42Å
47	K	93.9	Very high	90.8	Very high	101 Å²	101	40.8 Å²	40.8	44%	0.439	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	95.6	-179.9	-66.8	176.6	-168.2	165.3	0	108.5	K36 L37	K36-K47 HydrophobicContact CD-CB 4.2Å; K36-K47 HydrophobicContact CG-CB 4.44Å; L37-K47 WeakPolarHBondContact O-CA 3.45Å
48	W	96	Very high	90.8	Very high	3 Å²	3	45.3 Å²	45.3	1%	0.011	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	131.9	-178.3	-64.3	-7.9	0	0	0	110.2	K36 L37 I39 L46 I64 F65 F71 L99 V100 Y103	K36-W48 CarbonylContact C-O 3.57Å; K36-W48 WeakPolarHBondContact CA-O 3.27Å; L37-W48 PolarHBondContact N-O 3.2Å; L37-W48 PolarHBondContact O-N 3.38Å; I39-W48 HydrophobicContact CD1-CD2 3.89Å; I39-W48 HydrophobicContact CD1-CE3 3.48Å; I39-W48 VanDerWaalsContact CD1-CE3 3.48Å; I39-W48 HydrophobicContact CD1-CH2 4.38Å; I39-W48 HydrophobicContact CD1-CZ3 3.74Å; L46-W48 HydrophobicContact CD1-CZ2 3.85Å; W48-I64 WeakPolarHBondContact CA-O 3.45Å; W48-F65 AromaticContact CD2-CD1 3.77Å; W48-F65 HydrophobicContact CD2-CD1 3.77Å; W48-F65 HydrophobicContact CD2-CE1 4.21Å; W48-F65 AromaticContact CE2-CD1 3.68Å; W48-F65 HydrophobicContact CE3-CD1 4.22Å; W48-F65 HydrophobicContact CE3-CE1 4.2Å; W48-F65 HydrophobicContact CG-CD1 4.05Å; W48-F65 HydrophobicContact CH2-CE1 4.47Å; W48-F65 HydrophobicContact CZ2-CD1 4.08Å; W48-F65 HydrophobicContact CZ2-CE1 4.46Å; W48-F65 HydrophobicContact CZ3-CE1 4.34Å; W48-F65 AromaticContact NE1-CD1 3.87Å; W48-F71 HydrophobicContact CH2-CE1 4.34Å; W48-F71 HydrophobicContact CZ2-CE1 4.08Å; W48-L99 HydrophobicContact CH2-CB 3.77Å; W48-L99 HydrophobicContact CZ3-CB 3.53Å; W48-L99 HydrophobicContact CZ3-CD1 4.14Å; W48-L99 HydrophobicContact CZ3-CG 4.44Å; W48-V100 HydrophobicContact CH2-CG2 3.87Å; W48-V100 HydrophobicContact CZ3-CG2 4.15Å; W48-Y103 HydrophobicContact CZ2-CD2 4.26Å; W48-Y103 HydrophobicContact CZ2-CG 4.38Å
49	D	96.7	Very high	91	Very high	44 Å²	44	48 Å²	48	24%	0.235	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	127.9	169.8	-61.4	-76.6	0	0	0	108.8	K36 F63 I64	K36-D49 IonicContact NZ-OD1 2.63Å; K36-D49 PolarHBondContact NZ-OD1 3.26Å; K36-D49 IonicContact NZ-OD2 3.72Å; K36-D49 PolarHBondContact NZ-OD2 3.39Å; D49-F63 WeakPolarHBondContact O-CA 3.41Å; D49-I64 HydrophobicContact CB-CB 4.13Å; D49-I64 PolarHBondContact N-O 3.25Å; D49-I64 PolarHBondContact O-N 2.59Å
50	I	97	Very high	91.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.1	177.4	-59.4	-175.1	0	0	0	107.6	R34 F35 L37 F52 P61 F63 L92 V96	R34-I50 WeakPolarHBondContact CA-O 3.5Å; F35-I50 HydrophobicContact CD2-CB 4.33Å; F35-I50 HydrophobicContact CE1-CB 4.17Å; F35-I50 HydrophobicContact CE1-CG2 4.01Å; F35-I50 HydrophobicContact CE2-CB 3.86Å; F35-I50 HydrophobicContact CE2-CD1 3.8Å; F35-I50 HydrophobicContact CE2-CG1 4.19Å; F35-I50 HydrophobicContact CE2-CG2 4.31Å; F35-I50 HydrophobicContact CZ-CB 3.76Å; F35-I50 HydrophobicContact CZ-CD1 4.03Å; F35-I50 HydrophobicContact CZ-CG1 4.41Å; F35-I50 HydrophobicContact CZ-CG2 3.71Å; F35-I50 PolarHBondContact N-O 2.83Å; F35-I50 VanDerWaalsContact N-O 3.08Å; F35-I50 PolarHBondContact O-N 3.3Å; L37-I50 HydrophobicContact CB-CD1 3.75Å; L37-I50 HydrophobicContact CB-CG1 4.25Å; L37-I50 HydrophobicContact CD2-CD1 3.63Å; L37-I50 HydrophobicContact CG-CD1 4.29Å; I50-F52 HydrophobicContact CG2-CD2 4.03Å; I50-F52 HydrophobicContact CG2-CE2 3.67Å; I50-F52 HydrophobicContact CG2-CZ 4.49Å; I50-P61 HydrophobicContact CG2-CB 3.95Å; I50-F63 HydrophobicContact CD1-CD1 4.46Å; I50-F63 HydrophobicContact CD1-CE1 4.09Å; I50-F63 HydrophobicContact CG1-CD1 4.04Å; I50-F63 HydrophobicContact CG1-CE1 4.09Å; I50-F63 HydrophobicContact CG2-CE1 4.49Å; I50-L92 HydrophobicContact CD1-CD1 4.43Å; I50-L92 HydrophobicContact CG2-CD1 4.46Å; I50-V96 HydrophobicContact CD1-CG2 4.35Å
51	I	97.6	Very high	91.7	Very high	32 Å²	32	50.7 Å²	50.7	16%	0.164	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	105.7	-171.7	-61.9	170.3	0	0	0	108.4	R34 P61 D62 I64	R34-I51 HydrophobicContact CG-CG1 4.43Å; R34-I51 HydrophobicContact CG-CG2 4.17Å; I51-P61 CarbonylContact O-C 3.55Å; I51-P61 WeakPolarHBondContact O-CA 3.38Å; I51-D62 HydrophobicContact CB-CB 4.19Å; I51-D62 PolarHBondContact N-O 2.9Å; I51-D62 PolarHBondContact O-N 2.73Å; I51-I64 HydrophobicContact CD1-CD1 3.74Å; I51-I64 HydrophobicContact CD1-CG1 4.22Å
52	F	96.8	Very high	92.3	Very high	43 Å²	43	56 Å²	56	19%	0.189	30%	0.295	C	S	.	.			trans	-91.8	171.6	162.8	-70.9	-84.5	0	0	0	110.5	D33 F35 I50 P61 W84 L92	D33-F52 HydrophobicContact CB-CB 4.01Å; D33-F52 WeakPolarHBondContact O-CB 3.45Å; D33-F52 PolarHBondContact O-N 3.03Å; F35-F52 AromaticContact CE1-CD2 3.96Å; F35-F52 HydrophobicContact CE1-CD2 3.96Å; F35-F52 AromaticContact CE1-CE2 3.93Å; F35-F52 HydrophobicContact CE1-CE2 3.93Å; F35-F52 HydrophobicContact CZ-CE2 4.22Å; I50-F52 HydrophobicContact CG2-CD2 4.03Å; I50-F52 HydrophobicContact CG2-CE2 3.67Å; I50-F52 HydrophobicContact CG2-CZ 4.49Å; F52-P61 HydrophobicContact CD1-CB 3.84Å; F52-P61 HydrophobicContact CD1-CG 4.43Å; F52-P61 HydrophobicContact CD2-CB 4.21Å; F52-P61 HydrophobicContact CE1-CB 3.61Å; F52-P61 HydrophobicContact CE1-CG 3.73Å; F52-P61 HydrophobicContact CE2-CB 3.99Å; F52-P61 HydrophobicContact CE2-CG 4.42Å; F52-P61 HydrophobicContact CG-CB 4.15Å; F52-P61 HydrophobicContact CZ-CB 3.7Å; F52-P61 HydrophobicContact CZ-CG 3.73Å; F52-W84 HydrophobicContact CE1-CH2 4.21Å; F52-W84 AromaticContact CE1-CZ2 3.87Å; F52-W84 HydrophobicContact CE1-CZ2 3.87Å; F52-W84 HydrophobicContact CZ-CH2 4.35Å; F52-W84 HydrophobicContact CZ-CZ2 4.43Å; F52-L92 HydrophobicContact CE2-CD1 4.38Å; F52-L92 HydrophobicContact CE2-CD2 4.02Å; F52-L92 HydrophobicContact CZ-CD1 3.99Å; F52-L92 HydrophobicContact CZ-CD2 4.03Å; F52-L92 HydrophobicContact CZ-CG 4.45Å
53	N	94.1	Very high	93.1	Very high	60 Å²	60	57.6 Å²	57.6	32%	0.321	30%	0.302	S	S	.	.			trans	-117.2	107.6	168.4	-170.2	-22.7	0	0	0	109.4	Q55 Y56	N53-Q55 PolarHBondContact O-N 2.91Å; N53-Q55 VanDerWaalsContact O-N 3.11Å; N53-Q55 PolarHBondContact OD1-N 3.46Å; N53-Q55 VanDerWaalsContact OD1-N 3.13Å; N53-Y56 WeakPolarHBondContact ND2-CD2 3.44Å; N53-Y56 CarbonylContact O-C 3.18Å; N53-Y56 PolarHBondContact O-N 2.93Å
54	A	92.3	Very high	94.1	Very high	40 Å²	40	60.7 Å²	60.7	33%	0.331	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-26.1	-178.5	0	0	0	0	0	113.5	D33 Y56	D33-A54 HydrophobicContact CB-CB 3.93Å; D33-A54 PolarHBondContact OD2-N 3.37Å; A54-Y56 VanDerWaalsContact C-N 3.32Å
55	Q	91.4	Very high	94.7	Very high	122 Å²	122	59.3 Å²	59.3	57%	0.57	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-17.5	179.2	-63.3	-175.5	-26.7	0	0	113	N53	N53-Q55 PolarHBondContact O-N 2.91Å; N53-Q55 VanDerWaalsContact O-N 3.11Å; N53-Q55 PolarHBondContact OD1-N 3.46Å; N53-Q55 VanDerWaalsContact OD1-N 3.13Å
56	Y	93.7	Very high	94.8	Very high	122 Å²	122	59.2 Å²	59.2	48%	0.478	31%	0.313	S	S	.	.			trans	-138.4	66.8	-177.4	-58.1	-83.5	0	0	0	109.7	N53 A54 E58 L59	N53-Y56 WeakPolarHBondContact ND2-CD2 3.44Å; N53-Y56 CarbonylContact O-C 3.18Å; N53-Y56 PolarHBondContact O-N 2.93Å; A54-Y56 VanDerWaalsContact C-N 3.32Å; Y56-E58 VanDerWaalsContact C-OE2 3.23Å; Y56-E58 WeakPolarHBondContact CA-OE2 3.24Å; Y56-E58 PolarHBondContact O-N 3.33Å; Y56-E58 VanDerWaalsContact O-N 3.15Å; Y56-L59 HydrophobicContact CG-CD1 4.2Å; Y56-L59 WeakPolarHBondContact O-CB 3.41Å; Y56-L59 PolarHBondContact O-N 2.93Å; Y56-L59 VanDerWaalsContact O-N 3.11Å
57	P	92.2	Very high	94.4	Very high	89 Å²	89	66.5 Å²	66.5	58%	0.578	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-15.4	-172.8	28.2	-36.8	0	0	0	114.2	L59	P57-L59 VanDerWaalsContact C-N 3.31Å
58	E	94.6	Very high	94	Very high	103 Å²	103	62.4 Å²	62.4	48%	0.481	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-19.6	175.4	71.2	-74.4	176.5	0	0	113.6	Y56 W84 P86	Y56-E58 VanDerWaalsContact C-OE2 3.23Å; Y56-E58 WeakPolarHBondContact CA-OE2 3.24Å; Y56-E58 PolarHBondContact O-N 3.33Å; Y56-E58 VanDerWaalsContact O-N 3.15Å; E58-W84 VanDerWaalsContact O-CD1 3.29Å; E58-W84 PolarHBondContact O-NE1 3.25Å; E58-P86 HydrophobicContact CB-CG 4.32Å
59	L	96.2	Very high	93.4	Very high	85 Å²	85	66.3 Å²	66.3	45%	0.445	36%	0.363	S	S	.	.	S	Bend	trans	-75.1	147.5	180	-63	-178.9	0	0	0	111.3	Y56 P57 W84	Y56-L59 HydrophobicContact CG-CD1 4.2Å; Y56-L59 WeakPolarHBondContact O-CB 3.41Å; Y56-L59 PolarHBondContact O-N 2.93Å; Y56-L59 VanDerWaalsContact O-N 3.11Å; P57-L59 VanDerWaalsContact C-N 3.31Å; L59-W84 PolarHBondContact O-NE1 3.11Å
60	P	97.1	Very high	93	Very high	61 Å²	61	69.8 Å²	69.8	40%	0.396	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-65.4	156.1	172.8	28.5	-34.4	0	0	0	111.4	L81 W84	P60-L81 HydrophobicContact CB-CD1 3.74Å; P60-W84 HydrophobicContact CB-CB 4.03Å; P60-W84 HydrophobicContact CB-CD2 4.05Å; P60-W84 HydrophobicContact CB-CG 3.76Å
61	P	97.4	Very high	92.9	Very high	4 Å²	4	70 Å²	70	3%	0.026	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-76.5	157.6	175	31.1	-33.2	0	0	0	112.5	I50 I51 F52 F63 W84 L92	I50-P61 HydrophobicContact CG2-CB 3.95Å; I51-P61 CarbonylContact O-C 3.55Å; I51-P61 WeakPolarHBondContact O-CA 3.38Å; F52-P61 HydrophobicContact CD1-CB 3.84Å; F52-P61 HydrophobicContact CD1-CG 4.43Å; F52-P61 HydrophobicContact CD2-CB 4.21Å; F52-P61 HydrophobicContact CE1-CB 3.61Å; F52-P61 HydrophobicContact CE1-CG 3.73Å; F52-P61 HydrophobicContact CE2-CB 3.99Å; F52-P61 HydrophobicContact CE2-CG 4.42Å; F52-P61 HydrophobicContact CG-CB 4.15Å; F52-P61 HydrophobicContact CZ-CB 3.7Å; F52-P61 HydrophobicContact CZ-CG 3.73Å; P61-F63 HydrophobicContact CB-CE2 4.45Å; P61-F63 HydrophobicContact CB-CZ 4.41Å; P61-F63 HydrophobicContact CG-CE2 3.84Å; P61-F63 HydrophobicContact CG-CZ 3.67Å; P61-W84 HydrophobicContact CG-CH2 4.35Å; P61-L92 HydrophobicContact CG-CD1 4.17Å
