A0A077Z830_TRITR Loading...

Zf-H2C2 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z830, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 483 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.2	Very low	44.8	Very low	231 Å²	231	143 Å²	143	100%	1.138	73%	0.728	S	S	*	*				0	-4.6	0	-77	167.2	174.3	0	0	114.3	Q3	M1-Q3 PolarHBondContact O-N 3.44Å
2	N	43.6	Very low	44.4	Very low	151 Å²	151	139.6 Å²	139.6	81%	0.807	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	9.1	-163.2	-63.4	8	0	0	0	116.5
3	Q	46	Very low	44.6	Very low	170 Å²	170	137.8 Å²	137.8	79%	0.794	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-9.3	-174.2	-76.9	175.4	-25.8	0	0	115.7	M1	M1-Q3 PolarHBondContact O-N 3.44Å
4	F	43.7	Very low	44.2	Very low	170 Å²	170	137.4 Å²	137.4	75%	0.746	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	0.5	-165.8	-91.2	-85.2	0	0	0	116.7
5	N	48.2	Very low	43.6	Very low	115 Å²	115	137.8 Å²	137.8	62%	0.615	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-19.4	-179.7	-79.7	-34.4	0	0	0	113.9	V8	N5-V8 PolarHBondContact O-N 2.75Å
6	D	44.8	Very low	43.3	Very low	83 Å²	83	134.1 Å²	134.1	44%	0.444	75%	0.745	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.8	-14.9	-165.1	-57.2	-46.1	0	0	0	114.5	V8 K9	D6-V8 VanDerWaalsContact C-N 3.33Å; D6-K9 WeakPolarHBondContact OD1-CD 3.5Å; D6-K9 IonicContact OD1-NZ 2.81Å; D6-K9 PolarHBondContact OD1-NZ 2.9Å
7	V	49.1	Very low	43.3	Very low	119 Å²	119	135.9 Å²	135.9	72%	0.721	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-35.1	168.7	-177.3	0	0	0	0	110.9
8	V	47.9	Very low	44.1	Very low	119 Å²	119	133.3 Å²	133.3	72%	0.721	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-75.4	-26	-179.1	-176.5	0	0	0	0	112	N5 D6	N5-V8 PolarHBondContact O-N 2.75Å; D6-V8 VanDerWaalsContact C-N 3.33Å
9	K	45.9	Very low	45.2	Very low	138 Å²	138	131.7 Å²	131.7	60%	0.6	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-77.9	-16.4	-175.3	-71.1	176.8	-171	160.7	0	115.3	D6 S11	D6-K9 WeakPolarHBondContact OD1-CD 3.5Å; D6-K9 IonicContact OD1-NZ 2.81Å; D6-K9 PolarHBondContact OD1-NZ 2.9Å; K9-S11 VanDerWaalsContact C-N 3.25Å; K9-S11 PolarHBondContact O-N 3.18Å
10	K	43.7	Very low	46.3	Very low	193 Å²	193	127.8 Å²	127.8	84%	0.839	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-79.8	10.8	-171	-71.8	-171.3	176.6	-175	0	115.9
11	S	39.2	Very low	47.3	Very low	84 Å²	84	124.6 Å²	124.6	59%	0.587	68%	0.68	S	S	*	*			trans	-135.4	58.1	174.7	54.7	0	0	0	0	112.5	K9 T13	K9-S11 VanDerWaalsContact C-N 3.25Å; K9-S11 PolarHBondContact O-N 3.18Å; S11-T13 PolarHBondContact O-N 2.81Å
12	A	39.8	Very low	48.6	Very low	102 Å²	102	115.6 Å²	115.6	84%	0.843	64%	0.635	S	S	*	*			trans	-77.9	-3	175.2	0	0	0	0	0	114.1
13	T	46.7	Very low	49.9	Very low	117 Å²	117	115.8 Å²	115.8	72%	0.718	63%	0.631	S	S	*	*	S	Bend	trans	-104.6	133	-178.4	40.3	0	0	0	0	112.4	S11	S11-T13 PolarHBondContact O-N 2.81Å
14	T	39.2	Very low	51	Low	131 Å²	131	112.8 Å²	112.8	80%	0.804	62%	0.618	S	S	*	*	S	Bend	trans	53.8	107.6	169.5	46.6	0	0	0	0	117.7	A16	T14-A16 PolarHBondContact O-N 3.42Å
15	T	35.1	Very low	52.2	Low	144 Å²	144	104.7 Å²	104.7	88%	0.883	58%	0.582	S	S	*	*			trans	-43.8	76	175	-46.2	0	0	0	0	116.2
16	A	38.1	Very low	53.4	Low	79 Å²	79	99.6 Å²	99.6	65%	0.653	56%	0.555	S	S	*	*			trans	-127	119.1	168.6	0	0	0	0	0	109.5	T14 S18	T14-A16 PolarHBondContact O-N 3.42Å; A16-S18 VanDerWaalsContact C-N 3.27Å; A16-S18 PolarHBondContact O-N 3.33Å
17	W	43.9	Very low	54.6	Low	164 Å²	164	100 Å²	100	62%	0.621	56%	0.557	S	S	*	*			trans	-76.3	83.3	174.9	-71	67.7	0	0	0	109	F19	W17-F19 WeakPolarHBondContact O-CD2 3.5Å; W17-F19 PolarHBondContact O-N 3.04Å
18	S	58	Low	55.5	Low	89 Å²	89	96 Å²	96	62%	0.622	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-53.1	122.4	174.5	35.8	0	0	0	0	110.2	A16	A16-S18 VanDerWaalsContact C-N 3.27Å; A16-S18 PolarHBondContact O-N 3.33Å
19	F	64.1	Low	56.3	Low	104 Å²	104	94.2 Å²	94.2	46%	0.456	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-82.7	124	175.2	-69	-105.3	0	0	0	108.3	W17 R101 R103	W17-F19 WeakPolarHBondContact O-CD2 3.5Å; W17-F19 PolarHBondContact O-N 3.04Å; F19-R101 VanDerWaalsContact CA-O 3.27Å; F19-R101 WeakPolarHBondContact CA-O 3.46Å; F19-R101 WeakPolarHBondContact CB-O 3.39Å; F19-R101 HydrophobicContact CD1-CB 3.83Å; F19-R101 WeakPolarHBondContact CD1-O 3.48Å; F19-R101 HydrophobicContact CE1-CB 4.04Å; F19-R103 HydrophobicContact CB-CB 3.84Å; F19-R103 HydrophobicContact CD1-CB 4.25Å; F19-R103 HydrophobicContact CG-CB 4.29Å
20	L	67.2	Low	56.6	Low	52 Å²	52	96.2 Å²	96.2	27%	0.272	54%	0.537	S	S	.	.	B	Isolated β-bridge	trans	-70.2	142.6	174.2	-63.2	179.4	0	0	0	110.4	V25 I100 R101 R103	L20-V25 HydrophobicContact CB-CG1 3.6Å; L20-V25 HydrophobicContact CD1-CG1 3.55Å; L20-V25 HydrophobicContact CG-CG1 4.22Å; L20-I100 HydrophobicContact CD1-CD1 4.32Å; L20-I100 HydrophobicContact CD1-CG1 4.45Å; L20-I100 HydrophobicContact CD1-CG2 4.02Å; L20-R101 PolarHBondContact N-O 2.81Å; L20-R103 PolarHBondContact O-N 3.31Å
21	P	68.2	Low	56.9	Low	62 Å²	62	91.1 Å²	91.1	40%	0.403	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-51.7	151.6	165.5	-26.1	35.5	0	0	0	111.7	E23 E24 V25	P21-E23 VanDerWaalsContact C-N 3.34Å; P21-E23 PolarHBondContact O-N 3.43Å; P21-E24 HydrophobicContact CB-CG 4.19Å; P21-E24 HydrophobicContact CG-CG 4.25Å; P21-E24 WeakPolarHBondContact CG-OE1 3.45Å; P21-E24 PolarHBondContact O-N 3.27Å; P21-V25 WeakPolarHBondContact O-CG2 3.45Å
22	E	69.2	Low	57.6	Low	41 Å²	41	90.3 Å²	90.3	19%	0.192	51%	0.507	C	S	.	.	H	α-helix	trans	-67.5	-38.5	-179	-160.8	-172.6	128.6	0	0	112	E24 V25 I26 K87 V102 T104	E22-E24 VanDerWaalsContact C-N 3.27Å; E22-E24 PolarHBondContact O-N 3.45Å; E22-V25 WeakPolarHBondContact O-CG2 3.39Å; E22-V25 PolarHBondContact O-N 3.47Å; E22-I26 HydrophobicContact CG-CB 4.42Å; E22-I26 HydrophobicContact CG-CD1 3.67Å; E22-I26 HydrophobicContact CG-CG1 4.09Å; E22-I26 PolarHBondContact O-N 3.44Å; E22-K87 VanDerWaalsContact OE1-CD 3.25Å; E22-K87 WeakPolarHBondContact OE1-CD 3.27Å; E22-K87 WeakPolarHBondContact OE1-CE 3.28Å; E22-K87 IonicContact OE1-NZ 3.78Å; E22-K87 PolarHBondContact OE1-NZ 2.98Å; E22-K87 WeakPolarHBondContact OE2-CE 3.4Å; E22-K87 IonicContact OE2-NZ 3.14Å; E22-K87 PolarHBondContact OE2-NZ 3.29Å; E22-V102 HydrophobicContact CB-CG1 3.94Å; E22-V102 HydrophobicContact CG-CG1 3.86Å; E22-T104 HydrophobicContact CG-CG2 4.42Å; E22-T104 WeakPolarHBondContact OE2-CG2 3.15Å
23	E	69.8	Low	58.2	Low	155 Å²	155	91.4 Å²	91.4	72%	0.724	50%	0.499	S	S	*	.	H	α-helix	trans	-65.4	-25.2	-179.7	-68.8	146.1	-128.7	0	0	113.4	P21 K78	P21-E23 VanDerWaalsContact C-N 3.34Å; P21-E23 PolarHBondContact O-N 3.43Å; E23-K78 PolarHBondContact O-NZ 2.92Å
24	E	69	Low	58.2	Low	108 Å²	108	92.6 Å²	92.6	51%	0.505	49%	0.494	S	S	.	.	H	α-helix	trans	-75.9	-24.2	176.1	-73.9	-179.5	-162.1	0	0	113.2	P21 E22 K78	P21-E24 HydrophobicContact CB-CG 4.19Å; P21-E24 HydrophobicContact CG-CG 4.25Å; P21-E24 WeakPolarHBondContact CG-OE1 3.45Å; P21-E24 PolarHBondContact O-N 3.27Å; E22-E24 VanDerWaalsContact C-N 3.27Å; E22-E24 PolarHBondContact O-N 3.45Å; E24-K78 WeakPolarHBondContact O-CD 3.43Å
25	V	69.3	Low	58.2	Low	0 Å²	0	92 Å²	92	0%	0	49%	0.486	C	S	.	.	H	α-helix	trans	-122.2	-20.5	-164.8	-55.2	0	0	0	0	114.3	L20 P21 E22 K78 Y79 L94 I100 V102	L20-V25 HydrophobicContact CB-CG1 3.6Å; L20-V25 HydrophobicContact CD1-CG1 3.55Å; L20-V25 HydrophobicContact CG-CG1 4.22Å; P21-V25 WeakPolarHBondContact O-CG2 3.45Å; E22-V25 WeakPolarHBondContact O-CG2 3.39Å; E22-V25 PolarHBondContact O-N 3.47Å; V25-K78 PolarHBondContact O-N 2.93Å; V25-Y79 HydrophobicContact CB-CE2 3.98Å; V25-Y79 HydrophobicContact CG1-CE2 3.95Å; V25-L94 HydrophobicContact CB-CD1 4.11Å; V25-L94 HydrophobicContact CG2-CD1 3.82Å; V25-I100 HydrophobicContact CG1-CG2 4.11Å; V25-V102 HydrophobicContact CG2-CB 4.35Å; V25-V102 HydrophobicContact CG2-CG1 3.74Å; V25-V102 HydrophobicContact CG2-CG2 3.7Å
26	I	74.1	Confident	58.8	Low	8 Å²	8	88.5 Å²	88.5	4%	0.041	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	131.2	170.6	-58.6	-170.7	0	0	0	107.7	E22 S28 F75 K78 K87 L90 I91 L94	E22-I26 HydrophobicContact CG-CB 4.42Å; E22-I26 HydrophobicContact CG-CD1 3.67Å; E22-I26 HydrophobicContact CG-CG1 4.09Å; E22-I26 PolarHBondContact O-N 3.44Å; I26-S28 VanDerWaalsContact CG2-OG 3.24Å; I26-S28 WeakPolarHBondContact CG2-OG 3.49Å; I26-F75 HydrophobicContact CG2-CB 4.48Å; I26-F75 HydrophobicContact CG2-CD1 4.3Å; I26-K78 WeakPolarHBondContact O-CE 3.47Å; I26-K87 HydrophobicContact CD1-CG 4.4Å; I26-L90 HydrophobicContact CB-CD2 4.05Å; I26-L90 HydrophobicContact CD1-CD2 3.93Å; I26-L90 HydrophobicContact CD1-CG 4.46Å; I26-L90 HydrophobicContact CG1-CD2 3.65Å; I26-L90 HydrophobicContact CG1-CG 4.37Å; I26-L90 HydrophobicContact CG2-CD2 3.65Å; I26-I91 HydrophobicContact CD1-CG1 4.05Å; I26-L94 HydrophobicContact CG1-CD1 4.08Å
27	D	69.8	Low	59.1	Low	90 Å²	90	90 Å²	90	48%	0.481	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	137.4	159.8	-162	-2.2	0	0	0	109.5	H76 K78	D27-H76 HydrophobicContact CB-CB 4.2Å; D27-H76 PolarHBondContact N-O 2.87Å; D27-H76 PolarHBondContact O-N 3.47Å; D27-K78 HydrophobicContact CB-CD 4.45Å; D27-K78 HydrophobicContact CB-CG 4.06Å
28	S	68	Low	59	Low	35 Å²	35	88.7 Å²	88.7	25%	0.245	48%	0.483	C	S	.	.			trans	-164.9	126.6	-173	-74.8	0	0	0	0	111.9	I26 Q30 F75	I26-S28 VanDerWaalsContact CG2-OG 3.24Å; I26-S28 WeakPolarHBondContact CG2-OG 3.49Å; S28-Q30 PolarHBondContact O-N 2.96Å; S28-F75 WeakPolarHBondContact OG-CD1 3.48Å
29	P	63.1	Low	58.4	Low	82 Å²	82	88.7 Å²	88.7	53%	0.532	48%	0.483	S	S	.	.			trans	-56.5	124.6	172.8	-26.1	33.7	0	0	0	112.9	N31 L32	P29-N31 VanDerWaalsContact C-N 3.26Å; P29-N31 PolarHBondContact O-N 3.41Å; P29-L32 HydrophobicContact CB-CD1 4.1Å; P29-L32 HydrophobicContact CB-CG 4.24Å; P29-L32 HydrophobicContact CG-CD1 4.25Å
30	Q	54	Low	57.6	Low	181 Å²	181	89.3 Å²	89.3	85%	0.846	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	55.9	-176.9	-65.3	-173	-10.3	0	0	113.8	S28	S28-Q30 PolarHBondContact O-N 2.96Å
31	N	48.5	Very low	56.8	Low	86 Å²	86	92.2 Å²	92.2	46%	0.46	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-160.5	-3.3	163.9	-102	-29.5	0	0	0	117	P29 D33 K34	P29-N31 VanDerWaalsContact C-N 3.26Å; P29-N31 PolarHBondContact O-N 3.41Å; N31-D33 PolarHBondContact O-N 3.23Å; N31-K34 PolarHBondContact O-N 2.87Å; N31-K34 WeakPolarHBondContact OD1-CD 3.17Å
32	L	54.3	Low	56.2	Low	66 Å²	66	95.9 Å²	95.9	35%	0.346	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-3.7	-168	-67.4	162.1	0	0	0	118.9	P29 P74	P29-L32 HydrophobicContact CB-CD1 4.1Å; P29-L32 HydrophobicContact CB-CG 4.24Å; P29-L32 HydrophobicContact CG-CD1 4.25Å; L32-P74 HydrophobicContact CD1-CB 3.3Å; L32-P74 HydrophobicContact CD1-CG 3.95Å; L32-P74 HydrophobicContact CD2-CB 4.45Å; L32-P74 HydrophobicContact CD2-CG 4.42Å
33	D	51.9	Low	55.5	Low	125 Å²	125	97.2 Å²	97.2	67%	0.668	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	6.2	174.3	-68.8	-42.7	0	0	0	112.8	N31 R67	N31-D33 PolarHBondContact O-N 3.23Å; D33-R67 IonicContact OD1-CZ 2.69Å; D33-R67 IonicContact OD1-NH1 2.9Å; D33-R67 PolarHBondContact OD1-NH1 2.9Å; D33-R67 IonicContact OD1-NH2 2.68Å; D33-R67 PolarHBondContact OD1-NH2 3.38Å
34	K	47.7	Very low	54.9	Low	142 Å²	142	94.5 Å²	94.5	62%	0.617	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-47.1	171.2	-69	-170.8	-171.9	164.9	0	112.9	N31 A36 T37	N31-K34 PolarHBondContact O-N 2.87Å; N31-K34 WeakPolarHBondContact OD1-CD 3.17Å; K34-A36 PolarHBondContact O-N 3.09Å; K34-T37 PolarHBondContact O-N 3.24Å; K34-T37 PolarHBondContact O-OG1 2.97Å; K34-T37 VanDerWaalsContact O-OG1 3.09Å
35	D	39.5	Very low	54.3	Low	119 Å²	119	96.2 Å²	96.2	64%	0.636	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	2.1	-175.3	-46.3	-49.2	0	0	0	113.9	T37	D35-T37 VanDerWaalsContact C-N 3.3Å
36	A	47.8	Very low	54.2	Low	71 Å²	71	96.9 Å²	96.9	59%	0.587	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-2.5	168.9	0	0	0	0	0	113.7	K34	K34-A36 PolarHBondContact O-N 3.09Å
37	T	44.2	Very low	54.4	Low	110 Å²	110	101.3 Å²	101.3	68%	0.675	58%	0.58	S	S	*	*	S	Bend	trans	-88.1	119	171.5	58.1	0	0	0	0	111.2	K34 D35	K34-T37 PolarHBondContact O-N 3.24Å; K34-T37 PolarHBondContact O-OG1 2.97Å; K34-T37 VanDerWaalsContact O-OG1 3.09Å; D35-T37 VanDerWaalsContact C-N 3.3Å
38	V	41.3	Very low	55	Low	136 Å²	136	101 Å²	101	82%	0.824	58%	0.578	S	S	*	*			trans	67.5	66.4	169.8	-159.4	0	0	0	0	115.3
39	S	46.3	Very low	55.8	Low	90 Å²	90	99.4 Å²	99.4	63%	0.629	57%	0.567	S	S	*	*			trans	-88.5	126.9	141.5	-51.3	0	0	0	0	108	D41	S39-D41 VanDerWaalsContact C-N 3.32Å; S39-D41 PolarHBondContact O-N 3.44Å