62	D	97	Very high	92.7	Very high	114 Å²	114	75.5 Å²	75.5	61%	0.61	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	154.8	163.4	-65.9	-42.4	0	0	0	111.2	I51	I51-D62 HydrophobicContact CB-CB 4.19Å; I51-D62 PolarHBondContact N-O 2.9Å; I51-D62 PolarHBondContact O-N 2.73Å
63	F	96.4	Very high	92.6	Very high	33 Å²	33	74.8 Å²	74.8	15%	0.145	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.1	-177.3	-60.1	-91.8	0	0	0	111.8	D49 I50 P61 F65 L81 L92 V95 V96 L99	D49-F63 WeakPolarHBondContact O-CA 3.41Å; I50-F63 HydrophobicContact CD1-CD1 4.46Å; I50-F63 HydrophobicContact CD1-CE1 4.09Å; I50-F63 HydrophobicContact CG1-CD1 4.04Å; I50-F63 HydrophobicContact CG1-CE1 4.09Å; I50-F63 HydrophobicContact CG2-CE1 4.49Å; P61-F63 HydrophobicContact CB-CE2 4.45Å; P61-F63 HydrophobicContact CB-CZ 4.41Å; P61-F63 HydrophobicContact CG-CE2 3.84Å; P61-F63 HydrophobicContact CG-CZ 3.67Å; F63-F65 HydrophobicContact CB-CE1 3.76Å; F63-F65 HydrophobicContact CB-CZ 3.83Å; F63-L81 HydrophobicContact CE2-CD1 4.27Å; F63-L81 HydrophobicContact CE2-CD2 4.39Å; F63-L92 HydrophobicContact CZ-CD1 4.38Å; F63-V95 HydrophobicContact CE2-CG1 3.89Å; F63-V95 HydrophobicContact CZ-CG1 3.57Å; F63-V96 HydrophobicContact CE1-CG2 4.29Å; F63-L99 HydrophobicContact CD1-CD1 3.68Å; F63-L99 HydrophobicContact CD2-CD1 4.06Å; F63-L99 HydrophobicContact CE1-CD1 3.63Å; F63-L99 HydrophobicContact CE2-CD1 4.01Å; F63-L99 HydrophobicContact CG-CD1 3.9Å; F63-L99 HydrophobicContact CZ-CD1 3.8Å
64	I	95.9	Very high	92.6	Very high	90 Å²	90	75.7 Å²	75.7	46%	0.462	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	121.8	170.4	-53.5	175.2	0	0	0	108.8	W48 D49 I51 G66	W48-I64 WeakPolarHBondContact CA-O 3.45Å; D49-I64 HydrophobicContact CB-CB 4.13Å; D49-I64 PolarHBondContact N-O 3.25Å; D49-I64 PolarHBondContact O-N 2.59Å; I51-I64 HydrophobicContact CD1-CD1 3.74Å; I51-I64 HydrophobicContact CD1-CG1 4.22Å; I64-G66 VanDerWaalsContact C-N 3.31Å; I64-G66 PolarHBondContact O-N 3.1Å
65	F	94.4	Very high	92.5	Very high	41 Å²	41	78.6 Å²	78.6	18%	0.18	43%	0.428	C	S	.	.			trans	-89	24.7	-169.3	-53.8	-59.3	0	0	0	115.6	W48 F63 E67 D68 F71 P73 L99	W48-F65 AromaticContact CD2-CD1 3.77Å; W48-F65 HydrophobicContact CD2-CD1 3.77Å; W48-F65 HydrophobicContact CD2-CE1 4.21Å; W48-F65 AromaticContact CE2-CD1 3.68Å; W48-F65 HydrophobicContact CE3-CD1 4.22Å; W48-F65 HydrophobicContact CE3-CE1 4.2Å; W48-F65 HydrophobicContact CG-CD1 4.05Å; W48-F65 HydrophobicContact CH2-CE1 4.47Å; W48-F65 HydrophobicContact CZ2-CD1 4.08Å; W48-F65 HydrophobicContact CZ2-CE1 4.46Å; W48-F65 HydrophobicContact CZ3-CE1 4.34Å; W48-F65 AromaticContact NE1-CD1 3.87Å; F63-F65 HydrophobicContact CB-CE1 3.76Å; F63-F65 HydrophobicContact CB-CZ 3.83Å; F65-E67 PolarHBondContact O-N 3.15Å; F65-D68 PolarHBondContact O-N 3.25Å; F65-F71 HydrophobicContact CB-CD1 4Å; F65-F71 AromaticContact CD1-CD1 3.89Å; F65-F71 HydrophobicContact CD1-CD1 3.89Å; F65-F71 AromaticContact CD1-CE1 3.85Å; F65-F71 HydrophobicContact CD1-CE1 3.85Å; F65-F71 AromaticContact CD2-CD1 3.68Å; F65-F71 HydrophobicContact CD2-CD1 3.68Å; F65-F71 HydrophobicContact CD2-CE1 4.11Å; F65-F71 HydrophobicContact CE1-CD1 4.29Å; F65-F71 AromaticContact CE1-CE1 3.85Å; F65-F71 HydrophobicContact CE1-CE1 3.85Å; F65-F71 HydrophobicContact CE2-CD1 4.11Å; F65-F71 HydrophobicContact CE2-CE1 4.12Å; F65-F71 AromaticContact CG-CD1 3.57Å; F65-F71 HydrophobicContact CG-CD1 3.57Å; F65-F71 AromaticContact CG-CE1 4Å; F65-F71 HydrophobicContact CG-CE1 4Å; F65-F71 HydrophobicContact CZ-CD1 4.4Å; F65-F71 HydrophobicContact CZ-CE1 4Å; F65-P73 HydrophobicContact CE2-CG 3.75Å; F65-P73 HydrophobicContact CZ-CG 3.8Å; F65-L99 HydrophobicContact CE1-CD1 4.42Å; F65-L99 HydrophobicContact CE1-CD2 4.13Å; F65-L99 HydrophobicContact CZ-CD2 3.89Å
66	G	88.6	Confident	92.7	Very high	44 Å²	44	77.1 Å²	77.1	45%	0.454	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	-121.2	172.6	0	0	0	0	0	114.2	I64	I64-G66 VanDerWaalsContact C-N 3.31Å; I64-G66 PolarHBondContact O-N 3.1Å
67	E	83.6	Confident	92.7	Very high	166 Å²	166	73 Å²	73	78%	0.776	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-15.7	-171.5	-62.9	179.1	-167.6	0	0	114.2	F65 A69 K140	F65-E67 PolarHBondContact O-N 3.15Å; E67-A69 PolarHBondContact O-N 3.49Å; E67-K140 PolarHBondContact O-NZ 3.4Å; E67-K140 VanDerWaalsContact O-NZ 3.11Å
68	D	84.6	Confident	92.8	Very high	14 Å²	14	69.3 Å²	69.3	8%	0.075	40%	0.397	C	S	.	.			trans	-93.8	65.4	179.8	-83.8	-52	0	0	0	111.9	F65 E70 F71 Y103 R110 K140	F65-D68 PolarHBondContact O-N 3.25Å; D68-E70 PolarHBondContact O-N 3.25Å; D68-F71 HydrophobicContact CB-CB 4.16Å; D68-F71 WeakPolarHBondContact O-CB 3.48Å; D68-F71 PolarHBondContact O-N 3.2Å; D68-Y103 HydrophobicContact CB-CE2 4.25Å; D68-Y103 PolarHBondContact OD2-OH 3.34Å; D68-R110 IonicContact OD1-CZ 3.64Å; D68-R110 IonicContact OD1-NH1 3.8Å; D68-R110 PolarHBondContact OD1-NH1 3.11Å; D68-R110 IonicContact OD1-NH2 2.73Å; D68-R110 PolarHBondContact OD1-NH2 3.27Å; D68-K140 WeakPolarHBondContact OD1-CE 3.43Å; D68-K140 IonicContact OD1-NZ 2.9Å
69	A	84	Confident	92.9	Very high	86 Å²	86	70.9 Å²	70.9	71%	0.711	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-15.6	179.5	0	0	0	0	0	115.6	E67	E67-A69 PolarHBondContact O-N 3.49Å
70	E	89.1	Confident	92.9	Very high	117 Å²	117	69.3 Å²	69.3	55%	0.547	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-10.3	177.2	-68.5	164.1	-177.8	0	0	112.6	D68 L72 F106 R110	D68-E70 PolarHBondContact O-N 3.25Å; E70-L72 PolarHBondContact O-N 3.1Å; E70-L72 VanDerWaalsContact O-N 3.15Å; E70-F106 HydrophobicContact CB-CE2 4.25Å; E70-F106 HydrophobicContact CB-CZ 4Å; E70-F106 WeakPolarHBondContact O-CE2 3.39Å; E70-R110 IonicContact OE2-CZ 2.71Å; E70-R110 IonicContact OE2-NE 2.83Å; E70-R110 IonicContact OE2-NH2 3.47Å; E70-R110 PolarHBondContact OE2-NH2 2.74Å
71	F	93.3	Very high	92.9	Very high	5 Å²	5	68.4 Å²	68.4	2%	0.022	39%	0.388	C	S	.	.			trans	-74.2	107.4	176.3	175.3	-126.1	0	0	0	109.4	W48 F65 D68 P73 Q102 Y103 F106	W48-F71 HydrophobicContact CH2-CE1 4.34Å; W48-F71 HydrophobicContact CZ2-CE1 4.08Å; F65-F71 HydrophobicContact CB-CD1 4Å; F65-F71 AromaticContact CD1-CD1 3.89Å; F65-F71 HydrophobicContact CD1-CD1 3.89Å; F65-F71 AromaticContact CD1-CE1 3.85Å; F65-F71 HydrophobicContact CD1-CE1 3.85Å; F65-F71 AromaticContact CD2-CD1 3.68Å; F65-F71 HydrophobicContact CD2-CD1 3.68Å; F65-F71 HydrophobicContact CD2-CE1 4.11Å; F65-F71 HydrophobicContact CE1-CD1 4.29Å; F65-F71 AromaticContact CE1-CE1 3.85Å; F65-F71 HydrophobicContact CE1-CE1 3.85Å; F65-F71 HydrophobicContact CE2-CD1 4.11Å; F65-F71 HydrophobicContact CE2-CE1 4.12Å; F65-F71 AromaticContact CG-CD1 3.57Å; F65-F71 HydrophobicContact CG-CD1 3.57Å; F65-F71 AromaticContact CG-CE1 4Å; F65-F71 HydrophobicContact CG-CE1 4Å; F65-F71 HydrophobicContact CZ-CD1 4.4Å; F65-F71 HydrophobicContact CZ-CE1 4Å; D68-F71 HydrophobicContact CB-CB 4.16Å; D68-F71 WeakPolarHBondContact O-CB 3.48Å; D68-F71 PolarHBondContact O-N 3.2Å; F71-P73 HydrophobicContact CE1-CB 4.42Å; F71-P73 HydrophobicContact CE1-CG 4.31Å; F71-P73 HydrophobicContact CE2-CB 4.18Å; F71-P73 HydrophobicContact CZ-CB 3.82Å; F71-P73 HydrophobicContact CZ-CG 4.2Å; F71-Q102 HydrophobicContact CE2-CB 4.17Å; F71-Q102 HydrophobicContact CZ-CB 4.07Å; F71-Y103 HydrophobicContact CB-CD2 4.41Å; F71-Y103 AromaticContact CD1-CD2 3.82Å; F71-Y103 HydrophobicContact CD1-CD2 3.82Å; F71-Y103 AromaticContact CD2-CD2 3.97Å; F71-Y103 HydrophobicContact CD2-CD2 3.97Å; F71-Y103 HydrophobicContact CE1-CD2 4.01Å; F71-Y103 VanDerWaalsContact CE2-CA 3.48Å; F71-Y103 HydrophobicContact CE2-CD2 4.17Å; F71-Y103 AromaticContact CG-CD2 3.79Å; F71-Y103 HydrophobicContact CG-CD2 3.79Å; F71-Y103 HydrophobicContact CG-CE2 4.36Å; F71-Y103 HydrophobicContact CZ-CD2 4.18Å; F71-F106 HydrophobicContact CB-CD1 4.14Å; F71-F106 HydrophobicContact CB-CE1 3.88Å; F71-F106 HydrophobicContact CB-CZ 4.07Å; F71-F106 HydrophobicContact CD2-CB 3.81Å; F71-F106 AromaticContact CD2-CD1 3.89Å; F71-F106 HydrophobicContact CD2-CD1 3.89Å; F71-F106 HydrophobicContact CD2-CD2 4.35Å; F71-F106 HydrophobicContact CD2-CE1 4.49Å; F71-F106 AromaticContact CD2-CG 3.78Å; F71-F106 HydrophobicContact CD2-CG 3.78Å; F71-F106 HydrophobicContact CE2-CB 4.14Å; F71-F106 HydrophobicContact CG-CD1 4.34Å
72	L	93.7	Very high	92.8	Very high	147 Å²	147	72.5 Å²	72.5	77%	0.77	42%	0.422	S	S	*	.			trans	-119.8	91.8	179.4	-62.4	175.8	0	0	0	107.9	E70	E70-L72 PolarHBondContact O-N 3.1Å; E70-L72 VanDerWaalsContact O-N 3.15Å
73	P	94.4	Very high	92.7	Very high	27 Å²	27	71 Å²	71	18%	0.175	42%	0.42	C	S	.	.			trans	-65.5	142.6	-178.8	26.7	-33.8	0	0	0	111	F65 F71 P75 L78 L99 Q102	F65-P73 HydrophobicContact CE2-CG 3.75Å; F65-P73 HydrophobicContact CZ-CG 3.8Å; F71-P73 HydrophobicContact CE1-CB 4.42Å; F71-P73 HydrophobicContact CE1-CG 4.31Å; F71-P73 HydrophobicContact CE2-CB 4.18Å; F71-P73 HydrophobicContact CZ-CB 3.82Å; F71-P73 HydrophobicContact CZ-CG 4.2Å; P73-P75 VanDerWaalsContact O-CD 3.26Å; P73-P75 WeakPolarHBondContact O-CD 3.41Å; P73-L78 HydrophobicContact CB-CD1 4.43Å; P73-L99 HydrophobicContact CB-CD2 4.01Å; P73-L99 HydrophobicContact CG-CD2 3.94Å; P73-Q102 HydrophobicContact CB-CB 4.14Å; P73-Q102 HydrophobicContact CB-CG 4.37Å