40	S	46.7	Very low	56.7	Low	116 Å²	116	100.2 Å²	100.2	81%	0.811	57%	0.574	S	S	*	*			trans	-87.5	50.5	-161.4	55.1	0	0	0	0	114.9
41	D	50.2	Low	58.1	Low	113 Å²	113	96.3 Å²	96.3	60%	0.604	56%	0.562	S	S	*	*			trans	-94.4	132.6	174	-68.4	-51.9	0	0	0	111.4	S39 D43 V44	S39-D41 VanDerWaalsContact C-N 3.32Å; S39-D41 PolarHBondContact O-N 3.44Å; D41-D43 PolarHBondContact O-N 2.92Å; D41-V44 WeakPolarHBondContact O-CG2 3.4Å
42	P	54.5	Low	59.8	Low	139 Å²	139	95.5 Å²	95.5	90%	0.903	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	0.2	-171.2	25.7	-34.3	0	0	0	116.7
43	D	55.2	Low	61.2	Low	70 Å²	70	95 Å²	95	37%	0.374	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.8	25.3	-179.7	-173.9	41.7	0	0	0	113.6	D41 N45 G46	D41-D43 PolarHBondContact O-N 2.92Å; D43-N45 VanDerWaalsContact C-N 3.27Å; D43-N45 PolarHBondContact O-N 3.17Å; D43-G46 PolarHBondContact O-N 3.5Å; D43-G46 WeakPolarHBondContact OD1-CA 3.42Å
44	V	56.9	Low	62.7	Low	97 Å²	97	93.2 Å²	93.2	59%	0.588	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-30.3	-178.6	-166.2	0	0	0	0	112.7	D41 G46	D41-V44 WeakPolarHBondContact O-CG2 3.4Å; V44-G46 VanDerWaalsContact C-N 3.25Å; V44-G46 PolarHBondContact O-N 3.48Å
45	N	56.5	Low	64.5	Low	145 Å²	145	92.6 Å²	92.6	78%	0.775	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-4.8	174.6	-80.9	-16.2	0	0	0	113.5	D43 K47	D43-N45 VanDerWaalsContact C-N 3.27Å; D43-N45 PolarHBondContact O-N 3.17Å; N45-K47 PolarHBondContact O-N 3.18Å
46	G	68	Low	66.5	Low	14 Å²	14	87 Å²	87	14%	0.144	53%	0.528	C	S	.	.			trans	-62.2	117	178.1	0	0	0	0	0	112.6	D43 V44 I48	D43-G46 PolarHBondContact O-N 3.5Å; D43-G46 WeakPolarHBondContact OD1-CA 3.42Å; V44-G46 VanDerWaalsContact C-N 3.25Å; V44-G46 PolarHBondContact O-N 3.48Å; G46-I48 PolarHBondContact O-N 2.81Å
47	K	78	Confident	68.2	Low	100 Å²	100	90.3 Å²	90.3	44%	0.435	53%	0.529	S	S	.	.	S	Bend	trans	-73	-2.9	162.5	-71.7	-164.6	-177.4	-166.9	0	112.8	N45 Q55 G56 K57 M62	N45-K47 PolarHBondContact O-N 3.18Å; K47-Q55 HydrophobicContact CB-CG 4.18Å; K47-Q55 CarbonylContact O-C 3.51Å; K47-Q55 VanDerWaalsContact O-CA 3.28Å; K47-Q55 WeakPolarHBondContact O-CA 3.46Å; K47-Q55 WeakPolarHBondContact O-CG 3.19Å; K47-G56 PolarHBondContact O-N 3.27Å; K47-K57 PolarHBondContact NZ-O 3.46Å; K47-M62 VanDerWaalsContact O-CE 3.31Å; K47-M62 WeakPolarHBondContact O-CE 3.46Å
48	I	82.3	Confident	70.1	Confident	85 Å²	85	92.3 Å²	92.3	44%	0.436	52%	0.524	S	S	.	.	B	Isolated β-bridge	trans	-111.5	148	-172.9	-58.7	170.7	0	0	0	108.9	G46 Y54 Q55 M62	G46-I48 PolarHBondContact O-N 2.81Å; I48-Y54 CarbonylContact C-O 3.37Å; I48-Y54 WeakPolarHBondContact CA-O 3.49Å; I48-Q55 HydrophobicContact CG1-CB 4.3Å; I48-Q55 HydrophobicContact CG1-CG 3.94Å; I48-M62 VanDerWaalsContact C-CE 3.48Å
49	C	84.8	Confident	72.2	Confident	1 Å²	1	89.3 Å²	89.3	1%	0.007	50%	0.503	C	S	.	.			trans	-95.9	116.2	174	-171.8	0	0	0	0	111.1	V51 C52 G53 Y54 M62 H65 H69	C49-V51 PolarHBondContact O-N 2.78Å; C49-V51 VanDerWaalsContact O-N 3.12Å; C49-C52 PolarHBondContact O-N 3.19Å; C49-C52 VanDerWaalsContact O-N 3.16Å; C49-G53 WeakPolarHBondContact O-CA 3.31Å; C49-G53 PolarHBondContact O-N 3.38Å; C49-Y54 PolarHBondContact N-O 2.78Å; C49-M62 HydrophobicContact CB-CE 3.79Å; C49-M62 HydrophobicContact CB-SD 3.62Å; C49-H65 VanDerWaalsContact SG-CD2 3.58Å; C49-H69 VanDerWaalsContact SG-CD2 3.54Å; C49-H69 PolarHBondContact SG-NE2 3.34Å
50	S	82.2	Confident	74	Confident	98 Å²	98	89.1 Å²	89.1	69%	0.685	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-34	175.4	53.1	0	0	0	0	114.6
51	V	84	Confident	75.8	Confident	99 Å²	99	85.9 Å²	85.9	60%	0.6	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-22.3	-176	-176.5	0	0	0	0	113.6	C49 H69	C49-V51 PolarHBondContact O-N 2.78Å; C49-V51 VanDerWaalsContact O-N 3.12Å; V51-H69 HydrophobicContact CG1-CB 4.48Å
52	C	84.3	Confident	77.5	Confident	69 Å²	69	80.7 Å²	80.7	47%	0.466	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.4	3.4	-171.2	71.4	0	0	0	0	116.6	C49 Y54 H65	C49-C52 PolarHBondContact O-N 3.19Å; C49-C52 VanDerWaalsContact O-N 3.16Å; C52-Y54 PolarHBondContact O-N 3.47Å; C52-Y54 VanDerWaalsContact O-N 3.15Å; C52-Y54 VanDerWaalsContact SG-CB 3.58Å; C52-H65 PolarHBondContact SG-NE2 3.01Å
53	G	83.9	Confident	78.8	Confident	55 Å²	55	78.1 Å²	78.1	57%	0.567	42%	0.423	S	S	*	.			trans	68.3	4.8	-178.8	0	0	0	0	0	115.6	C49 Q55	C49-G53 WeakPolarHBondContact O-CA 3.31Å; C49-G53 PolarHBondContact O-N 3.38Å; G53-Q55 PolarHBondContact O-N 3.4Å
54	Y	82.7	Confident	80.1	Confident	89 Å²	89	80.6 Å²	80.6	35%	0.349	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-63.3	131.2	176.4	171.6	-101.6	0	0	0	110.7	I48 C49 C52 M62 H65	I48-Y54 CarbonylContact C-O 3.37Å; I48-Y54 WeakPolarHBondContact CA-O 3.49Å; C49-Y54 PolarHBondContact N-O 2.78Å; C52-Y54 PolarHBondContact O-N 3.47Å; C52-Y54 VanDerWaalsContact O-N 3.15Å; C52-Y54 VanDerWaalsContact SG-CB 3.58Å; Y54-M62 HydrophobicContact CD1-CE 3.89Å; Y54-M62 HydrophobicContact CE1-CE 4.39Å; Y54-M62 WeakPolarHBondContact O-CE 3.24Å; Y54-H65 VanDerWaalsContact CB-CE1 3.5Å; Y54-H65 WeakPolarHBondContact CB-CE1 3.31Å; Y54-H65 HydrophobicContact CD1-CB 4.01Å; Y54-H65 AromaticContact CD1-CD2 3.93Å; Y54-H65 AromaticContact CD1-CE1 3.45Å; Y54-H65 VanDerWaalsContact CD1-CE1 3.45Å; Y54-H65 WeakPolarHBondContact CD1-CE1 3.27Å; Y54-H65 AromaticContact CD1-CG 3.39Å; Y54-H65 AromaticContact CD1-ND1 3.06Å; Y54-H65 WeakPolarHBondContact CD1-ND1 3.5Å; Y54-H65 AromaticContact CD1-NE2 3.97Å; Y54-H65 HydrophobicContact CE1-CB 4.01Å; Y54-H65 AromaticContact CE1-CG 3.84Å; Y54-H65 AromaticContact CE1-ND1 3.52Å; Y54-H65 AromaticContact CG-CE1 3.54Å; Y54-H65 AromaticContact CG-ND1 3.6Å
55	Q	85.5	Confident	81.4	Confident	129 Å²	129	77.4 Å²	77.4	60%	0.603	41%	0.406	S	S	*	.	B	Isolated β-bridge	trans	-103	121	174.7	-164.1	178.6	33.4	0	0	110.6	K47 I48 G53	K47-Q55 HydrophobicContact CB-CG 4.18Å; K47-Q55 CarbonylContact O-C 3.51Å; K47-Q55 VanDerWaalsContact O-CA 3.28Å; K47-Q55 WeakPolarHBondContact O-CA 3.46Å; K47-Q55 WeakPolarHBondContact O-CG 3.19Å; I48-Q55 HydrophobicContact CG1-CB 4.3Å; I48-Q55 HydrophobicContact CG1-CG 3.94Å; G53-Q55 PolarHBondContact O-N 3.4Å
56	G	81.4	Confident	82.6	Confident	2 Å²	2	74.5 Å²	74.5	2%	0.021	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-86.5	148.3	171.6	0	0	0	0	0	111.1	K47 W58	K47-G56 PolarHBondContact O-N 3.27Å; G56-W58 PolarHBondContact O-N 3.34Å
57	K	83.8	Confident	83.2	Confident	139 Å²	139	77.4 Å²	77.4	60%	0.604	39%	0.393	S	S	*	.	S	Bend	trans	-66.1	-31.4	177.3	-174.4	172.3	178	174.8	0	111.8	K47 E61	K47-K57 PolarHBondContact NZ-O 3.46Å; K57-E61 PolarHBondContact N-OE2 2.83Å
58	W	84.6	Confident	83.5	Confident	152 Å²	152	75.4 Å²	75.4	58%	0.576	39%	0.389	S	S	*	.	S	Bend	trans	-134	154.3	-174.3	-48.9	105.7	0	0	0	111.2	G56 S60 E61 M62	G56-W58 PolarHBondContact O-N 3.34Å; W58-S60 VanDerWaalsContact C-N 3.26Å; W58-S60 PolarHBondContact O-N 3.5Å; W58-E61 WeakPolarHBondContact O-CA 3.29Å; W58-E61 WeakPolarHBondContact O-CB 3.29Å; W58-E61 PolarHBondContact O-N 2.96Å; W58-M62 PolarHBondContact O-N 3.31Å; W58-M62 VanDerWaalsContact O-N 3.07Å
59	I	84.6	Confident	83.5	Confident	74 Å²	74	74.4 Å²	74.4	38%	0.379	38%	0.382	S	S	.	.	H	α-helix	trans	-60.2	-37.2	177.1	-59.1	173.6	0	0	0	111	E61 M62 I63	I59-E61 VanDerWaalsContact C-N 3.27Å; I59-E61 PolarHBondContact O-N 2.95Å; I59-M62 CarbonylContact O-C 3.53Å; I59-M62 WeakPolarHBondContact O-CA 3.34Å; I59-M62 WeakPolarHBondContact O-CB 3.31Å; I59-M62 PolarHBondContact O-N 2.97Å; I59-I63 HydrophobicContact CG2-CD1 3.95Å; I59-I63 HydrophobicContact CG2-CG1 4.32Å; I59-I63 WeakPolarHBondContact O-CG1 3.33Å; I59-I63 PolarHBondContact O-N 2.93Å
60	S	83.6	Confident	83.1	Confident	86 Å²	86	77.9 Å²	77.9	60%	0.601	40%	0.404	S	S	*	.	H	α-helix	trans	-62.5	-30.4	174.1	55.5	0	0	0	0	113.7	W58 R64	W58-S60 VanDerWaalsContact C-N 3.26Å; W58-S60 PolarHBondContact O-N 3.5Å; S60-R64 WeakPolarHBondContact O-CB 3.48Å; S60-R64 PolarHBondContact O-N 3.49Å; S60-R64 VanDerWaalsContact O-N 3.14Å
61	E	84.5	Confident	82.7	Confident	48 Å²	48	78.6 Å²	78.6	22%	0.224	40%	0.4	C	S	.	.	H	α-helix	trans	-74.4	-35.9	171.4	178.6	158.3	-115.2	0	0	111.7	K57 W58 I59 R64 H65	K57-E61 PolarHBondContact N-OE2 2.83Å; W58-E61 WeakPolarHBondContact O-CA 3.29Å; W58-E61 WeakPolarHBondContact O-CB 3.29Å; W58-E61 PolarHBondContact O-N 2.96Å; I59-E61 VanDerWaalsContact C-N 3.27Å; I59-E61 PolarHBondContact O-N 2.95Å; E61-R64 PolarHBondContact O-N 2.81Å; E61-R64 IonicContact OE1-NH2 2.78Å; E61-R64 PolarHBondContact OE1-NH2 2.92Å; E61-H65 WeakPolarHBondContact O-CB 3.29Å; E61-H65 PolarHBondContact O-N 3.35Å
62	M	86.1	Confident	82.5	Confident	4 Å²	4	79.3 Å²	79.3	2%	0.02	40%	0.397	C	S	.	.	H	α-helix	trans	-66.6	-44.1	173.5	-176.7	43.4	58.6	0	0	112.4	K47 I48 C49 Y54 W58 I59 R64 H65 K66	K47-M62 VanDerWaalsContact O-CE 3.31Å; K47-M62 WeakPolarHBondContact O-CE 3.46Å; I48-M62 VanDerWaalsContact C-CE 3.48Å; C49-M62 HydrophobicContact CB-CE 3.79Å; C49-M62 HydrophobicContact CB-SD 3.62Å; Y54-M62 HydrophobicContact CD1-CE 3.89Å; Y54-M62 HydrophobicContact CE1-CE 4.39Å; Y54-M62 WeakPolarHBondContact O-CE 3.24Å; W58-M62 PolarHBondContact O-N 3.31Å; W58-M62 VanDerWaalsContact O-N 3.07Å; I59-M62 CarbonylContact O-C 3.53Å; I59-M62 WeakPolarHBondContact O-CA 3.34Å; I59-M62 WeakPolarHBondContact O-CB 3.31Å; I59-M62 PolarHBondContact O-N 2.97Å; M62-R64 VanDerWaalsContact C-N 3.32Å; M62-R64 PolarHBondContact O-N 2.77Å; M62-H65 HydrophobicContact CE-CB 4.5Å; M62-H65 CarbonylContact O-C 3.58Å; M62-H65 WeakPolarHBondContact O-CA 3.22Å; M62-H65 WeakPolarHBondContact O-CB 3.27Å; M62-H65 PolarHBondContact O-N 3.13Å; M62-H65 HydrophobicContact SD-CB 4.22Å; M62-K66 PolarHBondContact O-N 3.32Å; M62-K66 HydrophobicContact SD-CG 4.24Å
63	I	82.9	Confident	82.4	Confident	84 Å²	84	81.4 Å²	81.4	43%	0.431	40%	0.395	S	S	.	.	H	α-helix	trans	-59.6	-43.1	173.7	-67	165.7	0	0	0	110.7	I59 H65 K66	I59-I63 HydrophobicContact CG2-CD1 3.95Å; I59-I63 HydrophobicContact CG2-CG1 4.32Å; I59-I63 WeakPolarHBondContact O-CG1 3.33Å; I59-I63 PolarHBondContact O-N 2.93Å; I63-H65 VanDerWaalsContact C-N 3.28Å; I63-H65 PolarHBondContact O-N 2.94Å; I63-K66 PolarHBondContact O-N 2.7Å
64	R	82.4	Confident	82.3	Confident	123 Å²	123	80 Å²	80	46%	0.464	38%	0.376	S	S	.	.	H	α-helix	trans	-63.7	-33.3	172.8	-175.2	-176.8	65.6	141.3	-5.1	112.3	S60 E61 M62 W86	S60-R64 WeakPolarHBondContact O-CB 3.48Å; S60-R64 PolarHBondContact O-N 3.49Å; S60-R64 VanDerWaalsContact O-N 3.14Å; E61-R64 PolarHBondContact O-N 2.81Å; E61-R64 IonicContact OE1-NH2 2.78Å; E61-R64 PolarHBondContact OE1-NH2 2.92Å; M62-R64 VanDerWaalsContact C-N 3.32Å; M62-R64 PolarHBondContact O-N 2.77Å; R64-W86 HydrophobicContact CG-CZ2 4.28Å
65	H	83.3	Confident	82.5	Confident	30 Å²	30	77 Å²	77	14%	0.139	37%	0.365	C	S	.	.	H	α-helix	trans	-72.4	-38.7	176.1	-178.4	94.1	0	0	0	112.5	C49 C52 Y54 E61 M62 I63 R67 V68 H69	C49-H65 VanDerWaalsContact SG-CD2 3.58Å; C52-H65 PolarHBondContact SG-NE2 3.01Å; Y54-H65 VanDerWaalsContact CB-CE1 3.5Å; Y54-H65 WeakPolarHBondContact CB-CE1 3.31Å; Y54-H65 HydrophobicContact CD1-CB 4.01Å; Y54-H65 AromaticContact CD1-CD2 3.93Å; Y54-H65 AromaticContact CD1-CE1 3.45Å; Y54-H65 VanDerWaalsContact CD1-CE1 3.45Å; Y54-H65 WeakPolarHBondContact CD1-CE1 3.27Å; Y54-H65 AromaticContact CD1-CG 3.39Å; Y54-H65 AromaticContact CD1-ND1 3.06Å; Y54-H65 WeakPolarHBondContact CD1-ND1 3.5Å; Y54-H65 AromaticContact CD1-NE2 3.97Å; Y54-H65 HydrophobicContact CE1-CB 4.01Å; Y54-H65 AromaticContact CE1-CG 3.84Å; Y54-H65 AromaticContact CE1-ND1 3.52Å; Y54-H65 AromaticContact CG-CE1 3.54Å; Y54-H65 AromaticContact CG-ND1 3.6Å; E61-H65 WeakPolarHBondContact O-CB 3.29Å; E61-H65 PolarHBondContact O-N 3.35Å; M62-H65 HydrophobicContact CE-CB 4.5Å; M62-H65 CarbonylContact O-C 3.58Å; M62-H65 WeakPolarHBondContact O-CA 3.22Å; M62-H65 WeakPolarHBondContact O-CB 3.27Å; M62-H65 PolarHBondContact O-N 3.13Å; M62-H65 HydrophobicContact SD-CB 4.22Å; I63-H65 VanDerWaalsContact C-N 3.28Å; I63-H65 PolarHBondContact O-N 2.94Å; H65-R67 VanDerWaalsContact C-N 3.25Å; H65-R67 PolarHBondContact O-N 3.16Å; H65-V68 WeakPolarHBondContact O-CA 3.44Å; H65-V68 WeakPolarHBondContact O-CB 3.02Å; H65-V68 WeakPolarHBondContact O-CG2 3.42Å; H65-V68 PolarHBondContact O-N 3.22Å; H65-H69 AromaticContact CD2-NE2 3.57Å; H65-H69 AromaticContact NE2-CE1 3.73Å; H65-H69 AromaticContact NE2-NE2 3.04Å; H65-H69 PolarHBondContact NE2-NE2 3.32Å