74	D	93.8	Very high	92.8	Very high	79 Å²	79	71.2 Å²	71.2	42%	0.422	42%	0.42	S	S	.	.			trans	-71.8	115.8	174.9	-177.1	-11.8	0	0	0	110	S76 A77	D74-S76 PolarHBondContact O-N 3.28Å; D74-S76 VanDerWaalsContact O-N 3.15Å; D74-S76 WeakPolarHBondContact OD1-CB 3.44Å; D74-S76 PolarHBondContact OD1-N 3.41Å; D74-S76 PolarHBondContact OD1-OG 2.78Å; D74-S76 PolarHBondContact OD2-OG 3.21Å; D74-A77 HydrophobicContact CB-CB 4.36Å; D74-A77 PolarHBondContact O-N 2.82Å
75	P	92.1	Very high	92.8	Very high	102 Å²	102	70.6 Å²	70.6	66%	0.662	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-59.6	-27.6	179.9	-22.7	34.4	0	0	0	113.4	P73 A77 L78	P73-P75 VanDerWaalsContact O-CD 3.26Å; P73-P75 WeakPolarHBondContact O-CD 3.41Å; P75-A77 PolarHBondContact O-N 2.86Å; P75-L78 PolarHBondContact O-N 2.81Å
76	S	94.4	Very high	92.8	Very high	91 Å²	91	71.7 Å²	71.7	64%	0.636	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-69.7	-20.9	179.6	74.4	0	0	0	0	113.1	D74	D74-S76 PolarHBondContact O-N 3.28Å; D74-S76 VanDerWaalsContact O-N 3.15Å; D74-S76 WeakPolarHBondContact OD1-CB 3.44Å; D74-S76 PolarHBondContact OD1-N 3.41Å; D74-S76 PolarHBondContact OD1-OG 2.78Å; D74-S76 PolarHBondContact OD2-OG 3.21Å
77	A	93.1	Very high	93.1	Very high	35 Å²	35	74.7 Å²	74.7	29%	0.289	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-88.1	-5.7	176.1	0	0	0	0	0	113.4	D74 P75 Q79 Q102	D74-A77 HydrophobicContact CB-CB 4.36Å; D74-A77 PolarHBondContact O-N 2.82Å; P75-A77 PolarHBondContact O-N 2.86Å; A77-Q79 PolarHBondContact O-N 2.82Å; A77-Q102 HydrophobicContact CB-CG 4.29Å; A77-Q102 VanDerWaalsContact CB-NE2 3.27Å
78	L	95.8	Very high	93.6	Very high	11 Å²	11	69.3 Å²	69.3	6%	0.058	42%	0.42	C	S	.	.			trans	-100.6	66.2	-178	-56.7	-179.4	0	0	0	111	P73 P75 N80 L81 A82 E98 L99 Q102	P73-L78 HydrophobicContact CB-CD1 4.43Å; P75-L78 PolarHBondContact O-N 2.81Å; L78-N80 VanDerWaalsContact C-N 3.35Å; L78-N80 PolarHBondContact O-N 2.75Å; L78-L81 HydrophobicContact CB-CB 3.96Å; L78-L81 HydrophobicContact CB-CD2 4.48Å; L78-L81 HydrophobicContact CD1-CD2 3.97Å; L78-L81 PolarHBondContact O-N 3Å; L78-A82 PolarHBondContact O-N 3.42Å; L78-E98 WeakPolarHBondContact CA-OE2 3.44Å; L78-E98 HydrophobicContact CD2-CB 3.73Å; L78-L99 HydrophobicContact CD1-CD2 3.78Å; L78-L99 HydrophobicContact CD2-CD2 3.93Å; L78-L99 HydrophobicContact CD2-CG 4.08Å; L78-Q102 HydrophobicContact CD2-CG 4.19Å
79	Q	96.6	Very high	94	Very high	137 Å²	137	74.1 Å²	74.1	64%	0.64	45%	0.452	S	S	*	.	H	α-helix	trans	-64.3	-39.1	-173.5	-63.7	-177.4	1.6	0	0	112.3	A77 L81 A82 S83 E98	A77-Q79 PolarHBondContact O-N 2.82Å; Q79-L81 VanDerWaalsContact C-N 3.26Å; Q79-L81 PolarHBondContact O-N 3Å; Q79-A82 PolarHBondContact O-N 3.41Å; Q79-S83 PolarHBondContact O-N 2.71Å; Q79-S83 PolarHBondContact O-OG 2.94Å; Q79-E98 PolarHBondContact N-OE1 2.98Å; Q79-E98 PolarHBondContact N-OE2 2.89Å
80	N	96.3	Very high	94.4	Very high	52 Å²	52	73.3 Å²	73.3	28%	0.278	43%	0.434	S	S	.	.	H	α-helix	trans	-70	-24.5	178.4	-73.1	-80	0	0	0	112.6	L78 S83 W84 L94 V95 E98	L78-N80 VanDerWaalsContact C-N 3.35Å; L78-N80 PolarHBondContact O-N 2.75Å; N80-S83 CarbonylContact O-C 3.58Å; N80-W84 WeakPolarHBondContact O-CA 3.46Å; N80-W84 PolarHBondContact O-N 3.25Å; N80-L94 HydrophobicContact CB-CB 3.99Å; N80-L94 WeakPolarHBondContact OD1-CD1 3.37Å; N80-V95 HydrophobicContact CB-CG2 3.79Å; N80-E98 WeakPolarHBondContact CB-OE2 3.46Å; N80-E98 PolarHBondContact N-OE1 2.93Å; N80-E98 VanDerWaalsContact N-OE1 3.09Å; N80-E98 PolarHBondContact N-OE2 3.26Å; N80-E98 VanDerWaalsContact N-OE2 3.15Å; N80-E98 VanDerWaalsContact ND2-CD 3.33Å; N80-E98 PolarHBondContact ND2-OE1 3.24Å
81	L	96	Very high	94.6	Very high	42 Å²	42	68.5 Å²	68.5	22%	0.22	41%	0.412	C	S	.	.	H	α-helix	trans	-79.1	-42.7	173.1	-173.1	60.4	0	0	0	111.1	P60 F63 L78 Q79 S83 W84 V95	P60-L81 HydrophobicContact CB-CD1 3.74Å; F63-L81 HydrophobicContact CE2-CD1 4.27Å; F63-L81 HydrophobicContact CE2-CD2 4.39Å; L78-L81 HydrophobicContact CB-CB 3.96Å; L78-L81 HydrophobicContact CB-CD2 4.48Å; L78-L81 HydrophobicContact CD1-CD2 3.97Å; L78-L81 PolarHBondContact O-N 3Å; Q79-L81 VanDerWaalsContact C-N 3.26Å; Q79-L81 PolarHBondContact O-N 3Å; L81-S83 VanDerWaalsContact C-N 3.29Å; L81-S83 PolarHBondContact O-N 2.83Å; L81-W84 WeakPolarHBondContact O-CB 3.34Å; L81-W84 PolarHBondContact O-N 3.19Å; L81-V95 HydrophobicContact CB-CG1 4.1Å; L81-V95 HydrophobicContact CB-CG2 3.98Å; L81-V95 HydrophobicContact CD1-CG1 4.2Å; L81-V95 HydrophobicContact CD1-CG2 4.39Å
82	A	95.9	Very high	94.7	Very high	89 Å²	89	70.3 Å²	70.3	74%	0.736	42%	0.422	S	S	*	.	H	α-helix	trans	-63.9	-35	176.8	0	0	0	0	0	112.5	L78 Q79	L78-A82 PolarHBondContact O-N 3.42Å; Q79-A82 PolarHBondContact O-N 3.41Å
83	S	95.9	Very high	94.6	Very high	82 Å²	82	64.6 Å²	64.6	57%	0.573	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	41.1	176.2	61	0	0	0	0	112.2	Q79 N80 L81 N85	Q79-S83 PolarHBondContact O-N 2.71Å; Q79-S83 PolarHBondContact O-OG 2.94Å; N80-S83 CarbonylContact O-C 3.58Å; L81-S83 VanDerWaalsContact C-N 3.29Å; L81-S83 PolarHBondContact O-N 2.83Å; S83-N85 PolarHBondContact O-N 3.36Å
84	W	97.1	Very high	94.6	Very high	38 Å²	38	65.9 Å²	65.9	14%	0.144	40%	0.398	C	S	.	.			trans	-49.6	122.7	-176.8	-178.1	-110.2	0	0	0	112.2	F52 E58 L59 P60 P61 N80 L81 C91 L92 V95	F52-W84 HydrophobicContact CE1-CH2 4.21Å; F52-W84 AromaticContact CE1-CZ2 3.87Å; F52-W84 HydrophobicContact CE1-CZ2 3.87Å; F52-W84 HydrophobicContact CZ-CH2 4.35Å; F52-W84 HydrophobicContact CZ-CZ2 4.43Å; E58-W84 VanDerWaalsContact O-CD1 3.29Å; E58-W84 PolarHBondContact O-NE1 3.25Å; L59-W84 PolarHBondContact O-NE1 3.11Å; P60-W84 HydrophobicContact CB-CB 4.03Å; P60-W84 HydrophobicContact CB-CD2 4.05Å; P60-W84 HydrophobicContact CB-CG 3.76Å; P61-W84 HydrophobicContact CG-CH2 4.35Å; N80-W84 WeakPolarHBondContact O-CA 3.46Å; N80-W84 PolarHBondContact O-N 3.25Å; L81-W84 WeakPolarHBondContact O-CB 3.34Å; L81-W84 PolarHBondContact O-N 3.19Å; W84-C91 HydrophobicContact CE3-CB 4.13Å; W84-C91 HydrophobicContact CH2-CB 3.99Å; W84-C91 WeakPolarHBondContact CH2-SG 3.01Å; W84-C91 VanDerWaalsContact CZ2-SG 3.56Å; W84-C91 HydrophobicContact CZ3-CB 3.77Å; W84-L92 HydrophobicContact CH2-CB 4.11Å; W84-V95 HydrophobicContact CE3-CG2 4.05Å; W84-V95 HydrophobicContact CZ3-CG2 3.87Å
85	N	95.8	Very high	94.7	Very high	77 Å²	77	62.1 Å²	62.1	41%	0.412	38%	0.377	S	S	.	.			trans	-123.8	95.6	-178.7	-178	0.7	0	0	0	110.4	S83 S87 N88 C91	S83-N85 PolarHBondContact O-N 3.36Å; N85-S87 PolarHBondContact O-N 3.41Å; N85-S87 VanDerWaalsContact O-N 3.13Å; N85-S87 VanDerWaalsContact OD1-CB 3.27Å; N85-S87 WeakPolarHBondContact OD1-CB 2.93Å; N85-S87 PolarHBondContact OD1-N 2.91Å; N85-N88 HydrophobicContact CB-CB 4.4Å; N85-N88 PolarHBondContact O-N 3.25Å; N85-C91 WeakPolarHBondContact O-CB 3.47Å
86	P	94.4	Very high	94.8	Very high	64 Å²	64	57.4 Å²	57.4	42%	0.416	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-14.1	-179.4	28.4	-35.9	0	0	0	113.2	E58 N88	E58-P86 HydrophobicContact CB-CG 4.32Å; P86-N88 VanDerWaalsContact C-N 3.31Å
87	S	95.4	Very high	94.7	Very high	107 Å²	107	57.6 Å²	57.6	75%	0.748	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-18.4	175.1	-54	0	0	0	0	112.7	N85 P89	N85-S87 PolarHBondContact O-N 3.41Å; N85-S87 VanDerWaalsContact O-N 3.13Å; N85-S87 VanDerWaalsContact OD1-CB 3.27Å; N85-S87 WeakPolarHBondContact OD1-CB 2.93Å; N85-S87 PolarHBondContact OD1-N 2.91Å; S87-P89 WeakPolarHBondContact O-CD 3.23Å
88	N	94.4	Very high	94.7	Very high	53 Å²	53	57.1 Å²	57.1	28%	0.283	33%	0.328	S	S	.	.	S	Bend	trans	-89.4	113.9	175.4	177.7	7.1	0	0	0	109.5	N85 P86 E90 C91	N85-N88 HydrophobicContact CB-CB 4.4Å; N85-N88 PolarHBondContact O-N 3.25Å; P86-N88 VanDerWaalsContact C-N 3.31Å; N88-E90 PolarHBondContact O-N 3.12Å; N88-E90 VanDerWaalsContact O-N 3.09Å; N88-E90 PolarHBondContact OD1-N 3.43Å; N88-C91 HydrophobicContact CB-CB 4.32Å; N88-C91 WeakPolarHBondContact O-CB 3.17Å; N88-C91 PolarHBondContact O-N 3.28Å; N88-C91 PolarHBondContact O-SG 3.33Å
89	P	92.3	Very high	94.7	Very high	116 Å²	116	56.6 Å²	56.6	75%	0.753	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-17.3	-178.9	26.7	-35.2	0	0	0	114	S87	S87-P89 WeakPolarHBondContact O-CD 3.23Å
90	E	92.2	Very high	94.5	Very high	69 Å²	69	50.5 Å²	50.5	32%	0.322	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-1	178	-60	-62.5	134.9	0	0	113.1	N3 N88 L92 L93 L94	N3-E90 PolarHBondContact ND2-OE1 3.34Å; N3-E90 PolarHBondContact ND2-OE2 2.91Å; N88-E90 PolarHBondContact O-N 3.12Å; N88-E90 VanDerWaalsContact O-N 3.09Å; N88-E90 PolarHBondContact OD1-N 3.43Å; E90-L92 VanDerWaalsContact C-N 3.33Å; E90-L92 PolarHBondContact O-N 2.98Å; E90-L93 WeakPolarHBondContact O-CB 3.3Å; E90-L93 PolarHBondContact O-N 3.15Å; E90-L93 WeakPolarHBondContact OE2-CD2 3.39Å; E90-L94 WeakPolarHBondContact O-CG 3.48Å; E90-L94 PolarHBondContact O-N 3.17Å
91	C	94.4	Very high	94.2	Very high	15 Å²	15	53.9 Å²	53.9	10%	0.101	31%	0.311	C	S	.	.	H	α-helix	trans	-53.8	-46.3	-174.4	58.1	0	0	0	0	112.9	W84 N85 N88 L93 L94 V95	W84-C91 HydrophobicContact CE3-CB 4.13Å; W84-C91 HydrophobicContact CH2-CB 3.99Å; W84-C91 WeakPolarHBondContact CH2-SG 3.01Å; W84-C91 VanDerWaalsContact CZ2-SG 3.56Å; W84-C91 HydrophobicContact CZ3-CB 3.77Å; N85-C91 WeakPolarHBondContact O-CB 3.47Å; N88-C91 HydrophobicContact CB-CB 4.32Å; N88-C91 WeakPolarHBondContact O-CB 3.17Å; N88-C91 PolarHBondContact O-N 3.28Å; N88-C91 PolarHBondContact O-SG 3.33Å; C91-L93 VanDerWaalsContact C-N 3.33Å; C91-L93 PolarHBondContact O-N 3.01Å; C91-L94 PolarHBondContact O-N 3.05Å; C91-V95 WeakPolarHBondContact O-CG2 3.36Å; C91-V95 PolarHBondContact O-N 3.41Å; C91-V95 VanDerWaalsContact O-N 3.09Å
92	L	95.3	Very high	94.1	Very high	44 Å²	44	53 Å²	53	23%	0.23	31%	0.306	C	S	.	.	H	α-helix	trans	-61.9	-41.6	176.8	179.3	60.1	0	0	0	111.9	F35 I50 F52 P61 F63 W84 E90 L94 V95 V96	F35-L92 HydrophobicContact CZ-CD2 4.18Å; I50-L92 HydrophobicContact CD1-CD1 4.43Å; I50-L92 HydrophobicContact CG2-CD1 4.46Å; F52-L92 HydrophobicContact CE2-CD1 4.38Å; F52-L92 HydrophobicContact CE2-CD2 4.02Å; F52-L92 HydrophobicContact CZ-CD1 3.99Å; F52-L92 HydrophobicContact CZ-CD2 4.03Å; F52-L92 HydrophobicContact CZ-CG 4.45Å; P61-L92 HydrophobicContact CG-CD1 4.17Å; F63-L92 HydrophobicContact CZ-CD1 4.38Å; W84-L92 HydrophobicContact CH2-CB 4.11Å; E90-L92 VanDerWaalsContact C-N 3.33Å; E90-L92 PolarHBondContact O-N 2.98Å; L92-L94 VanDerWaalsContact C-N 3.32Å; L92-L94 PolarHBondContact O-N 2.86Å; L92-V95 PolarHBondContact O-N 2.95Å; L92-V96 HydrophobicContact CD1-CG2 4.1Å; L92-V96 HydrophobicContact CG-CG2 4.4Å; L92-V96 WeakPolarHBondContact O-CB 3.5Å; L92-V96 VanDerWaalsContact O-CG2 3.26Å; L92-V96 WeakPolarHBondContact O-CG2 3.49Å; L92-V96 PolarHBondContact O-N 2.94Å
93	L	92.3	Very high	93.9	Very high	26 Å²	26	48.8 Å²	48.8	14%	0.136	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-41.9	179.7	-179.4	66.5	0	0	0	111	N3 V6 E90 C91 V96 K97	N3-L93 HydrophobicContact CB-CD2 3.61Å; V6-L93 HydrophobicContact CG2-CD1 3.62Å; E90-L93 WeakPolarHBondContact O-CB 3.3Å; E90-L93 PolarHBondContact O-N 3.15Å; E90-L93 WeakPolarHBondContact OE2-CD2 3.39Å; C91-L93 VanDerWaalsContact C-N 3.33Å; C91-L93 PolarHBondContact O-N 3.01Å; L93-V96 PolarHBondContact O-N 2.82Å; L93-K97 HydrophobicContact CG-CD 4.49Å; L93-K97 WeakPolarHBondContact O-CG 3.28Å; L93-K97 PolarHBondContact O-N 3.26Å
94	L	93.5	Very high	93.6	Very high	55 Å²	55	46.8 Å²	46.8	29%	0.288	25%	0.253	S	S	.	.	H	α-helix	trans	-62.9	-46.3	178.7	-65.4	171.9	0	0	0	111.3	N80 E90 C91 L92 V96 K97 E98	N80-L94 HydrophobicContact CB-CB 3.99Å; N80-L94 WeakPolarHBondContact OD1-CD1 3.37Å; E90-L94 WeakPolarHBondContact O-CG 3.48Å; E90-L94 PolarHBondContact O-N 3.17Å; C91-L94 PolarHBondContact O-N 3.05Å; L92-L94 VanDerWaalsContact C-N 3.32Å; L92-L94 PolarHBondContact O-N 2.86Å; L94-V96 VanDerWaalsContact C-N 3.34Å; L94-V96 PolarHBondContact O-N 3.14Å; L94-K97 WeakPolarHBondContact O-CB 3.47Å; L94-K97 PolarHBondContact O-N 2.76Å; L94-E98 WeakPolarHBondContact O-CG 3.47Å; L94-E98 PolarHBondContact O-N 2.86Å
95	V	96	Very high	93.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.8	-44.8	174.8	174.1	0	0	0	0	111.5	F63 N80 L81 W84 C91 L92 K97 E98 L99	F63-V95 HydrophobicContact CE2-CG1 3.89Å; F63-V95 HydrophobicContact CZ-CG1 3.57Å; N80-V95 HydrophobicContact CB-CG2 3.79Å; L81-V95 HydrophobicContact CB-CG1 4.1Å; L81-V95 HydrophobicContact CB-CG2 3.98Å; L81-V95 HydrophobicContact CD1-CG1 4.2Å; L81-V95 HydrophobicContact CD1-CG2 4.39Å; W84-V95 HydrophobicContact CE3-CG2 4.05Å; W84-V95 HydrophobicContact CZ3-CG2 3.87Å; C91-V95 WeakPolarHBondContact O-CG2 3.36Å; C91-V95 PolarHBondContact O-N 3.41Å; C91-V95 VanDerWaalsContact O-N 3.09Å; L92-V95 PolarHBondContact O-N 2.95Å; V95-K97 VanDerWaalsContact C-N 3.3Å; V95-K97 PolarHBondContact O-N 2.93Å; V95-E98 PolarHBondContact O-N 2.83Å; V95-L99 HydrophobicContact CG1-CD1 3.97Å; V95-L99 HydrophobicContact CG1-CG 4.42Å; V95-L99 WeakPolarHBondContact O-CG 3.46Å; V95-L99 PolarHBondContact O-N 3.27Å
96	V	94.7	Very high	93	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.018	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-36.4	179.2	167.8	0	0	0	0	111.4	V6 L37 I39 I50 F63 L92 L93 L94 L99 V100	V6-V96 HydrophobicContact CB-CG1 4.4Å; V6-V96 HydrophobicContact CG1-CG1 3.66Å; V6-V96 HydrophobicContact CG2-CG1 3.88Å; L37-V96 HydrophobicContact CD2-CG1 4.07Å; L37-V96 HydrophobicContact CD2-CG2 4.15Å; I39-V96 HydrophobicContact CD1-CG1 3.95Å; I50-V96 HydrophobicContact CD1-CG2 4.35Å; F63-V96 HydrophobicContact CE1-CG2 4.29Å; L92-V96 HydrophobicContact CD1-CG2 4.1Å; L92-V96 HydrophobicContact CG-CG2 4.4Å; L92-V96 WeakPolarHBondContact O-CB 3.5Å; L92-V96 VanDerWaalsContact O-CG2 3.26Å; L92-V96 WeakPolarHBondContact O-CG2 3.49Å; L92-V96 PolarHBondContact O-N 2.94Å; L93-V96 PolarHBondContact O-N 2.82Å; L94-V96 VanDerWaalsContact C-N 3.34Å; L94-V96 PolarHBondContact O-N 3.14Å; V96-L99 PolarHBondContact O-N 2.9Å; V96-V100 WeakPolarHBondContact O-CG2 3.32Å; V96-V100 PolarHBondContact O-N 3.47Å
97	K	90.7	Very high	92.6	Very high	95 Å²	95	44.7 Å²	44.7	41%	0.413	24%	0.236	S	C	.	.	H	α-helix	trans	-64.1	-45.5	172.9	-76.2	177.9	174.1	-175	0	112.2	V6 L93 L94 V95 L99 V100 Q101	V6-K97 HydrophobicContact CG1-CG 4.31Å; L93-K97 HydrophobicContact CG-CD 4.49Å; L93-K97 WeakPolarHBondContact O-CG 3.28Å; L93-K97 PolarHBondContact O-N 3.26Å; L94-K97 WeakPolarHBondContact O-CB 3.47Å; L94-K97 PolarHBondContact O-N 2.76Å; V95-K97 VanDerWaalsContact C-N 3.3Å; V95-K97 PolarHBondContact O-N 2.93Å; K97-L99 VanDerWaalsContact C-N 3.33Å; K97-L99 PolarHBondContact O-N 3.29Å; K97-V100 PolarHBondContact O-N 2.97Å; K97-Q101 PolarHBondContact O-N 2.85Å
98	E	94.4	Very high	92.1	Very high	24 Å²	24	40.2 Å²	40.2	11%	0.112	21%	0.205	C	C	.	.	H	α-helix	trans	-60.1	-43.8	175.8	-68.9	175.9	156.6	0	0	111.4	L78 Q79 N80 L94 V95 V100 Q101 Q102	L78-E98 WeakPolarHBondContact CA-OE2 3.44Å; L78-E98 HydrophobicContact CD2-CB 3.73Å; Q79-E98 PolarHBondContact N-OE1 2.98Å; Q79-E98 PolarHBondContact N-OE2 2.89Å; N80-E98 WeakPolarHBondContact CB-OE2 3.46Å; N80-E98 PolarHBondContact N-OE1 2.93Å; N80-E98 VanDerWaalsContact N-OE1 3.09Å; N80-E98 PolarHBondContact N-OE2 3.26Å; N80-E98 VanDerWaalsContact N-OE2 3.15Å; N80-E98 VanDerWaalsContact ND2-CD 3.33Å; N80-E98 PolarHBondContact ND2-OE1 3.24Å; L94-E98 WeakPolarHBondContact O-CG 3.47Å; L94-E98 PolarHBondContact O-N 2.86Å; V95-E98 PolarHBondContact O-N 2.83Å; E98-V100 PolarHBondContact O-N 2.94Å; E98-Q101 WeakPolarHBondContact O-CB 3.38Å; E98-Q101 PolarHBondContact O-N 3.49Å; E98-Q102 WeakPolarHBondContact O-CG 3.44Å; E98-Q102 PolarHBondContact O-N 3.22Å
99	L	95.4	Very high	91.7	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-62.8	-41	176.8	-76.6	169.1	0	0	0	112.4	W48 F63 F65 P73 L78 V95 V96 K97 Q101 Q102 Y103	W48-L99 HydrophobicContact CH2-CB 3.77Å; W48-L99 HydrophobicContact CZ3-CB 3.53Å; W48-L99 HydrophobicContact CZ3-CD1 4.14Å; W48-L99 HydrophobicContact CZ3-CG 4.44Å; F63-L99 HydrophobicContact CD1-CD1 3.68Å; F63-L99 HydrophobicContact CD2-CD1 4.06Å; F63-L99 HydrophobicContact CE1-CD1 3.63Å; F63-L99 HydrophobicContact CE2-CD1 4.01Å; F63-L99 HydrophobicContact CG-CD1 3.9Å; F63-L99 HydrophobicContact CZ-CD1 3.8Å; F65-L99 HydrophobicContact CE1-CD1 4.42Å; F65-L99 HydrophobicContact CE1-CD2 4.13Å; F65-L99 HydrophobicContact CZ-CD2 3.89Å; P73-L99 HydrophobicContact CB-CD2 4.01Å; P73-L99 HydrophobicContact CG-CD2 3.94Å; L78-L99 HydrophobicContact CD1-CD2 3.78Å; L78-L99 HydrophobicContact CD2-CD2 3.93Å; L78-L99 HydrophobicContact CD2-CG 4.08Å; V95-L99 HydrophobicContact CG1-CD1 3.97Å; V95-L99 HydrophobicContact CG1-CG 4.42Å; V95-L99 WeakPolarHBondContact O-CG 3.46Å; V95-L99 PolarHBondContact O-N 3.27Å; V96-L99 PolarHBondContact O-N 2.9Å; K97-L99 VanDerWaalsContact C-N 3.33Å; K97-L99 PolarHBondContact O-N 3.29Å; L99-Q101 VanDerWaalsContact C-N 3.33Å; L99-Q102 WeakPolarHBondContact O-CB 3.46Å; L99-Q102 PolarHBondContact O-N 3.33Å; L99-Y103 WeakPolarHBondContact O-CB 3.45Å; L99-Y103 PolarHBondContact O-N 3.1Å
100	V	92.3	Very high	91.4	Very high	9 Å²	9	36.3 Å²	36.3	6%	0.055	18%	0.18	C	C	.	.	H	α-helix	trans	-67.8	-35.2	176	168.1	0	0	0	0	111.5	V6 I39 Y41 W48 V96 K97 E98 Y103 H104	V6-V100 HydrophobicContact CG1-CB 3.96Å; V6-V100 HydrophobicContact CG1-CG1 4.36Å; V6-V100 HydrophobicContact CG1-CG2 3.55Å; I39-V100 HydrophobicContact CD1-CG2 4.12Å; I39-V100 HydrophobicContact CG2-CG2 4.13Å; Y41-V100 HydrophobicContact CD2-CG1 3.87Å; Y41-V100 HydrophobicContact CE2-CG1 3.94Å; W48-V100 HydrophobicContact CH2-CG2 3.87Å; W48-V100 HydrophobicContact CZ3-CG2 4.15Å; V96-V100 WeakPolarHBondContact O-CG2 3.32Å; V96-V100 PolarHBondContact O-N 3.47Å; K97-V100 PolarHBondContact O-N 2.97Å; E98-V100 PolarHBondContact O-N 2.94Å; V100-Y103 WeakPolarHBondContact O-CB 3.45Å; V100-Y103 PolarHBondContact O-N 3.43Å; V100-H104 PolarHBondContact O-N 3.27Å
101	Q	90.1	Very high	90.9	Very high	122 Å²	122	33.2 Å²	33.2	57%	0.57	17%	0.166	S	C	*	.	H	α-helix	trans	-64	-43	172.4	-172.6	-179.9	8	0	0	111.7	K97 E98 L99 Y103 H104 Q105	K97-Q101 PolarHBondContact O-N 2.85Å; E98-Q101 WeakPolarHBondContact O-CB 3.38Å; E98-Q101 PolarHBondContact O-N 3.49Å; L99-Q101 VanDerWaalsContact C-N 3.33Å; Q101-Y103 VanDerWaalsContact C-N 3.32Å; Q101-Y103 PolarHBondContact O-N 3.27Å; Q101-H104 WeakPolarHBondContact O-CB 3.45Å; Q101-H104 PolarHBondContact O-N 3.26Å; Q101-Q105 PolarHBondContact O-N 3.43Å; Q101-Q105 VanDerWaalsContact O-N 3.1Å