66	K	81.4	Confident	82.5	Confident	83 Å²	83	75 Å²	75	36%	0.361	36%	0.355	S	S	.	.	H	α-helix	trans	-57.6	-36.8	177.2	-71.7	-172.1	177.3	-174.6	0	111.7	M62 I63 V68 H69	M62-K66 PolarHBondContact O-N 3.32Å; M62-K66 HydrophobicContact SD-CG 4.24Å; I63-K66 PolarHBondContact O-N 2.7Å; K66-V68 PolarHBondContact O-N 3.39Å; K66-V68 VanDerWaalsContact O-N 3.08Å; K66-H69 PolarHBondContact O-N 3.39Å
67	R	81.8	Confident	82.8	Confident	75 Å²	75	75.4 Å²	75.4	28%	0.283	36%	0.358	S	S	.	.	H	α-helix	trans	-62.9	-9	170.1	-61.9	-166.4	-131.6	-160.5	2.7	114.8	D33 H65 K85	D33-R67 IonicContact OD1-CZ 2.69Å; D33-R67 IonicContact OD1-NH1 2.9Å; D33-R67 PolarHBondContact OD1-NH1 2.9Å; D33-R67 IonicContact OD1-NH2 2.68Å; D33-R67 PolarHBondContact OD1-NH2 3.38Å; H65-R67 VanDerWaalsContact C-N 3.25Å; H65-R67 PolarHBondContact O-N 3.16Å; R67-K85 PolarHBondContact O-NZ 3.3Å
68	V	82.7	Confident	83	Confident	59 Å²	59	73.8 Å²	73.8	36%	0.358	35%	0.35	S	S	.	.	H	α-helix	trans	-73.7	-30.8	169.7	-177.3	0	0	0	0	110.8	H65 K66 K85 W86	H65-V68 WeakPolarHBondContact O-CA 3.44Å; H65-V68 WeakPolarHBondContact O-CB 3.02Å; H65-V68 WeakPolarHBondContact O-CG2 3.42Å; H65-V68 PolarHBondContact O-N 3.22Å; K66-V68 PolarHBondContact O-N 3.39Å; K66-V68 VanDerWaalsContact O-N 3.08Å; V68-K85 PolarHBondContact O-NZ 2.72Å; V68-W86 HydrophobicContact CG2-CZ2 4.26Å
69	H	82.3	Confident	83	Confident	63 Å²	63	71.6 Å²	71.6	29%	0.292	34%	0.343	S	S	.	.	H	α-helix	trans	-85.4	-40.7	-178.4	-58.5	-53.7	0	0	0	113.2	C49 V51 H65 K66 N71	C49-H69 VanDerWaalsContact SG-CD2 3.54Å; C49-H69 PolarHBondContact SG-NE2 3.34Å; V51-H69 HydrophobicContact CG1-CB 4.48Å; H65-H69 AromaticContact CD2-NE2 3.57Å; H65-H69 AromaticContact NE2-CE1 3.73Å; H65-H69 AromaticContact NE2-NE2 3.04Å; H65-H69 PolarHBondContact NE2-NE2 3.32Å; K66-H69 PolarHBondContact O-N 3.39Å; H69-N71 PolarHBondContact O-N 3.07Å; H69-N71 PolarHBondContact O-ND2 3.39Å
70	T	77.8	Confident	83.1	Confident	74 Å²	74	70.5 Å²	70.5	45%	0.454	34%	0.341	S	S	.	.	S	Bend	trans	-61.3	-15.4	-177.6	64.9	0	0	0	0	114.6	E72	T70-E72 WeakPolarHBondContact CB-OE2 3.21Å; T70-E72 PolarHBondContact O-N 3.04Å; T70-E72 PolarHBondContact OG1-OE2 3.39Å
71	N	73.2	Confident	83.2	Confident	114 Å²	114	76 Å²	76	61%	0.61	36%	0.357	S	S	*	.			trans	60.3	-9.7	176.4	-79.6	-41	0	0	0	119	H69 K85	H69-N71 PolarHBondContact O-N 3.07Å; H69-N71 PolarHBondContact O-ND2 3.39Å; N71-K85 PolarHBondContact OD1-NZ 3.43Å
72	E	80.2	Confident	83.3	Confident	114 Å²	114	79.7 Å²	79.7	53%	0.533	37%	0.369	S	S	.	.			trans	-42.9	144.3	164.8	-62.6	151.2	160.1	0	0	112.6	T70 P74 K85	T70-E72 WeakPolarHBondContact CB-OE2 3.21Å; T70-E72 PolarHBondContact O-N 3.04Å; T70-E72 PolarHBondContact OG1-OE2 3.39Å; E72-P74 HydrophobicContact CB-CG 4.31Å; E72-K85 WeakPolarHBondContact O-CG 3.25Å
73	R	82.8	Confident	83.3	Confident	113 Å²	113	80.7 Å²	80.7	43%	0.426	38%	0.377	S	S	.	.			trans	-135.4	70.2	175.9	-69.7	179.9	-177.7	169.9	7.1	109.7	F75 H76 S83 S84 K85	R73-F75 PolarHBondContact O-N 3.46Å; R73-F75 VanDerWaalsContact O-N 3.14Å; R73-H76 PolarHBondContact O-CE1 3.26Å; R73-S83 WeakPolarHBondContact CB-OG 3.37Å; R73-S83 WeakPolarHBondContact CD-OG 3.38Å; R73-S83 WeakPolarHBondContact O-CB 3.46Å; R73-S84 CarbonylContact C-O 3.58Å; R73-S84 VanDerWaalsContact C-O 3.25Å; R73-S84 WeakPolarHBondContact CA-O 2.92Å; R73-K85 HydrophobicContact CG-CG 3.93Å
74	P	81.6	Confident	83.5	Confident	26 Å²	26	77.1 Å²	77.1	17%	0.169	36%	0.359	C	S	.	.			trans	-69.1	-21	-163	-19	32.2	0	0	0	114.2	L32 E72 H76	L32-P74 HydrophobicContact CD1-CB 3.3Å; L32-P74 HydrophobicContact CD1-CG 3.95Å; L32-P74 HydrophobicContact CD2-CB 4.45Å; L32-P74 HydrophobicContact CD2-CG 4.42Å; E72-P74 HydrophobicContact CB-CG 4.31Å; P74-H76 PolarHBondContact O-N 2.83Å; P74-H76 PolarHBondContact O-ND1 3.15Å
75	F	85.3	Confident	83.5	Confident	26 Å²	26	73 Å²	73	11%	0.114	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	108.5	-179.9	-53.4	-80.5	0	0	0	110	I26 S28 R73 S83 S84 K85 K87 L90	I26-F75 HydrophobicContact CG2-CB 4.48Å; I26-F75 HydrophobicContact CG2-CD1 4.3Å; S28-F75 WeakPolarHBondContact OG-CD1 3.48Å; R73-F75 PolarHBondContact O-N 3.46Å; R73-F75 VanDerWaalsContact O-N 3.14Å; F75-S83 CarbonylContact O-C 3.6Å; F75-S83 WeakPolarHBondContact O-CA 3.49Å; F75-S84 PolarHBondContact N-O 2.93Å; F75-S84 PolarHBondContact O-N 3.03Å; F75-K85 WeakPolarHBondContact CE2-O 3.49Å; F75-K87 HydrophobicContact CD1-CB 3.83Å; F75-K87 VanDerWaalsContact CD2-N 3.34Å; F75-K87 HydrophobicContact CE1-CB 3.71Å; F75-K87 HydrophobicContact CE1-CD 4.15Å; F75-K87 HydrophobicContact CE1-CG 4.43Å; F75-K87 HydrophobicContact CE2-CB 4.39Å; F75-K87 HydrophobicContact CG-CB 4.25Å; F75-K87 HydrophobicContact CZ-CB 4Å; F75-L90 HydrophobicContact CB-CB 4.32Å; F75-L90 HydrophobicContact CB-CD2 3.77Å
76	H	86.5	Confident	83.6	Confident	87 Å²	87	75.9 Å²	75.9	40%	0.403	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	139	-177.5	-66	79.1	0	0	0	111.8	D27 R73 P74 L90	D27-H76 HydrophobicContact CB-CB 4.2Å; D27-H76 PolarHBondContact N-O 2.87Å; D27-H76 PolarHBondContact O-N 3.47Å; R73-H76 PolarHBondContact O-CE1 3.26Å; P74-H76 PolarHBondContact O-N 2.83Å; P74-H76 PolarHBondContact O-ND1 3.15Å; H76-L90 WeakPolarHBondContact O-CD2 3.19Å
77	C	88.3	Confident	83.7	Confident	10 Å²	10	76 Å²	76	7%	0.068	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	124.3	172.5	-168.7	0	0	0	0	110.2	Y79 R82 L90 H93 L94	C77-Y79 PolarHBondContact O-N 3.19Å; C77-Y79 VanDerWaalsContact O-N 3.16Å; C77-R82 HydrophobicContact CB-CB 4.4Å; C77-R82 WeakPolarHBondContact CB-O 3.47Å; C77-R82 PolarHBondContact N-O 3.34Å; C77-R82 VanDerWaalsContact N-O 3.11Å; C77-L90 HydrophobicContact CB-CD1 3.81Å; C77-H93 PolarHBondContact SG-NE2 3.02Å; C77-L94 VanDerWaalsContact SG-CD2 3.58Å
78	K	86.2	Confident	83.9	Confident	105 Å²	105	74.5 Å²	74.5	46%	0.457	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-7.6	175.2	-73	177.8	169.5	-178	0	114.1	E23 E24 V25 I26 D27	E23-K78 PolarHBondContact O-NZ 2.92Å; E24-K78 WeakPolarHBondContact O-CD 3.43Å; V25-K78 PolarHBondContact O-N 2.93Å; I26-K78 WeakPolarHBondContact O-CE 3.47Å; D27-K78 HydrophobicContact CB-CD 4.45Å; D27-K78 HydrophobicContact CB-CG 4.06Å