102	Q	93.8	Very high	90.2	Very high	23 Å²	23	40.9 Å²	40.9	11%	0.107	19%	0.193	C	C	.	.	H	α-helix	trans	-61.5	-40.9	172.2	-74.1	-66.3	-59.7	0	0	111.7	F71 P73 A77 L78 E98 L99 H104 Q105 F106	F71-Q102 HydrophobicContact CE2-CB 4.17Å; F71-Q102 HydrophobicContact CZ-CB 4.07Å; P73-Q102 HydrophobicContact CB-CB 4.14Å; P73-Q102 HydrophobicContact CB-CG 4.37Å; A77-Q102 HydrophobicContact CB-CG 4.29Å; A77-Q102 VanDerWaalsContact CB-NE2 3.27Å; L78-Q102 HydrophobicContact CD2-CG 4.19Å; E98-Q102 WeakPolarHBondContact O-CG 3.44Å; E98-Q102 PolarHBondContact O-N 3.22Å; L99-Q102 WeakPolarHBondContact O-CB 3.46Å; L99-Q102 PolarHBondContact O-N 3.33Å; Q102-H104 VanDerWaalsContact C-N 3.31Å; Q102-H104 PolarHBondContact O-N 3.37Å; Q102-Q105 VanDerWaalsContact NE2-OE1 3.07Å; Q102-Q105 PolarHBondContact O-N 2.9Å; Q102-F106 PolarHBondContact O-N 3.35Å
103	Y	92.3	Very high	89.5	Confident	1 Å²	1	47 Å²	47	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-62.9	-38.2	175.9	-172.1	-95.8	0	0	0	112	Y41 L46 W48 D68 F71 L99 V100 Q101 F106 Q107 Y137	Y41-Y103 HydrophobicContact CD1-CD1 4.09Å; Y41-Y103 AromaticContact CD1-CE1 3.82Å; Y41-Y103 HydrophobicContact CD1-CE1 3.82Å; Y41-Y103 AromaticContact CE1-CD1 3.78Å; Y41-Y103 HydrophobicContact CE1-CD1 3.78Å; Y41-Y103 AromaticContact CE1-CE1 3.7Å; Y41-Y103 HydrophobicContact CE1-CE1 3.7Å; Y41-Y103 HydrophobicContact CE2-CD1 4.43Å; Y41-Y103 AromaticContact CZ-CD1 3.98Å; L46-Y103 HydrophobicContact CD1-CD1 3.85Å; L46-Y103 HydrophobicContact CD1-CE1 3.89Å; L46-Y103 HydrophobicContact CD1-CG 4.25Å; L46-Y103 HydrophobicContact CD2-CD1 4.46Å; L46-Y103 HydrophobicContact CD2-CE1 3.66Å; L46-Y103 HydrophobicContact CD2-CE2 4.37Å; L46-Y103 WeakPolarHBondContact CD2-OH 3.37Å; L46-Y103 HydrophobicContact CG-CE1 4.42Å; W48-Y103 HydrophobicContact CZ2-CD2 4.26Å; W48-Y103 HydrophobicContact CZ2-CG 4.38Å; D68-Y103 HydrophobicContact CB-CE2 4.25Å; D68-Y103 PolarHBondContact OD2-OH 3.34Å; F71-Y103 HydrophobicContact CB-CD2 4.41Å; F71-Y103 AromaticContact CD1-CD2 3.82Å; F71-Y103 HydrophobicContact CD1-CD2 3.82Å; F71-Y103 AromaticContact CD2-CD2 3.97Å; F71-Y103 HydrophobicContact CD2-CD2 3.97Å; F71-Y103 HydrophobicContact CE1-CD2 4.01Å; F71-Y103 VanDerWaalsContact CE2-CA 3.48Å; F71-Y103 HydrophobicContact CE2-CD2 4.17Å; F71-Y103 AromaticContact CG-CD2 3.79Å; F71-Y103 HydrophobicContact CG-CD2 3.79Å; F71-Y103 HydrophobicContact CG-CE2 4.36Å; F71-Y103 HydrophobicContact CZ-CD2 4.18Å; L99-Y103 WeakPolarHBondContact O-CB 3.45Å; L99-Y103 PolarHBondContact O-N 3.1Å; V100-Y103 WeakPolarHBondContact O-CB 3.45Å; V100-Y103 PolarHBondContact O-N 3.43Å; Q101-Y103 VanDerWaalsContact C-N 3.32Å; Q101-Y103 PolarHBondContact O-N 3.27Å; Y103-F106 HydrophobicContact CD2-CD1 4.22Å; Y103-F106 HydrophobicContact CE2-CD1 4.17Å; Y103-F106 HydrophobicContact CE2-CE1 4.36Å; Y103-F106 WeakPolarHBondContact O-CB 3.5Å; Y103-F106 PolarHBondContact O-N 3.19Å; Y103-Q107 HydrophobicContact CD1-CG 4.02Å; Y103-Q107 HydrophobicContact CE1-CG 3.68Å; Y103-Q107 VanDerWaalsContact CZ-NE2 3.25Å; Y103-Q107 WeakPolarHBondContact O-CG 3.13Å; Y103-Q107 PolarHBondContact O-N 2.76Å; Y103-Q107 PolarHBondContact OH-NE2 2.93Å; Y103-Y137 WeakPolarHBondContact OH-CE2 3.4Å
104	H	88.7	Confident	88.9	Confident	41 Å²	41	47.4 Å²	47.4	19%	0.19	23%	0.225	C	C	.	.	H	α-helix	trans	-61.6	-45.7	172.8	175.8	71.6	0	0	0	112.2	Y41 V100 Q101 Q102 F106 Q107 C108 M134	Y41-H104 VanDerWaalsContact OH-CA 3.28Å; Y41-H104 WeakPolarHBondContact OH-CA 3.08Å; Y41-H104 VanDerWaalsContact OH-CB 3.3Å; Y41-H104 WeakPolarHBondContact OH-CB 3.37Å; Y41-H104 PolarHBondContact OH-ND1 3.44Å; V100-H104 PolarHBondContact O-N 3.27Å; Q101-H104 WeakPolarHBondContact O-CB 3.45Å; Q101-H104 PolarHBondContact O-N 3.26Å; Q102-H104 VanDerWaalsContact C-N 3.31Å; Q102-H104 PolarHBondContact O-N 3.37Å; H104-F106 VanDerWaalsContact C-N 3.25Å; H104-F106 PolarHBondContact O-N 3.3Å; H104-Q107 PolarHBondContact O-N 3.09Å; H104-Q107 VanDerWaalsContact O-N 3.12Å; H104-C108 PolarHBondContact O-N 3.4Å; H104-C108 PolarHBondContact O-SG 3.46Å; H104-M134 PolarHBondContact CE1-O 3.06Å
105	Q	89	Confident	88.2	Confident	103 Å²	103	49.8 Å²	49.8	48%	0.481	25%	0.247	S	C	.	.	H	α-helix	trans	-59.7	-38.9	175.8	-67.6	178.2	-2.7	0	0	112	Q101 Q102 C108 S109	Q101-Q105 PolarHBondContact O-N 3.43Å; Q101-Q105 VanDerWaalsContact O-N 3.1Å; Q102-Q105 VanDerWaalsContact NE2-OE1 3.07Å; Q102-Q105 PolarHBondContact O-N 2.9Å; Q105-C108 WeakPolarHBondContact O-CB 3.47Å; Q105-C108 PolarHBondContact O-N 3.22Å; Q105-S109 PolarHBondContact O-N 2.93Å
106	F	91	Very high	87.4	Confident	31 Å²	31	56.1 Å²	56.1	14%	0.136	27%	0.27	C	S	.	.	H	α-helix	trans	-64	-40.9	173.7	168.9	-107.5	0	0	0	113.1	E70 F71 Q102 Y103 H104 C108 S109 R110	E70-F106 HydrophobicContact CB-CE2 4.25Å; E70-F106 HydrophobicContact CB-CZ 4Å; E70-F106 WeakPolarHBondContact O-CE2 3.39Å; F71-F106 HydrophobicContact CB-CD1 4.14Å; F71-F106 HydrophobicContact CB-CE1 3.88Å; F71-F106 HydrophobicContact CB-CZ 4.07Å; F71-F106 HydrophobicContact CD2-CB 3.81Å; F71-F106 AromaticContact CD2-CD1 3.89Å; F71-F106 HydrophobicContact CD2-CD1 3.89Å; F71-F106 HydrophobicContact CD2-CD2 4.35Å; F71-F106 HydrophobicContact CD2-CE1 4.49Å; F71-F106 AromaticContact CD2-CG 3.78Å; F71-F106 HydrophobicContact CD2-CG 3.78Å; F71-F106 HydrophobicContact CE2-CB 4.14Å; F71-F106 HydrophobicContact CG-CD1 4.34Å; Q102-F106 PolarHBondContact O-N 3.35Å; Y103-F106 HydrophobicContact CD2-CD1 4.22Å; Y103-F106 HydrophobicContact CE2-CD1 4.17Å; Y103-F106 HydrophobicContact CE2-CE1 4.36Å; Y103-F106 WeakPolarHBondContact O-CB 3.5Å; Y103-F106 PolarHBondContact O-N 3.19Å; H104-F106 VanDerWaalsContact C-N 3.25Å; H104-F106 PolarHBondContact O-N 3.3Å; F106-C108 VanDerWaalsContact C-N 3.33Å; F106-S109 PolarHBondContact O-N 3.44Å; F106-S109 PolarHBondContact O-OG 3.24Å; F106-R110 PolarHBondContact O-N 3.47Å; F106-R110 VanDerWaalsContact O-N 3.11Å
107	Q	87.1	Confident	86.6	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-66.2	-37.9	174.3	-70.1	-66.4	-15.2	0	0	111.8	Y41 Y103 H104 S109 R110 L111 I136 A138	Y41-Q107 HydrophobicContact CE1-CG 4.39Å; Y103-Q107 HydrophobicContact CD1-CG 4.02Å; Y103-Q107 HydrophobicContact CE1-CG 3.68Å; Y103-Q107 VanDerWaalsContact CZ-NE2 3.25Å; Y103-Q107 WeakPolarHBondContact O-CG 3.13Å; Y103-Q107 PolarHBondContact O-N 2.76Å; Y103-Q107 PolarHBondContact OH-NE2 2.93Å; H104-Q107 PolarHBondContact O-N 3.09Å; H104-Q107 VanDerWaalsContact O-N 3.12Å; Q107-S109 VanDerWaalsContact C-N 3.33Å; Q107-S109 PolarHBondContact O-N 3.08Å; Q107-R110 PolarHBondContact O-N 3.08Å; Q107-L111 PolarHBondContact O-N 2.9Å; Q107-I136 VanDerWaalsContact CB-O 3.24Å; Q107-I136 WeakPolarHBondContact CB-O 3.39Å; Q107-I136 WeakPolarHBondContact CG-O 3.44Å; Q107-A138 PolarHBondContact OE1-O 3.05Å
108	C	84.8	Confident	86.1	Confident	14 Å²	14	54.3 Å²	54.3	10%	0.095	26%	0.264	C	S	.	.	H	α-helix	trans	-63.6	-35.6	172.9	-73.2	0	0	0	0	112.5	H104 Q105 F106 L111 R112	H104-C108 PolarHBondContact O-N 3.4Å; H104-C108 PolarHBondContact O-SG 3.46Å; Q105-C108 WeakPolarHBondContact O-CB 3.47Å; Q105-C108 PolarHBondContact O-N 3.22Å; F106-C108 VanDerWaalsContact C-N 3.33Å; C108-L111 WeakPolarHBondContact O-CB 3.49Å; C108-L111 PolarHBondContact O-N 2.87Å; C108-R112 WeakPolarHBondContact O-CG 3.4Å; C108-R112 PolarHBondContact O-N 3.15Å
109	S	86.7	Confident	85.4	Confident	60 Å²	60	60.2 Å²	60.2	42%	0.42	29%	0.29	S	S	.	.	H	α-helix	trans	-69.1	-39.4	175.8	72.6	0	0	0	0	111.9	Q105 F106 Q107 L111 R112	Q105-S109 PolarHBondContact O-N 2.93Å; F106-S109 PolarHBondContact O-N 3.44Å; F106-S109 PolarHBondContact O-OG 3.24Å; Q107-S109 VanDerWaalsContact C-N 3.33Å; Q107-S109 PolarHBondContact O-N 3.08Å; S109-L111 VanDerWaalsContact C-N 3.34Å; S109-L111 PolarHBondContact O-N 3.06Å; S109-R112 WeakPolarHBondContact O-CB 3.39Å; S109-R112 PolarHBondContact O-N 2.91Å
110	R	83.9	Confident	84.6	Confident	26 Å²	26	62.6 Å²	62.6	10%	0.098	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-40.1	171.1	-75.8	-175.9	166.3	166.4	3.7	112.6	D68 E70 F106 Q107 R112 E113 A138	D68-R110 IonicContact OD1-CZ 3.64Å; D68-R110 IonicContact OD1-NH1 3.8Å; D68-R110 PolarHBondContact OD1-NH1 3.11Å; D68-R110 IonicContact OD1-NH2 2.73Å; D68-R110 PolarHBondContact OD1-NH2 3.27Å; E70-R110 IonicContact OE2-CZ 2.71Å; E70-R110 IonicContact OE2-NE 2.83Å; E70-R110 IonicContact OE2-NH2 3.47Å; E70-R110 PolarHBondContact OE2-NH2 2.74Å; F106-R110 PolarHBondContact O-N 3.47Å; F106-R110 VanDerWaalsContact O-N 3.11Å; Q107-R110 PolarHBondContact O-N 3.08Å; R110-R112 PolarHBondContact O-N 3.03Å; R110-E113 WeakPolarHBondContact O-CB 3.44Å; R110-E113 WeakPolarHBondContact O-CG 3.48Å; R110-E113 PolarHBondContact O-N 2.96Å; R110-E113 VanDerWaalsContact O-N 3.1Å; R110-A138 HydrophobicContact CB-CB 4.16Å
111	L	82.9	Confident	83.9	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-57.6	-36.3	177.5	-167.5	74.8	0	0	0	112.3	Q107 C108 S109 E113 S114 L117 M118 Y121 I136 V145	Q107-L111 PolarHBondContact O-N 2.9Å; C108-L111 WeakPolarHBondContact O-CB 3.49Å; C108-L111 PolarHBondContact O-N 2.87Å; S109-L111 VanDerWaalsContact C-N 3.34Å; S109-L111 PolarHBondContact O-N 3.06Å; L111-E113 PolarHBondContact O-N 2.82Å; L111-E113 VanDerWaalsContact O-N 3.15Å; L111-S114 PolarHBondContact O-N 2.91Å; L111-L117 HydrophobicContact CD1-CB 3.58Å; L111-L117 HydrophobicContact CD1-CD1 4.41Å; L111-L117 HydrophobicContact CG-CB 4.21Å; L111-M118 HydrophobicContact CD2-SD 4.43Å; L111-Y121 VanDerWaalsContact CD2-CB 3.5Å; L111-Y121 HydrophobicContact CD2-CD1 3.9Å; L111-Y121 HydrophobicContact CD2-CD2 4.38Å; L111-Y121 HydrophobicContact CD2-CG 3.68Å; L111-I136 HydrophobicContact CD1-CG2 4.45Å; L111-V145 HydrophobicContact CD1-CB 4.42Å; L111-V145 HydrophobicContact CD1-CG1 4.09Å; L111-V145 HydrophobicContact CD1-CG2 3.46Å; L111-V145 VanDerWaalsContact CD1-CG2 3.46Å