79	Y	85.2	Confident	84.1	Confident	106 Å²	106	74.2 Å²	74.2	42%	0.416	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-5.1	-176	-54.9	-80.6	0	0	0	115	V25 C77 L94 H98 I100	V25-Y79 HydrophobicContact CB-CE2 3.98Å; V25-Y79 HydrophobicContact CG1-CE2 3.95Å; C77-Y79 PolarHBondContact O-N 3.19Å; C77-Y79 VanDerWaalsContact O-N 3.16Å; Y79-L94 HydrophobicContact CD2-CD2 3.83Å; Y79-L94 HydrophobicContact CE2-CD2 4.22Å; Y79-H98 WeakPolarHBondContact CB-CE1 3.41Å; Y79-H98 WeakPolarHBondContact CB-ND1 3.37Å; Y79-H98 PolarHBondContact O-CE1 3.35Å; Y79-I100 HydrophobicContact CD2-CD1 3.68Å; Y79-I100 HydrophobicContact CE1-CD1 4.17Å; Y79-I100 HydrophobicContact CE2-CD1 3.24Å; Y79-I100 HydrophobicContact CG-CD1 4.3Å
80	C	86.8	Confident	84.4	Confident	50 Å²	50	71.2 Å²	71.2	34%	0.338	34%	0.341	S	S	.	.	S	Bend	trans	-164.4	168.1	170.1	68.4	0	0	0	0	111.4	R82 H93 H98	C80-R82 PolarHBondContact O-N 3.11Å; C80-R82 VanDerWaalsContact SG-CB 3.55Å; C80-H93 PolarHBondContact SG-CE1 3.06Å; C80-H93 PolarHBondContact SG-NE2 2.6Å; C80-H93 VanDerWaalsContact SG-NE2 3.41Å; C80-H98 PolarHBondContact SG-NE2 3.03Å
81	Q	85.5	Confident	84.8	Confident	203 Å²	203	68.5 Å²	68.5	95%	0.949	32%	0.323	S	S	*	.	S	Bend	trans	-69.8	35.5	179.2	-60.2	-66.3	2	0	0	114.5
82	R	86.1	Confident	85.5	Confident	125 Å²	125	69.1 Å²	69.1	47%	0.472	32%	0.317	S	S	.	.			trans	-102.9	100.8	179.7	-173	62	-173.4	-166.6	3.5	112.1	C77 C80	C77-R82 HydrophobicContact CB-CB 4.4Å; C77-R82 WeakPolarHBondContact CB-O 3.47Å; C77-R82 PolarHBondContact N-O 3.34Å; C77-R82 VanDerWaalsContact N-O 3.11Å; C80-R82 PolarHBondContact O-N 3.11Å; C80-R82 VanDerWaalsContact SG-CB 3.55Å
83	S	87.7	Confident	85.9	Confident	25 Å²	25	65 Å²	65	18%	0.175	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	152.1	164.9	63	0	0	0	0	112.3	R73 F75	R73-S83 WeakPolarHBondContact CB-OG 3.37Å; R73-S83 WeakPolarHBondContact CD-OG 3.38Å; R73-S83 WeakPolarHBondContact O-CB 3.46Å; F75-S83 CarbonylContact O-C 3.6Å; F75-S83 WeakPolarHBondContact O-CA 3.49Å
84	S	85.6	Confident	86.2	Confident	9 Å²	9	59.6 Å²	59.6	6%	0.063	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	148.1	179.6	-61.5	0	0	0	0	112.4	R73 F75 W86	R73-S84 CarbonylContact C-O 3.58Å; R73-S84 VanDerWaalsContact C-O 3.25Å; R73-S84 WeakPolarHBondContact CA-O 2.92Å; F75-S84 PolarHBondContact N-O 2.93Å; F75-S84 PolarHBondContact O-N 3.03Å; S84-W86 VanDerWaalsContact C-N 3.3Å; S84-W86 PolarHBondContact O-N 3.14Å
85	K	83.9	Confident	86.5	Confident	36 Å²	36	61 Å²	61	16%	0.157	29%	0.291	C	S	.	.	S	Bend	trans	-69.8	-26.2	176	-61.7	-151.5	171.5	-170.9	0	113.5	R67 V68 N71 E72 R73 F75	R67-K85 PolarHBondContact O-NZ 3.3Å; V68-K85 PolarHBondContact O-NZ 2.72Å; N71-K85 PolarHBondContact OD1-NZ 3.43Å; E72-K85 WeakPolarHBondContact O-CG 3.25Å; R73-K85 HydrophobicContact CG-CG 3.93Å; F75-K85 WeakPolarHBondContact CE2-O 3.49Å
86	W	84.1	Confident	86.7	Confident	90 Å²	90	67.5 Å²	67.5	34%	0.341	32%	0.319	S	S	.	.	S	Bend	trans	-135.5	132.1	-176.4	-56.6	-52.6	0	0	0	111.9	R64 V68 S84 A88 D89 L90	R64-W86 HydrophobicContact CG-CZ2 4.28Å; V68-W86 HydrophobicContact CG2-CZ2 4.26Å; S84-W86 VanDerWaalsContact C-N 3.3Å; S84-W86 PolarHBondContact O-N 3.14Å; W86-A88 PolarHBondContact O-N 2.96Å; W86-A88 VanDerWaalsContact O-N 3.16Å; W86-D89 WeakPolarHBondContact O-CB 3.35Å; W86-D89 PolarHBondContact O-N 3.16Å; W86-L90 PolarHBondContact O-N 3.39Å
87	K	84.6	Confident	86.8	Confident	86 Å²	86	67.8 Å²	67.8	37%	0.374	33%	0.327	S	S	.	.	H	α-helix	trans	-41.1	-45	170.6	177.4	159.5	155.9	148.7	0	114.2	E22 I26 F75 D89 L90 I91	E22-K87 VanDerWaalsContact OE1-CD 3.25Å; E22-K87 WeakPolarHBondContact OE1-CD 3.27Å; E22-K87 WeakPolarHBondContact OE1-CE 3.28Å; E22-K87 IonicContact OE1-NZ 3.78Å; E22-K87 PolarHBondContact OE1-NZ 2.98Å; E22-K87 WeakPolarHBondContact OE2-CE 3.4Å; E22-K87 IonicContact OE2-NZ 3.14Å; E22-K87 PolarHBondContact OE2-NZ 3.29Å; I26-K87 HydrophobicContact CD1-CG 4.4Å; F75-K87 HydrophobicContact CD1-CB 3.83Å; F75-K87 VanDerWaalsContact CD2-N 3.34Å; F75-K87 HydrophobicContact CE1-CB 3.71Å; F75-K87 HydrophobicContact CE1-CD 4.15Å; F75-K87 HydrophobicContact CE1-CG 4.43Å; F75-K87 HydrophobicContact CE2-CB 4.39Å; F75-K87 HydrophobicContact CG-CB 4.25Å; F75-K87 HydrophobicContact CZ-CB 4Å; K87-D89 VanDerWaalsContact C-N 3.31Å; K87-D89 PolarHBondContact O-N 3.46Å; K87-L90 PolarHBondContact O-N 3Å; K87-I91 HydrophobicContact CG-CD1 3.88Å; K87-I91 WeakPolarHBondContact O-CD1 3.45Å; K87-I91 VanDerWaalsContact O-CG1 3.27Å; K87-I91 WeakPolarHBondContact O-CG1 3.24Å; K87-I91 PolarHBondContact O-N 3.32Å
88	A	85.4	Confident	86.7	Confident	44 Å²	44	69.7 Å²	69.7	36%	0.364	34%	0.335	S	S	.	.	H	α-helix	trans	-64.3	-28.9	178.4	0	0	0	0	0	114.4	W86 R92	W86-A88 PolarHBondContact O-N 2.96Å; W86-A88 VanDerWaalsContact O-N 3.16Å; A88-R92 WeakPolarHBondContact O-CB 3.37Å; A88-R92 PolarHBondContact O-N 3.35Å
89	D	87.1	Confident	86.8	Confident	52 Å²	52	72.6 Å²	72.6	28%	0.278	35%	0.347	S	S	.	.	H	α-helix	trans	-77.1	-37.8	174	-74.9	-4.6	0	0	0	111.1	W86 K87 R92 H93	W86-D89 WeakPolarHBondContact O-CB 3.35Å; W86-D89 PolarHBondContact O-N 3.16Å; K87-D89 VanDerWaalsContact C-N 3.31Å; K87-D89 PolarHBondContact O-N 3.46Å; D89-R92 WeakPolarHBondContact O-CB 3.46Å; D89-R92 PolarHBondContact O-N 2.89Å; D89-R92 IonicContact OD1-CZ 2.78Å; D89-R92 IonicContact OD1-NH1 2.87Å; D89-R92 PolarHBondContact OD1-NH1 3.4Å; D89-R92 IonicContact OD1-NH2 3.97Å; D89-R92 PolarHBondContact OD1-NH2 2.84Å; D89-H93 PolarHBondContact O-N 3.42Å
90	L	88.9	Confident	86.7	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-66.1	-43.2	176.6	-173.2	66.1	0	0	0	111.9	I26 F75 H76 C77 W86 K87 R92 H93 L94	I26-L90 HydrophobicContact CB-CD2 4.05Å; I26-L90 HydrophobicContact CD1-CD2 3.93Å; I26-L90 HydrophobicContact CD1-CG 4.46Å; I26-L90 HydrophobicContact CG1-CD2 3.65Å; I26-L90 HydrophobicContact CG1-CG 4.37Å; I26-L90 HydrophobicContact CG2-CD2 3.65Å; F75-L90 HydrophobicContact CB-CB 4.32Å; F75-L90 HydrophobicContact CB-CD2 3.77Å; H76-L90 WeakPolarHBondContact O-CD2 3.19Å; C77-L90 HydrophobicContact CB-CD1 3.81Å; W86-L90 PolarHBondContact O-N 3.39Å; K87-L90 PolarHBondContact O-N 3Å; L90-R92 VanDerWaalsContact C-N 3.26Å; L90-R92 PolarHBondContact O-N 3.01Å; L90-H93 CarbonylContact O-C 3.47Å; L90-H93 WeakPolarHBondContact O-CA 3.35Å; L90-H93 WeakPolarHBondContact O-CB 3.38Å; L90-H93 PolarHBondContact O-N 3Å; L90-L94 HydrophobicContact CG-CD1 4.38Å; L90-L94 WeakPolarHBondContact O-CG 3.44Å; L90-L94 PolarHBondContact O-N 3.13Å
91	I	87.1	Confident	86.4	Confident	17 Å²	17	72.4 Å²	72.4	9%	0.087	34%	0.341	C	S	.	.	H	α-helix	trans	-59.1	-39.9	173.3	-64.2	155.8	0	0	0	110.7	I26 K87 H93 L94 A95 V102 T104	I26-I91 HydrophobicContact CD1-CG1 4.05Å; K87-I91 HydrophobicContact CG-CD1 3.88Å; K87-I91 WeakPolarHBondContact O-CD1 3.45Å; K87-I91 VanDerWaalsContact O-CG1 3.27Å; K87-I91 WeakPolarHBondContact O-CG1 3.24Å; K87-I91 PolarHBondContact O-N 3.32Å; I91-H93 VanDerWaalsContact C-N 3.32Å; I91-L94 PolarHBondContact O-N 2.77Å; I91-A95 WeakPolarHBondContact O-CB 3.25Å; I91-A95 PolarHBondContact O-N 3.19Å; I91-V102 HydrophobicContact CG1-CB 4.46Å; I91-V102 HydrophobicContact CG1-CG2 4.39Å; I91-V102 HydrophobicContact CG2-CB 4.31Å; I91-V102 HydrophobicContact CG2-CG2 4.29Å; I91-T104 HydrophobicContact CD1-CG2 3.62Å; I91-T104 HydrophobicContact CG1-CG2 4.31Å
92	R	87.2	Confident	86.1	Confident	127 Å²	127	62.8 Å²	62.8	48%	0.479	30%	0.296	S	S	.	.	H	α-helix	trans	-69.1	-30.1	176	-160.1	-169.7	-48.9	111.8	13.3	112.5	A88 D89 L90 K96	A88-R92 WeakPolarHBondContact O-CB 3.37Å; A88-R92 PolarHBondContact O-N 3.35Å; D89-R92 WeakPolarHBondContact O-CB 3.46Å; D89-R92 PolarHBondContact O-N 2.89Å; D89-R92 IonicContact OD1-CZ 2.78Å; D89-R92 IonicContact OD1-NH1 2.87Å; D89-R92 PolarHBondContact OD1-NH1 3.4Å; D89-R92 IonicContact OD1-NH2 3.97Å; D89-R92 PolarHBondContact OD1-NH2 2.84Å; L90-R92 VanDerWaalsContact C-N 3.26Å; L90-R92 PolarHBondContact O-N 3.01Å; R92-K96 WeakPolarHBondContact O-CB 3.49Å; R92-K96 VanDerWaalsContact O-CG 3.28Å; R92-K96 WeakPolarHBondContact O-CG 3.45Å; R92-K96 PolarHBondContact O-N 2.96Å
93	H	88.1	Confident	85.4	Confident	28 Å²	28	65.2 Å²	65.2	13%	0.13	31%	0.305	C	S	.	.	H	α-helix	trans	-71.5	-49.9	172.4	156.3	78.4	0	0	0	111.2	C77 C80 D89 L90 I91 A95 K96 V97 H98	C77-H93 PolarHBondContact SG-NE2 3.02Å; C80-H93 PolarHBondContact SG-CE1 3.06Å; C80-H93 PolarHBondContact SG-NE2 2.6Å; C80-H93 VanDerWaalsContact SG-NE2 3.41Å; D89-H93 PolarHBondContact O-N 3.42Å; L90-H93 CarbonylContact O-C 3.47Å; L90-H93 WeakPolarHBondContact O-CA 3.35Å; L90-H93 WeakPolarHBondContact O-CB 3.38Å; L90-H93 PolarHBondContact O-N 3Å; I91-H93 VanDerWaalsContact C-N 3.32Å; H93-A95 VanDerWaalsContact C-N 3.31Å; H93-A95 PolarHBondContact O-N 3.34Å; H93-K96 PolarHBondContact O-N 3.26Å; H93-V97 WeakPolarHBondContact ND1-CG2 3.46Å; H93-V97 WeakPolarHBondContact O-CB 3.49Å; H93-V97 PolarHBondContact O-N 3.27Å; H93-H98 AromaticContact CE1-CD2 3.86Å; H93-H98 AromaticContact CE1-NE2 3.59Å; H93-H98 AromaticContact NE2-CD2 3.46Å; H93-H98 PolarHBondContact NE2-CD2 3.49Å; H93-H98 AromaticContact NE2-NE2 3.33Å; H93-H98 PolarHBondContact NE2-NE2 3.31Å
94	L	89.6	Confident	84.6	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	30%	0.3	C	S	.	.	I	π-helix	trans	-53.2	-47.5	175.4	-75.2	166.6	0	0	0	111.3	V25 I26 C77 Y79 L90 I91 K96 H98 K99 I100 V102	V25-L94 HydrophobicContact CB-CD1 4.11Å; V25-L94 HydrophobicContact CG2-CD1 3.82Å; I26-L94 HydrophobicContact CG1-CD1 4.08Å; C77-L94 VanDerWaalsContact SG-CD2 3.58Å; Y79-L94 HydrophobicContact CD2-CD2 3.83Å; Y79-L94 HydrophobicContact CE2-CD2 4.22Å; L90-L94 HydrophobicContact CG-CD1 4.38Å; L90-L94 WeakPolarHBondContact O-CG 3.44Å; L90-L94 PolarHBondContact O-N 3.13Å; I91-L94 PolarHBondContact O-N 2.77Å; L94-K96 VanDerWaalsContact C-N 3.29Å; L94-K96 PolarHBondContact O-N 3.31Å; L94-H98 CarbonylContact O-C 3.49Å; L94-H98 WeakPolarHBondContact O-CA 3.42Å; L94-H98 PolarHBondContact O-N 3.36Å; L94-H98 VanDerWaalsContact O-N 3.14Å; L94-K99 PolarHBondContact O-N 2.89Å; L94-I100 CarbonylContact C-O 3.58Å; L94-I100 HydrophobicContact CB-CB 4.33Å; L94-I100 HydrophobicContact CB-CG2 4.49Å; L94-I100 HydrophobicContact CD2-CD1 4.44Å; L94-I100 PolarHBondContact O-N 3.05Å; L94-V102 HydrophobicContact CB-CG2 4.29Å; L94-V102 HydrophobicContact CD1-CG2 3.64Å
95	A	88.5	Confident	83.7	Confident	54 Å²	54	75.3 Å²	75.3	45%	0.446	34%	0.339	S	S	.	.	I	π-helix	trans	-68.8	-19.7	178.9	0	0	0	0	0	115	I91 H93 I100	I91-A95 WeakPolarHBondContact O-CB 3.25Å; I91-A95 PolarHBondContact O-N 3.19Å; H93-A95 VanDerWaalsContact C-N 3.31Å; H93-A95 PolarHBondContact O-N 3.34Å; A95-I100 WeakPolarHBondContact CA-O 3.48Å; A95-I100 PolarHBondContact N-O 2.81Å
96	K	88.2	Confident	82.5	Confident	163 Å²	163	81.2 Å²	81.2	71%	0.709	36%	0.361	S	S	*	.	I	π-helix	trans	-103.4	-37.7	-178.1	-77.1	-173.3	174.4	-164.7	0	114.4	R92 H93 L94	R92-K96 WeakPolarHBondContact O-CB 3.49Å; R92-K96 VanDerWaalsContact O-CG 3.28Å; R92-K96 WeakPolarHBondContact O-CG 3.45Å; R92-K96 PolarHBondContact O-N 2.96Å; H93-K96 PolarHBondContact O-N 3.26Å; L94-K96 VanDerWaalsContact C-N 3.29Å; L94-K96 PolarHBondContact O-N 3.31Å
97	V	88.5	Confident	81.3	Confident	93 Å²	93	79.7 Å²	79.7	56%	0.564	36%	0.36	S	S	*	.	I	π-helix	trans	-96	-51.8	-175.3	179.9	0	0	0	0	110	H93	H93-V97 WeakPolarHBondContact ND1-CG2 3.46Å; H93-V97 WeakPolarHBondContact O-CB 3.49Å; H93-V97 PolarHBondContact O-N 3.27Å
98	H	87.4	Confident	80.2	Confident	51 Å²	51	82.9 Å²	82.9	24%	0.236	37%	0.37	C	S	.	.	I	π-helix	trans	-92	-4.7	-178.2	-58.1	-76.2	0	0	0	113.1	Y79 C80 H93 L94 I100	Y79-H98 WeakPolarHBondContact CB-CE1 3.41Å; Y79-H98 WeakPolarHBondContact CB-ND1 3.37Å; Y79-H98 PolarHBondContact O-CE1 3.35Å; C80-H98 PolarHBondContact SG-NE2 3.03Å; H93-H98 AromaticContact CE1-CD2 3.86Å; H93-H98 AromaticContact CE1-NE2 3.59Å; H93-H98 AromaticContact NE2-CD2 3.46Å; H93-H98 PolarHBondContact NE2-CD2 3.49Å; H93-H98 AromaticContact NE2-NE2 3.33Å; H93-H98 PolarHBondContact NE2-NE2 3.31Å; L94-H98 CarbonylContact O-C 3.49Å; L94-H98 WeakPolarHBondContact O-CA 3.42Å; L94-H98 PolarHBondContact O-N 3.36Å; L94-H98 VanDerWaalsContact O-N 3.14Å; H98-I100 HydrophobicContact CB-CB 4.44Å; H98-I100 HydrophobicContact CB-CD1 3.86Å; H98-I100 HydrophobicContact CB-CG1 4.05Å; H98-I100 PolarHBondContact O-N 2.82Å; H98-I100 VanDerWaalsContact O-N 3.11Å
99	K	86.4	Confident	78.9	Confident	166 Å²	166	89.1 Å²	89.1	72%	0.722	38%	0.384	S	S	*	.			trans	59	10.5	-173.3	-55.7	175.2	-177.2	171.9	0	114.6	L94	L94-K99 PolarHBondContact O-N 2.89Å