112	R	80.1	Confident	83.4	Confident	176 Å²	176	62.1 Å²	62.1	66%	0.664	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.6	179.8	-68.4	173.7	-173	-160.5	2	113.5	C108 S109 R110 S114 M118	C108-R112 WeakPolarHBondContact O-CG 3.4Å; C108-R112 PolarHBondContact O-N 3.15Å; S109-R112 WeakPolarHBondContact O-CB 3.39Å; S109-R112 PolarHBondContact O-N 2.91Å; R110-R112 PolarHBondContact O-N 3.03Å; R112-S114 PolarHBondContact O-N 3.26Å; R112-M118 HydrophobicContact CG-CE 4.4Å; R112-M118 HydrophobicContact CG-SD 3.72Å
113	E	79.8	Confident	82.8	Confident	172 Å²	172	64.1 Å²	64.1	80%	0.804	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-20.3	172.3	-60.4	-178.3	-179.4	0	0	111.9	R110 L111	R110-E113 WeakPolarHBondContact O-CB 3.44Å; R110-E113 WeakPolarHBondContact O-CG 3.48Å; R110-E113 PolarHBondContact O-N 2.96Å; R110-E113 VanDerWaalsContact O-N 3.1Å; L111-E113 PolarHBondContact O-N 2.82Å; L111-E113 VanDerWaalsContact O-N 3.15Å
114	S	79.7	Confident	82.1	Confident	35 Å²	35	66.2 Å²	66.2	25%	0.245	32%	0.322	C	S	.	.			trans	-111.1	104.4	174.3	-173.1	0	0	0	0	111.5	L111 R112 R116 L117 M118	L111-S114 PolarHBondContact O-N 2.91Å; R112-S114 PolarHBondContact O-N 3.26Å; S114-R116 PolarHBondContact O-N 3.21Å; S114-L117 PolarHBondContact O-N 3.06Å; S114-M118 WeakPolarHBondContact O-CB 3.43Å; S114-M118 PolarHBondContact O-N 3.24Å
115	S	79.6	Confident	81.4	Confident	106 Å²	106	67.2 Å²	67.2	74%	0.741	33%	0.328	S	S	*	.	H	α-helix	trans	-56.3	-34.3	176.7	55.3	0	0	0	0	113.2	F119	S115-F119 PolarHBondContact O-N 3.26Å; S115-F119 VanDerWaalsContact O-N 3.09Å
116	R	78.6	Confident	80.7	Confident	132 Å²	132	69.2 Å²	69.2	50%	0.498	34%	0.338	S	S	.	.	H	α-helix	trans	-64.4	-52.7	177.2	-178	-175.9	-173	138.6	19.9	112	S114 M118 F119 E120 I161	S114-R116 PolarHBondContact O-N 3.21Å; R116-M118 VanDerWaalsContact C-N 3.31Å; R116-F119 WeakPolarHBondContact O-CB 3.26Å; R116-F119 PolarHBondContact O-N 3.48Å; R116-E120 IonicContact NE-OE1 3.58Å; R116-E120 PolarHBondContact O-N 3.3Å; R116-I161 VanDerWaalsContact CZ-CD1 3.42Å
117	L	77.4	Confident	79.8	Confident	21 Å²	21	72 Å²	72	11%	0.11	35%	0.351	C	S	.	.	H	α-helix	trans	-71.3	-33	-176.3	-65.3	164.5	0	0	0	111.1	L111 S114 F119 E120 Y121 V145 I157	L111-L117 HydrophobicContact CD1-CB 3.58Å; L111-L117 HydrophobicContact CD1-CD1 4.41Å; L111-L117 HydrophobicContact CG-CB 4.21Å; S114-L117 PolarHBondContact O-N 3.06Å; L117-F119 VanDerWaalsContact C-N 3.34Å; L117-E120 PolarHBondContact O-N 3.29Å; L117-Y121 WeakPolarHBondContact O-CB 3.45Å; L117-Y121 PolarHBondContact O-N 2.98Å; L117-V145 HydrophobicContact CB-CG2 4.22Å; L117-V145 HydrophobicContact CD1-CB 4.48Å; L117-V145 HydrophobicContact CD1-CG2 3.35Å; L117-V145 HydrophobicContact CD2-CB 4.07Å; L117-V145 HydrophobicContact CD2-CG2 3.76Å; L117-V145 HydrophobicContact CG-CG2 3.96Å; L117-I157 HydrophobicContact CD2-CG2 4.32Å
118	M	80.4	Confident	78.7	Confident	40 Å²	40	77.9 Å²	77.9	20%	0.197	39%	0.389	C	S	.	.	H	α-helix	trans	-63.3	-38.8	172.9	-172.2	64.9	-162.3	0	0	112.2	L111 R112 S114 R116 Y121 Q122	L111-M118 HydrophobicContact CD2-SD 4.43Å; R112-M118 HydrophobicContact CG-CE 4.4Å; R112-M118 HydrophobicContact CG-SD 3.72Å; S114-M118 WeakPolarHBondContact O-CB 3.43Å; S114-M118 PolarHBondContact O-N 3.24Å; R116-M118 VanDerWaalsContact C-N 3.31Å; M118-Y121 HydrophobicContact CE-CD1 4.16Å; M118-Y121 PolarHBondContact O-N 3.43Å; M118-Y121 HydrophobicContact SD-CD1 4.09Å; M118-Q122 WeakPolarHBondContact O-CB 3.33Å; M118-Q122 PolarHBondContact O-N 2.95Å
119	F	79.9	Confident	77.6	Confident	147 Å²	147	81.6 Å²	81.6	65%	0.645	41%	0.405	S	S	*	.	H	α-helix	trans	-61.7	-48.5	174.7	177.8	-94.7	0	0	0	111.4	S115 R116 L117 Y121 Q122 T123	S115-F119 PolarHBondContact O-N 3.26Å; S115-F119 VanDerWaalsContact O-N 3.09Å; R116-F119 WeakPolarHBondContact O-CB 3.26Å; R116-F119 PolarHBondContact O-N 3.48Å; L117-F119 VanDerWaalsContact C-N 3.34Å; F119-Y121 VanDerWaalsContact C-N 3.33Å; F119-Y121 PolarHBondContact O-N 3.43Å; F119-Q122 PolarHBondContact O-N 2.97Å; F119-T123 PolarHBondContact O-N 3.05Å; F119-T123 PolarHBondContact O-OG1 3.09Å
120	E	78.3	Confident	76.4	Confident	51 Å²	51	81 Å²	81	24%	0.238	39%	0.394	C	S	.	.	H	α-helix	trans	-60.5	-42	178.4	-68.3	173.5	-171.2	0	0	111.6	R116 L117 T123 L124 I157	R116-E120 IonicContact NE-OE1 3.58Å; R116-E120 PolarHBondContact O-N 3.3Å; L117-E120 PolarHBondContact O-N 3.29Å; E120-T123 PolarHBondContact O-N 3.06Å; E120-L124 WeakPolarHBondContact O-CG 3.25Å; E120-L124 PolarHBondContact O-N 3.15Å; E120-I157 WeakPolarHBondContact OE2-CD1 3.48Å
121	Y	78.1	Confident	75.3	Confident	29 Å²	29	81.3 Å²	81.3	11%	0.114	41%	0.405	C	S	.	.	H	α-helix	trans	-63.4	-43.8	175.1	173.6	-116.1	0	0	0	113.2	L111 L117 M118 F119 T123 L124 L125 M134 I136	L111-Y121 VanDerWaalsContact CD2-CB 3.5Å; L111-Y121 HydrophobicContact CD2-CD1 3.9Å; L111-Y121 HydrophobicContact CD2-CD2 4.38Å; L111-Y121 HydrophobicContact CD2-CG 3.68Å; L117-Y121 WeakPolarHBondContact O-CB 3.45Å; L117-Y121 PolarHBondContact O-N 2.98Å; M118-Y121 HydrophobicContact CE-CD1 4.16Å; M118-Y121 PolarHBondContact O-N 3.43Å; M118-Y121 HydrophobicContact SD-CD1 4.09Å; F119-Y121 VanDerWaalsContact C-N 3.33Å; F119-Y121 PolarHBondContact O-N 3.43Å; Y121-T123 VanDerWaalsContact C-N 3.31Å; Y121-T123 PolarHBondContact O-N 3.12Å; Y121-L124 PolarHBondContact O-N 3.38Å; Y121-L125 HydrophobicContact CD1-CD1 3.96Å; Y121-L125 HydrophobicContact CD2-CG 4.3Å; Y121-L125 HydrophobicContact CE1-CD1 3.38Å; Y121-L125 HydrophobicContact CE1-CG 4.14Å; Y121-L125 HydrophobicContact CE2-CD1 4.04Å; Y121-L125 HydrophobicContact CE2-CD2 4.1Å; Y121-L125 HydrophobicContact CE2-CG 3.88Å; Y121-L125 VanDerWaalsContact CZ-CD1 3.45Å; Y121-L125 PolarHBondContact O-N 2.89Å; Y121-M134 HydrophobicContact CD2-CE 3.66Å; Y121-M134 HydrophobicContact CD2-SD 4.23Å; Y121-M134 HydrophobicContact CE2-CE 3.34Å; Y121-M134 HydrophobicContact CE2-SD 4.25Å; Y121-I136 HydrophobicContact CD2-CD1 3.08Å; Y121-I136 HydrophobicContact CE2-CD1 3.03Å; Y121-I136 HydrophobicContact CE2-CG1 4.39Å; Y121-I136 HydrophobicContact CG-CD1 4.03Å
122	Q	80.4	Confident	74	Confident	93 Å²	93	90.6 Å²	90.6	44%	0.435	45%	0.448	S	S	.	.	H	α-helix	trans	-61.4	-42.3	178.4	-166.1	76.5	31.7	0	0	110.9	M118 F119 L124 L125 E126	M118-Q122 WeakPolarHBondContact O-CB 3.33Å; M118-Q122 PolarHBondContact O-N 2.95Å; F119-Q122 PolarHBondContact O-N 2.97Å; Q122-L124 VanDerWaalsContact C-N 3.35Å; Q122-L124 PolarHBondContact O-N 2.7Å; Q122-L125 PolarHBondContact O-N 3.41Å; Q122-E126 PolarHBondContact O-N 2.95Å
123	T	80.6	Confident	73.4	Confident	65 Å²	65	86.1 Å²	86.1	40%	0.399	44%	0.438	S	S	.	.	H	α-helix	trans	-62.9	-40.2	175.2	-56.6	0	0	0	0	111.9	F119 E120 Y121 E126	F119-T123 PolarHBondContact O-N 3.05Å; F119-T123 PolarHBondContact O-OG1 3.09Å; E120-T123 PolarHBondContact O-N 3.06Å; Y121-T123 VanDerWaalsContact C-N 3.31Å; Y121-T123 PolarHBondContact O-N 3.12Å; T123-E126 PolarHBondContact O-N 2.86Å
124	L	76.9	Confident	73	Confident	44 Å²	44	78.4 Å²	78.4	23%	0.23	40%	0.402	C	S	.	.	H	α-helix	trans	-68	-33.9	176.3	-72.6	169.5	0	0	0	112.8	E120 Y121 Q122 E126 E127 Y130 M134 I147	E120-L124 WeakPolarHBondContact O-CG 3.25Å; E120-L124 PolarHBondContact O-N 3.15Å; Y121-L124 PolarHBondContact O-N 3.38Å; Q122-L124 VanDerWaalsContact C-N 3.35Å; Q122-L124 PolarHBondContact O-N 2.7Å; L124-E126 VanDerWaalsContact C-N 3.26Å; L124-E126 PolarHBondContact O-N 3.09Å; L124-E127 WeakPolarHBondContact O-CB 3.17Å; L124-E127 PolarHBondContact O-N 3.28Å; L124-Y130 HydrophobicContact CD2-CD2 4.27Å; L124-Y130 HydrophobicContact CD2-CE2 4.21Å; L124-Y130 WeakPolarHBondContact O-CB 3.5Å; L124-M134 HydrophobicContact CB-CE 4.34Å; L124-M134 HydrophobicContact CB-SD 4.39Å; L124-M134 HydrophobicContact CD1-SD 4.44Å; L124-I147 HydrophobicContact CD1-CD1 3.42Å; L124-I147 VanDerWaalsContact CD1-CD1 3.42Å
125	L	73.6	Confident	73	Confident	62 Å²	62	77.1 Å²	77.1	33%	0.325	39%	0.392	S	S	.	.	H	α-helix	trans	-66.8	-25.4	176.3	-79.4	176.4	0	0	0	113.8	Y121 Q122 E127 M134	Y121-L125 HydrophobicContact CD1-CD1 3.96Å; Y121-L125 HydrophobicContact CD2-CG 4.3Å; Y121-L125 HydrophobicContact CE1-CD1 3.38Å; Y121-L125 HydrophobicContact CE1-CG 4.14Å; Y121-L125 HydrophobicContact CE2-CD1 4.04Å; Y121-L125 HydrophobicContact CE2-CD2 4.1Å; Y121-L125 HydrophobicContact CE2-CG 3.88Å; Y121-L125 VanDerWaalsContact CZ-CD1 3.45Å; Y121-L125 PolarHBondContact O-N 2.89Å; Q122-L125 PolarHBondContact O-N 3.41Å; L125-E127 PolarHBondContact O-N 3.19Å; L125-M134 HydrophobicContact CD2-CE 3.82Å; L125-M134 HydrophobicContact CG-CE 4.14Å
126	E	75	Confident	73	Confident	146 Å²	146	72.1 Å²	72.1	68%	0.682	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-18.7	177.4	-70.8	174.6	-172.2	0	0	112.4	Q122 T123 L124 P128	Q122-E126 PolarHBondContact O-N 2.95Å; T123-E126 PolarHBondContact O-N 2.86Å; L124-E126 VanDerWaalsContact C-N 3.26Å; L124-E126 PolarHBondContact O-N 3.09Å; E126-P128 WeakPolarHBondContact O-CD 3.29Å
127	E	71.6	Confident	73.1	Confident	90 Å²	90	68.3 Å²	68.3	42%	0.421	34%	0.343	S	S	.	.	S	Bend	trans	-85.9	117.1	178.4	-70.7	-74.7	149.9	0	0	110.1	L124 L125 Q129 Y130	L124-E127 WeakPolarHBondContact O-CB 3.17Å; L124-E127 PolarHBondContact O-N 3.28Å; L125-E127 PolarHBondContact O-N 3.19Å; E127-Q129 PolarHBondContact O-N 3.44Å; E127-Q129 PolarHBondContact OE2-NE2 2.98Å; E127-Q129 PolarHBondContact OE2-OE1 3.21Å; E127-Y130 HydrophobicContact CB-CD2 3.5Å; E127-Y130 VanDerWaalsContact CB-CD2 3.5Å; E127-Y130 HydrophobicContact CB-CE2 4.09Å; E127-Y130 HydrophobicContact CG-CD2 4.27Å; E127-Y130 HydrophobicContact CG-CE2 4.48Å; E127-Y130 PolarHBondContact O-N 3.35Å
128	P	64.1	Low	73.1	Confident	122 Å²	122	67.9 Å²	67.9	79%	0.792	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-24.6	-172.9	-24.7	33.1	0	0	0	114.6	E126 Y130	E126-P128 WeakPolarHBondContact O-CD 3.29Å; P128-Y130 VanDerWaalsContact C-N 3.34Å
129	Q	61.6	Low	72.5	Confident	92 Å²	92	67.3 Å²	67.3	43%	0.43	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-20.5	178.6	65.8	-90.8	15.7	0	0	114.3	E127	E127-Q129 PolarHBondContact O-N 3.44Å; E127-Q129 PolarHBondContact OE2-NE2 2.98Å; E127-Q129 PolarHBondContact OE2-OE1 3.21Å
130	Y	60.8	Low	71.6	Confident	49 Å²	49	65.2 Å²	65.2	19%	0.192	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-17.7	-174.9	-66.9	-78.6	0	0	0	114.3	L124 E127 P128 N133 M134 E149	L124-Y130 HydrophobicContact CD2-CD2 4.27Å; L124-Y130 HydrophobicContact CD2-CE2 4.21Å; L124-Y130 WeakPolarHBondContact O-CB 3.5Å; E127-Y130 HydrophobicContact CB-CD2 3.5Å; E127-Y130 VanDerWaalsContact CB-CD2 3.5Å; E127-Y130 HydrophobicContact CB-CE2 4.09Å; E127-Y130 HydrophobicContact CG-CD2 4.27Å; E127-Y130 HydrophobicContact CG-CE2 4.48Å; E127-Y130 PolarHBondContact O-N 3.35Å; P128-Y130 VanDerWaalsContact C-N 3.34Å; Y130-N133 CarbonylContact O-C 3.55Å; Y130-M134 VanDerWaalsContact O-CB 3.23Å; Y130-M134 WeakPolarHBondContact O-CB 3.41Å; Y130-E149 HydrophobicContact CD1-CB 4.46Å; Y130-E149 HydrophobicContact CD1-CG 3.8Å; Y130-E149 HydrophobicContact CE1-CB 4.19Å; Y130-E149 HydrophobicContact CE1-CG 3.63Å; Y130-E149 WeakPolarHBondContact CE1-OE2 3.49Å; Y130-E149 PolarHBondContact OH-OE2 3.17Å; Y130-E149 VanDerWaalsContact OH-OE2 3.1Å
131	G	60.9	Low	70.3	Confident	32 Å²	32	72 Å²	72	33%	0.33	37%	0.366	S	S	.	.	S	Bend	trans	-38.2	-101.2	-170	0	0	0	0	0	117.7	N133	G131-N133 PolarHBondContact O-N 3.01Å
132	E	57.6	Low	68.6	Low	198 Å²	198	76.2 Å²	76.2	93%	0.925	39%	0.39	S	S	*	.	S	Bend	trans	-74	-5.2	-177	-63.9	-175.1	163.6	0	0	113.5
133	N	65.6	Low	66.9	Low	83 Å²	83	78.6 Å²	78.6	44%	0.444	41%	0.406	S	S	.	.	S	Bend	trans	-111.1	47.9	-176.6	-62.1	-43.9	0	0	0	111.3	L8 Y130 G131	L8-N133 HydrophobicContact CD1-CB 4.34Å; L8-N133 WeakPolarHBondContact CD1-O 3.43Å; L8-N133 HydrophobicContact CD2-CB 4.05Å; Y130-N133 CarbonylContact O-C 3.55Å; G131-N133 PolarHBondContact O-N 3.01Å
134	M	73	Confident	65.4	Low	9 Å²	9	81.6 Å²	81.6	4%	0.044	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	132.5	172.3	177.4	168.7	42.2	0	0	111.9	H104 Y121 L124 L125 Y130 I136 I147	H104-M134 PolarHBondContact CE1-O 3.06Å; Y121-M134 HydrophobicContact CD2-CE 3.66Å; Y121-M134 HydrophobicContact CD2-SD 4.23Å; Y121-M134 HydrophobicContact CE2-CE 3.34Å; Y121-M134 HydrophobicContact CE2-SD 4.25Å; L124-M134 HydrophobicContact CB-CE 4.34Å; L124-M134 HydrophobicContact CB-SD 4.39Å; L124-M134 HydrophobicContact CD1-SD 4.44Å; L125-M134 HydrophobicContact CD2-CE 3.82Å; L125-M134 HydrophobicContact CG-CE 4.14Å; Y130-M134 VanDerWaalsContact O-CB 3.23Å; Y130-M134 WeakPolarHBondContact O-CB 3.41Å; M134-I136 HydrophobicContact CE-CD1 4.5Å; M134-I136 HydrophobicContact CG-CD1 4.27Å; M134-I136 HydrophobicContact CG-CG1 4.03Å; M134-I136 HydrophobicContact SD-CD1 4.15Å; M134-I136 HydrophobicContact SD-CG1 4.42Å; M134-I147 HydrophobicContact CG-CG2 3.79Å; M134-I147 HydrophobicContact SD-CG2 3.62Å
135	E	78.2	Confident	64.2	Low	9 Å²	9	80 Å²	80	4%	0.042	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	141.3	172.4	-82.4	177.7	-174.9	0	0	110.5	G7 L8 Y41 A42 I147 F148	G7-E135 WeakPolarHBondContact CA-OE1 3.26Å; L8-E135 HydrophobicContact CB-CG 4.26Å; L8-E135 HydrophobicContact CD1-CB 4.34Å; L8-E135 HydrophobicContact CD1-CG 3.87Å; L8-E135 HydrophobicContact CG-CG 4.12Å; L8-E135 PolarHBondContact N-OE1 3.09Å; Y41-E135 WeakPolarHBondContact CA-OE2 3.42Å; Y41-E135 HydrophobicContact CD2-CG 4Å; Y41-E135 HydrophobicContact CE2-CB 4.23Å; Y41-E135 HydrophobicContact CE2-CG 3.62Å; A42-E135 HydrophobicContact CB-CB 4.06Å; A42-E135 PolarHBondContact N-OE2 3.42Å; E135-I147 WeakPolarHBondContact O-CA 3.34Å; E135-F148 HydrophobicContact CB-CB 4.38Å; E135-F148 PolarHBondContact O-N 3.43Å; E135-F148 VanDerWaalsContact O-N 3.17Å
136	I	79.9	Confident	63.5	Low	1 Å²	1	81.7 Å²	81.7	1%	0.005	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	135.5	-173.2	-61.6	-177.9	0	0	0	109.6	Y41 Q107 L111 Y121 M134 V145 R146	Y41-I136 VanDerWaalsContact CE1-O 3.27Å; Y41-I136 WeakPolarHBondContact CE1-O 3.43Å; Y41-I136 PolarHBondContact OH-O 3.05Å; Q107-I136 VanDerWaalsContact CB-O 3.24Å; Q107-I136 WeakPolarHBondContact CB-O 3.39Å; Q107-I136 WeakPolarHBondContact CG-O 3.44Å; L111-I136 HydrophobicContact CD1-CG2 4.45Å; Y121-I136 HydrophobicContact CD2-CD1 3.08Å; Y121-I136 HydrophobicContact CE2-CD1 3.03Å; Y121-I136 HydrophobicContact CE2-CG1 4.39Å; Y121-I136 HydrophobicContact CG-CD1 4.03Å; M134-I136 HydrophobicContact CE-CD1 4.5Å; M134-I136 HydrophobicContact CG-CD1 4.27Å; M134-I136 HydrophobicContact CG-CG1 4.03Å; M134-I136 HydrophobicContact SD-CD1 4.15Å; M134-I136 HydrophobicContact SD-CG1 4.42Å; I136-V145 HydrophobicContact CG2-CG1 3.82Å; I136-R146 WeakPolarHBondContact CA-O 3.29Å
137	Y	80.7	Confident	62.6	Low	52 Å²	52	75.9 Å²	75.9	20%	0.204	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	123.7	172.2	-179.7	-94	0	0	0	110.8	E44 Y103 V145 R146	E44-Y137 HydrophobicContact CG-CD1 4.23Å; E44-Y137 HydrophobicContact CG-CE1 4.27Å; Y103-Y137 WeakPolarHBondContact OH-CE2 3.4Å; Y137-V145 WeakPolarHBondContact O-CA 3.45Å; Y137-R146 PolarHBondContact N-O 3.11Å; Y137-R146 PolarHBondContact O-N 3.13Å
138	A	78.7	Confident	61.8	Low	12 Å²	12	72 Å²	72	10%	0.099	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	111.7	173.9	0	0	0	0	0	109.7	Q107 R110 V145	Q107-A138 PolarHBondContact OE1-O 3.05Å; R110-A138 HydrophobicContact CB-CB 4.16Å; A138-V145 HydrophobicContact CB-CG2 4.49Å
139	G	67.8	Low	61.2	Low	28 Å²	28	68 Å²	68	29%	0.289	33%	0.33	S	S	.	.			trans	-77.2	144.5	-176.5	0	0	0	0	0	114	K141	G139-K141 VanDerWaalsContact C-N 3.32Å; G139-K141 PolarHBondContact O-N 3.13Å
140	K	60.8	Low	60.4	Low	103 Å²	103	68.5 Å²	68.5	45%	0.448	34%	0.336	S	S	.	.	S	Bend	trans	-65.6	-14.5	-173.4	-73.1	-178.1	174.5	175.8	0	117	E67 D68	E67-K140 PolarHBondContact O-NZ 3.4Å; E67-K140 VanDerWaalsContact O-NZ 3.11Å; D68-K140 WeakPolarHBondContact OD1-CE 3.43Å; D68-K140 IonicContact OD1-NZ 2.9Å
141	K	50.3	Low	59.7	Low	193 Å²	193	67.1 Å²	67.1	84%	0.839	34%	0.336	S	S	*	.	S	Bend	trans	-137.1	-15.1	-167.7	-77.3	-171.8	176	178.5	0	117.5	G139	G139-K141 VanDerWaalsContact C-N 3.32Å; G139-K141 PolarHBondContact O-N 3.13Å
142	N	42.1	Very low	58.7	Low	117 Å²	117	72.9 Å²	72.9	63%	0.626	35%	0.353	S	S	*	.	S	Bend	trans	-133.1	123.4	171.8	-61.1	-34.5	0	0	0	105	W144	N142-W144 HydrophobicContact CB-CG 4.34Å; N142-W144 PolarHBondContact O-N 3.11Å
143	N	45.3	Very low	57.9	Low	143 Å²	143	69.1 Å²	69.1	77%	0.765	33%	0.333	S	S	*	.			trans	-54.5	66.4	177.2	-67	-21.3	0	0	0	114.3
144	W	48.2	Very low	57	Low	129 Å²	129	69.6 Å²	69.6	49%	0.489	34%	0.336	S	S	.	.			trans	-129.4	131.8	-175.3	-64	56.6	0	0	0	107.5	N142 H158	N142-W144 HydrophobicContact CB-CG 4.34Å; N142-W144 PolarHBondContact O-N 3.11Å; W144-H158 AromaticContact CD1-CE1 3.7Å; W144-H158 AromaticContact CD1-ND1 3.85Å; W144-H158 HydrophobicContact CD2-CB 3.81Å; W144-H158 AromaticContact CD2-CD2 3.85Å; W144-H158 AromaticContact CD2-CE1 3.5Å; W144-H158 VanDerWaalsContact CD2-CE1 3.5Å; W144-H158 AromaticContact CD2-CG 3.31Å; W144-H158 AromaticContact CD2-ND1 3.1Å; W144-H158 AromaticContact CD2-NE2 3.95Å; W144-H158 AromaticContact CE2-CD2 3.39Å; W144-H158 AromaticContact CE2-CE1 3.07Å; W144-H158 AromaticContact CE2-CG 3.38Å; W144-H158 AromaticContact CE2-ND1 3.22Å; W144-H158 AromaticContact CE2-NE2 3.19Å; W144-H158 HydrophobicContact CE3-CB 3.07Å; W144-H158 AromaticContact CE3-CD2 3.81Å; W144-H158 AromaticContact CE3-CG 3.12Å; W144-H158 AromaticContact CE3-ND1 3.41Å; W144-H158 AromaticContact CG-CE1 3.91Å; W144-H158 AromaticContact CG-ND1 3.6Å; W144-H158 HydrophobicContact CH2-CB 3.52Å; W144-H158 AromaticContact CH2-CD2 2.86Å; W144-H158 WeakPolarHBondContact CH2-CD2 3.49Å; W144-H158 AromaticContact CH2-CG 3.13Å; W144-H158 AromaticContact CH2-ND1 3.91Å; W144-H158 AromaticContact CH2-NE2 3.53Å; W144-H158 HydrophobicContact CZ2-CB 4.19Å; W144-H158 AromaticContact CZ2-CD2 2.9Å; W144-H158 WeakPolarHBondContact CZ2-CD2 3.22Å; W144-H158 AromaticContact CZ2-CE1 3.43Å; W144-H158 VanDerWaalsContact CZ2-CE1 3.43Å; W144-H158 WeakPolarHBondContact CZ2-CE1 3.47Å; W144-H158 AromaticContact CZ2-CG 3.33Å; W144-H158 AromaticContact CZ2-ND1 3.65Å; W144-H158 AromaticContact CZ2-NE2 2.97Å; W144-H158 WeakPolarHBondContact CZ2-NE2 3.28Å; W144-H158 HydrophobicContact CZ3-CB 2.91Å; W144-H158 AromaticContact CZ3-CD2 3.37Å; W144-H158 WeakPolarHBondContact CZ3-CD2 3.27Å; W144-H158 AromaticContact CZ3-CG 3.04Å; W144-H158 AromaticContact CZ3-ND1 3.81Å; W144-H158 AromaticContact NE1-CE1 3.18Å; W144-H158 PolarHBondContact NE1-CE1 3.02Å; W144-H158 AromaticContact NE1-ND1 3.64Å; W144-H158 AromaticContact NE1-NE2 3.58Å
145	V	52.3	Low	55.6	Low	9 Å²	9	73.4 Å²	73.4	6%	0.055	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	135.2	177.8	174.8	0	0	0	0	107.8	L111 L117 I136 Y137 A138 I147	L111-V145 HydrophobicContact CD1-CB 4.42Å; L111-V145 HydrophobicContact CD1-CG1 4.09Å; L111-V145 HydrophobicContact CD1-CG2 3.46Å; L111-V145 VanDerWaalsContact CD1-CG2 3.46Å; L117-V145 HydrophobicContact CB-CG2 4.22Å; L117-V145 HydrophobicContact CD1-CB 4.48Å; L117-V145 HydrophobicContact CD1-CG2 3.35Å; L117-V145 HydrophobicContact CD2-CB 4.07Å; L117-V145 HydrophobicContact CD2-CG2 3.76Å; L117-V145 HydrophobicContact CG-CG2 3.96Å; I136-V145 HydrophobicContact CG2-CG1 3.82Å; Y137-V145 WeakPolarHBondContact O-CA 3.45Å; A138-V145 HydrophobicContact CB-CG2 4.49Å; V145-I147 HydrophobicContact CG1-CG1 4.1Å
146	R	59.4	Low	53.9	Low	98 Å²	98	79.4 Å²	79.4	37%	0.37	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	134.9	169.4	-67.3	-170.5	-179.6	166.8	12	109.3	G43 E44 I136 Y137 F148	G43-R146 PolarHBondContact O-NH1 3.35Å; E44-R146 IonicContact OE1-CZ 3.79Å; E44-R146 IonicContact OE1-NH1 3.2Å; E44-R146 PolarHBondContact OE1-NH1 3.15Å; E44-R146 IonicContact OE1-NH2 2.98Å; E44-R146 PolarHBondContact OE1-NH2 2.98Å; I136-R146 WeakPolarHBondContact CA-O 3.29Å; Y137-R146 PolarHBondContact N-O 3.11Å; Y137-R146 PolarHBondContact O-N 3.13Å; R146-F148 HydrophobicContact CB-CE2 4.31Å
147	I	55.5	Low	52.3	Low	25 Å²	25	81.4 Å²	81.4	13%	0.128	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132	177.7	-56.7	-175.7	0	0	0	107.5	L124 M134 E135 V145 I157	L124-I147 HydrophobicContact CD1-CD1 3.42Å; L124-I147 VanDerWaalsContact CD1-CD1 3.42Å; M134-I147 HydrophobicContact CG-CG2 3.79Å; M134-I147 HydrophobicContact SD-CG2 3.62Å; E135-I147 WeakPolarHBondContact O-CA 3.34Å; V145-I147 HydrophobicContact CG1-CG1 4.1Å; I147-I157 HydrophobicContact CD1-CD1 3.71Å; I147-I157 HydrophobicContact CG1-CD1 4.34Å
148	F	55.6	Low	50.4	Low	8 Å²	8	82.5 Å²	82.5	4%	0.035	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.3	178	-87.7	-106.9	0	0	0	110.8	A42 G43 E135 R146 K153	A42-F148 HydrophobicContact CB-CD2 4.25Å; A42-F148 WeakPolarHBondContact O-CD2 3.37Å; A42-F148 WeakPolarHBondContact O-CE2 3.47Å; G43-F148 VanDerWaalsContact N-CZ 3.28Å; E135-F148 HydrophobicContact CB-CB 4.38Å; E135-F148 PolarHBondContact O-N 3.43Å; E135-F148 VanDerWaalsContact O-N 3.17Å; R146-F148 HydrophobicContact CB-CE2 4.31Å; F148-K153 HydrophobicContact CE1-CB 4.06Å; F148-K153 HydrophobicContact CE1-CG 4.02Å; F148-K153 HydrophobicContact CZ-CB 4.28Å; F148-K153 HydrophobicContact CZ-CD 4.45Å; F148-K153 HydrophobicContact CZ-CG 3.73Å
149	E	50.1	Low	48.1	Very low	39 Å²	39	86.5 Å²	86.5	18%	0.182	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	128.9	179.2	-163.6	-151.1	145.9	0	0	109.8	Y130 G151 K152	Y130-E149 HydrophobicContact CD1-CB 4.46Å; Y130-E149 HydrophobicContact CD1-CG 3.8Å; Y130-E149 HydrophobicContact CE1-CB 4.19Å; Y130-E149 HydrophobicContact CE1-CG 3.63Å; Y130-E149 WeakPolarHBondContact CE1-OE2 3.49Å; Y130-E149 PolarHBondContact OH-OE2 3.17Å; Y130-E149 VanDerWaalsContact OH-OE2 3.1Å; E149-G151 VanDerWaalsContact C-N 3.26Å; E149-G151 PolarHBondContact O-N 3.49Å; E149-K152 PolarHBondContact O-N 2.68Å
150	N	46.6	Very low	46.4	Very low	101 Å²	101	93.4 Å²	93.4	54%	0.54	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	38.7	163.9	-71.8	-41.5	0	0	0	116.1	K152	N150-K152 PolarHBondContact O-N 3.34Å
151	G	45.3	Very low	45.2	Very low	20 Å²	20	92.3 Å²	92.3	21%	0.206	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.4	11.3	-179.9	0	0	0	0	0	115.1	E149	E149-G151 VanDerWaalsContact C-N 3.26Å; E149-G151 PolarHBondContact O-N 3.49Å
152	K	39.7	Very low	44.3	Very low	154 Å²	154	89 Å²	89	67%	0.67	43%	0.429	S	S	*	.	B	Isolated β-bridge	trans	-103.3	128.7	170.6	-70.2	-177.2	-177.5	171.3	0	109.2	E149 N150 D154	E149-K152 PolarHBondContact O-N 2.68Å; N150-K152 PolarHBondContact O-N 3.34Å; K152-D154 PolarHBondContact O-N 3.32Å; K152-D154 VanDerWaalsContact O-N 3.14Å
153	K	41.8	Very low	43.6	Very low	118 Å²	118	90.3 Å²	90.3	51%	0.513	44%	0.437	S	S	.	.			trans	-77.4	92.7	174.1	-172.9	178	-161.7	-127.6	0	108.4	F148 D155	F148-K153 HydrophobicContact CE1-CB 4.06Å; F148-K153 HydrophobicContact CE1-CG 4.02Å; F148-K153 HydrophobicContact CZ-CB 4.28Å; F148-K153 HydrophobicContact CZ-CD 4.45Å; F148-K153 HydrophobicContact CZ-CG 3.73Å; K153-D155 VanDerWaalsContact C-N 3.31Å; K153-D155 WeakPolarHBondContact CE-OD1 3.49Å; K153-D155 WeakPolarHBondContact CE-OD2 3.41Å; K153-D155 WeakPolarHBondContact CG-OD1 3.49Å; K153-D155 IonicContact NZ-OD1 2.71Å; K153-D155 PolarHBondContact NZ-OD1 3.42Å; K153-D155 IonicContact NZ-OD2 3.3Å; K153-D155 PolarHBondContact NZ-OD2 2.91Å; K153-D155 PolarHBondContact O-N 3.42Å; K153-D155 VanDerWaalsContact O-N 3.15Å
154	D	44.8	Very low	43	Very low	94 Å²	94	87.1 Å²	87.1	50%	0.503	43%	0.425	S	S	.	.			trans	-82.1	86.1	164.6	-80.2	-9.2	0	0	0	108.2	K152 F156	K152-D154 PolarHBondContact O-N 3.32Å; K152-D154 VanDerWaalsContact O-N 3.14Å; D154-F156 PolarHBondContact O-N 3.37Å
155	D	44.1	Very low	42.2	Very low	89 Å²	89	91.3 Å²	91.3	48%	0.476	44%	0.443	S	S	.	.			trans	-68.4	61.3	170.6	-82.2	-30	0	0	0	110.5	K153	K153-D155 VanDerWaalsContact C-N 3.31Å; K153-D155 WeakPolarHBondContact CE-OD1 3.49Å; K153-D155 WeakPolarHBondContact CE-OD2 3.41Å; K153-D155 WeakPolarHBondContact CG-OD1 3.49Å; K153-D155 IonicContact NZ-OD1 2.71Å; K153-D155 PolarHBondContact NZ-OD1 3.42Å; K153-D155 IonicContact NZ-OD2 3.3Å; K153-D155 PolarHBondContact NZ-OD2 2.91Å; K153-D155 PolarHBondContact O-N 3.42Å; K153-D155 VanDerWaalsContact O-N 3.15Å
156	F	43.1	Very low	41.3	Very low	134 Å²	134	101 Å²	101	59%	0.588	50%	0.502	S	S	*	.			trans	-150.6	72.4	180	-108.2	-79.4	0	0	0	115.9	D154 N159	D154-F156 PolarHBondContact O-N 3.37Å; F156-N159 HydrophobicContact CE1-CB 3.79Å; F156-N159 HydrophobicContact CZ-CB 4.17Å
157	I	46.4	Very low	40.4	Very low	43 Å²	43	101.2 Å²	101.2	22%	0.221	51%	0.508	C	S	.	.	S	Bend	trans	-133.5	63.7	136.5	-48.8	-177.7	0	0	0	109.7	L117 E120 I147	L117-I157 HydrophobicContact CD2-CG2 4.32Å; E120-I157 WeakPolarHBondContact OE2-CD1 3.48Å; I147-I157 HydrophobicContact CD1-CD1 3.71Å; I147-I157 HydrophobicContact CG1-CD1 4.34Å
158	H	39.4	Very low	39.6	Very low	76 Å²	76	105.2 Å²	105.2	35%	0.352	53%	0.528	S	S	.	.	S	Bend	trans	-156.6	25.6	152.6	-142.9	84.8	0	0	0	117.9	W144	W144-H158 AromaticContact CD1-CE1 3.7Å; W144-H158 AromaticContact CD1-ND1 3.85Å; W144-H158 HydrophobicContact CD2-CB 3.81Å; W144-H158 AromaticContact CD2-CD2 3.85Å; W144-H158 AromaticContact CD2-CE1 3.5Å; W144-H158 VanDerWaalsContact CD2-CE1 3.5Å; W144-H158 AromaticContact CD2-CG 3.31Å; W144-H158 AromaticContact CD2-ND1 3.1Å; W144-H158 AromaticContact CD2-NE2 3.95Å; W144-H158 AromaticContact CE2-CD2 3.39Å; W144-H158 AromaticContact CE2-CE1 3.07Å; W144-H158 AromaticContact CE2-CG 3.38Å; W144-H158 AromaticContact CE2-ND1 3.22Å; W144-H158 AromaticContact CE2-NE2 3.19Å; W144-H158 HydrophobicContact CE3-CB 3.07Å; W144-H158 AromaticContact CE3-CD2 3.81Å; W144-H158 AromaticContact CE3-CG 3.12Å; W144-H158 AromaticContact CE3-ND1 3.41Å; W144-H158 AromaticContact CG-CE1 3.91Å; W144-H158 AromaticContact CG-ND1 3.6Å; W144-H158 HydrophobicContact CH2-CB 3.52Å; W144-H158 AromaticContact CH2-CD2 2.86Å; W144-H158 WeakPolarHBondContact CH2-CD2 3.49Å; W144-H158 AromaticContact CH2-CG 3.13Å; W144-H158 AromaticContact CH2-ND1 3.91Å; W144-H158 AromaticContact CH2-NE2 3.53Å; W144-H158 HydrophobicContact CZ2-CB 4.19Å; W144-H158 AromaticContact CZ2-CD2 2.9Å; W144-H158 WeakPolarHBondContact CZ2-CD2 3.22Å; W144-H158 AromaticContact CZ2-CE1 3.43Å; W144-H158 VanDerWaalsContact CZ2-CE1 3.43Å; W144-H158 WeakPolarHBondContact CZ2-CE1 3.47Å; W144-H158 AromaticContact CZ2-CG 3.33Å; W144-H158 AromaticContact CZ2-ND1 3.65Å; W144-H158 AromaticContact CZ2-NE2 2.97Å; W144-H158 WeakPolarHBondContact CZ2-NE2 3.28Å; W144-H158 HydrophobicContact CZ3-CB 2.91Å; W144-H158 AromaticContact CZ3-CD2 3.37Å; W144-H158 WeakPolarHBondContact CZ3-CD2 3.27Å; W144-H158 AromaticContact CZ3-CG 3.04Å; W144-H158 AromaticContact CZ3-ND1 3.81Å; W144-H158 AromaticContact NE1-CE1 3.18Å; W144-H158 PolarHBondContact NE1-CE1 3.02Å; W144-H158 AromaticContact NE1-ND1 3.64Å; W144-H158 AromaticContact NE1-NE2 3.58Å
159	N	30.7	Very low	38.7	Very low	96 Å²	96	110.6 Å²	110.6	51%	0.513	56%	0.556	S	S	.	*	S	Bend	trans	-147.3	18.2	167.7	-106.2	-34.8	0	0	0	115.4	F156	F156-N159 HydrophobicContact CE1-CB 3.79Å; F156-N159 HydrophobicContact CZ-CB 4.17Å
160	K	31.9	Very low	38.1	Very low	173 Å²	173	114.8 Å²	114.8	75%	0.752	58%	0.578	S	S	*	*	S	Bend	trans	-95.8	4.4	170.8	-130	-178	-176.7	-178.6	0	114.2
161	I	37.2	Very low	37.5	Very low	79 Å²	79	115.7 Å²	115.7	41%	0.405	58%	0.58	S	S	.	*	S	Bend	trans	-115.9	-10.1	-173.6	-67.4	155.5	0	0	0	113.4	R116	R116-I161 VanDerWaalsContact CZ-CD1 3.42Å
162	I	30.9	Very low	37	Very low	123 Å²	123	122.1 Å²	122.1	63%	0.631	61%	0.605	S	S	*	*	S	Bend	trans	-98	-16	172.4	-58.8	-177.9	0	0	0	112.6
163	N	27.2	Very low	36.8	Very low	146 Å²	146	119.8 Å²	119.8	78%	0.781	60%	0.6	S	S	*	*	S	Bend	trans	-113.6	24.8	-177.7	-78.6	-22.5	0	0	0	115.7
164	S	32	Very low	36.5	Very low	75 Å²	75	119.9 Å²	119.9	52%	0.524	61%	0.607	S	S	.	*	S	Bend	trans	-121.1	9.5	168.7	76.6	0	0	0	0	114.8
165	Y	32.8	Very low	35.8	Very low	217 Å²	217	122.1 Å²	122.1	85%	0.851	62%	0.616	S	S	*	*			trans	-144	73.1	167.7	-73.3	-78.5	0	0	0	110.7
166	V	33.3	Very low	35	Very low	214 Å²	214	125.1 Å²	125.1	100%	1.297	63%	0.629	S	S	*	*			trans	-129.8	0	132	179.9	0	0	0	0	106.4

Retrieved 166 of 166 residues in 77.8 ms (Link to these results)

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