100	I	84.3	Confident	77.4	Confident	26 Å²	26	88.8 Å²	88.8	13%	0.133	39%	0.385	C	S	.	.			trans	-76.1	131.9	-176.1	-72.4	171.4	0	0	0	111	L20 V25 Y79 L94 A95 H98 V102	L20-I100 HydrophobicContact CD1-CD1 4.32Å; L20-I100 HydrophobicContact CD1-CG1 4.45Å; L20-I100 HydrophobicContact CD1-CG2 4.02Å; V25-I100 HydrophobicContact CG1-CG2 4.11Å; Y79-I100 HydrophobicContact CD2-CD1 3.68Å; Y79-I100 HydrophobicContact CE1-CD1 4.17Å; Y79-I100 HydrophobicContact CE2-CD1 3.24Å; Y79-I100 HydrophobicContact CG-CD1 4.3Å; L94-I100 CarbonylContact C-O 3.58Å; L94-I100 HydrophobicContact CB-CB 4.33Å; L94-I100 HydrophobicContact CB-CG2 4.49Å; L94-I100 HydrophobicContact CD2-CD1 4.44Å; L94-I100 PolarHBondContact O-N 3.05Å; A95-I100 WeakPolarHBondContact CA-O 3.48Å; A95-I100 PolarHBondContact N-O 2.81Å; H98-I100 HydrophobicContact CB-CB 4.44Å; H98-I100 HydrophobicContact CB-CD1 3.86Å; H98-I100 HydrophobicContact CB-CG1 4.05Å; H98-I100 PolarHBondContact O-N 2.82Å; H98-I100 VanDerWaalsContact O-N 3.11Å; I100-V102 HydrophobicContact CG2-CG2 4.28Å
101	R	80.7	Confident	75.7	Confident	126 Å²	126	91.1 Å²	91.1	48%	0.475	41%	0.405	S	S	.	.			trans	-102.8	105.4	175.5	-70.8	-176.7	175	172.3	1.3	110.7	F19 L20	F19-R101 VanDerWaalsContact CA-O 3.27Å; F19-R101 WeakPolarHBondContact CA-O 3.46Å; F19-R101 WeakPolarHBondContact CB-O 3.39Å; F19-R101 HydrophobicContact CD1-CB 3.83Å; F19-R101 WeakPolarHBondContact CD1-O 3.48Å; F19-R101 HydrophobicContact CE1-CB 4.04Å; L20-R101 PolarHBondContact N-O 2.81Å
102	V	79.1	Confident	74.3	Confident	1 Å²	1	94.7 Å²	94.7	1%	0.006	42%	0.421	C	S	.	.	B	Isolated β-bridge	trans	-83	134.1	177.1	-159	0	0	0	0	110.8	E22 V25 I91 L94 I100 T104 N107	E22-V102 HydrophobicContact CB-CG1 3.94Å; E22-V102 HydrophobicContact CG-CG1 3.86Å; V25-V102 HydrophobicContact CG2-CB 4.35Å; V25-V102 HydrophobicContact CG2-CG1 3.74Å; V25-V102 HydrophobicContact CG2-CG2 3.7Å; I91-V102 HydrophobicContact CG1-CB 4.46Å; I91-V102 HydrophobicContact CG1-CG2 4.39Å; I91-V102 HydrophobicContact CG2-CB 4.31Å; I91-V102 HydrophobicContact CG2-CG2 4.29Å; L94-V102 HydrophobicContact CB-CG2 4.29Å; L94-V102 HydrophobicContact CD1-CG2 3.64Å; I100-V102 HydrophobicContact CG2-CG2 4.28Å; V102-T104 HydrophobicContact CB-CG2 4.28Å; V102-T104 HydrophobicContact CG1-CG2 3.95Å; V102-T104 PolarHBondContact O-N 2.95Å; V102-N107 PolarHBondContact O-ND2 3.11Å
103	R	72.2	Confident	73	Confident	176 Å²	176	93.8 Å²	93.8	66%	0.664	42%	0.423	S	S	*	.			trans	-84.6	109.5	174.8	-171.5	173.5	-175.3	137.7	-1.9	110.6	F19 L20	F19-R103 HydrophobicContact CB-CB 3.84Å; F19-R103 HydrophobicContact CD1-CB 4.25Å; F19-R103 HydrophobicContact CG-CB 4.29Å; L20-R103 PolarHBondContact O-N 3.31Å
104	T	70.7	Confident	71.6	Confident	13 Å²	13	99.3 Å²	99.3	8%	0.08	45%	0.446	C	S	.	.			trans	-132.8	158.8	-179.6	67.8	0	0	0	0	112.4	E22 I91 V102 Y106 N107 R108	E22-T104 HydrophobicContact CG-CG2 4.42Å; E22-T104 WeakPolarHBondContact OE2-CG2 3.15Å; I91-T104 HydrophobicContact CD1-CG2 3.62Å; I91-T104 HydrophobicContact CG1-CG2 4.31Å; V102-T104 HydrophobicContact CB-CG2 4.28Å; V102-T104 HydrophobicContact CG1-CG2 3.95Å; V102-T104 PolarHBondContact O-N 2.95Å; T104-Y106 PolarHBondContact O-N 2.96Å; T104-Y106 VanDerWaalsContact O-N 3.15Å; T104-N107 PolarHBondContact O-N 3.47Å; T104-N107 PolarHBondContact OG1-N 3.29Å; T104-R108 PolarHBondContact O-N 3.33Å
105	R	65.9	Low	70.1	Confident	232 Å²	232	104.2 Å²	104.2	88%	0.875	47%	0.472	S	S	*	.	H	α-helix	trans	-54.7	-31.3	175.5	-70.6	-174.5	179.4	-176.8	-0.1	112.6	R109	R105-R109 PolarHBondContact O-N 3.41Å
106	Y	57.6	Low	68.7	Low	160 Å²	160	104.4 Å²	104.4	63%	0.627	47%	0.47	S	S	*	.	H	α-helix	trans	-66.8	-49	175.1	-174.3	-91.6	0	0	0	112	T104 R108 R109 S110	T104-Y106 PolarHBondContact O-N 2.96Å; T104-Y106 VanDerWaalsContact O-N 3.15Å; Y106-R108 PolarHBondContact O-N 3.32Å; Y106-R109 PolarHBondContact O-N 3.46Å; Y106-S110 PolarHBondContact O-N 3.4Å
107	N	60.9	Low	67.4	Low	58 Å²	58	100.3 Å²	100.3	31%	0.31	46%	0.462	S	S	.	.	H	α-helix	trans	-65.7	-27.6	178.2	-71.7	-14.8	0	0	0	112.4	V102 T104 A111	V102-N107 PolarHBondContact O-ND2 3.11Å; T104-N107 PolarHBondContact O-N 3.47Å; T104-N107 PolarHBondContact OG1-N 3.29Å; N107-A111 PolarHBondContact O-N 3.1Å
108	R	61	Low	66.1	Low	153 Å²	153	103.2 Å²	103.2	58%	0.577	47%	0.467	S	S	*	.	H	α-helix	trans	-62.7	-52.4	174.4	-152.6	-167.1	175.6	135.8	3.9	111.5	T104 Y106 S110 A111 E112	T104-R108 PolarHBondContact O-N 3.33Å; Y106-R108 PolarHBondContact O-N 3.32Å; R108-S110 PolarHBondContact O-N 3.34Å; R108-A111 WeakPolarHBondContact O-CB 3.32Å; R108-A111 PolarHBondContact O-N 2.93Å; R108-E112 VanDerWaalsContact CD-OE1 3.31Å; R108-E112 WeakPolarHBondContact CD-OE1 3.43Å; R108-E112 VanDerWaalsContact CG-OE1 3.31Å; R108-E112 WeakPolarHBondContact CG-OE1 3.37Å; R108-E112 IonicContact CZ-OE1 3.71Å; R108-E112 IonicContact NE-OE1 3.39Å; R108-E112 PolarHBondContact NE-OE1 3.27Å; R108-E112 IonicContact NH2-OE1 3.01Å; R108-E112 WeakPolarHBondContact O-CG 3.46Å; R108-E112 PolarHBondContact O-N 2.94Å
109	R	57.2	Low	65	Low	176 Å²	176	105 Å²	105	66%	0.664	48%	0.482	S	S	*	.	H	α-helix	trans	-57.3	-47.4	179.1	-71.5	-173.2	178.7	-177.1	-1.4	112.5	R105 Y106 A111 E112 E113	R105-R109 PolarHBondContact O-N 3.41Å; Y106-R109 PolarHBondContact O-N 3.46Å; R109-A111 PolarHBondContact O-N 2.77Å; R109-A111 VanDerWaalsContact O-N 3.16Å; R109-E112 PolarHBondContact O-N 2.82Å; R109-E112 VanDerWaalsContact O-N 3.13Å; R109-E113 WeakPolarHBondContact O-CB 3.23Å; R109-E113 VanDerWaalsContact O-CG 3.24Å; R109-E113 WeakPolarHBondContact O-CG 3.22Å; R109-E113 PolarHBondContact O-N 2.83Å
110	S	55	Low	63.8	Low	44 Å²	44	104.1 Å²	104.1	31%	0.308	48%	0.478	S	S	.	.	H	α-helix	trans	-71.2	-6.5	177.9	-68.2	0	0	0	0	115.4	Y106 R108 E113 K114	Y106-S110 PolarHBondContact O-N 3.4Å; R108-S110 PolarHBondContact O-N 3.34Å; S110-E113 WeakPolarHBondContact CA-OE2 3.25Å; S110-K114 VanDerWaalsContact O-CD 3.22Å; S110-K114 WeakPolarHBondContact O-CD 3.49Å; S110-K114 WeakPolarHBondContact O-CE 3.33Å; S110-K114 VanDerWaalsContact O-CG 3.27Å; S110-K114 WeakPolarHBondContact O-CG 3.49Å
111	A	55.1	Low	62.8	Low	50 Å²	50	110.2 Å²	110.2	41%	0.413	50%	0.504	S	S	.	.	H	α-helix	trans	-90.4	-44.4	165.2	0	0	0	0	0	110.9	N107 R108 R109 K114 N115	N107-A111 PolarHBondContact O-N 3.1Å; R108-A111 WeakPolarHBondContact O-CB 3.32Å; R108-A111 PolarHBondContact O-N 2.93Å; R109-A111 PolarHBondContact O-N 2.77Å; R109-A111 VanDerWaalsContact O-N 3.16Å; A111-K114 PolarHBondContact O-N 2.84Å; A111-N115 PolarHBondContact O-N 3.02Å
112	E	57.4	Low	61.7	Low	91 Å²	91	106.8 Å²	106.8	43%	0.425	50%	0.502	S	S	.	.	H	α-helix	trans	-63.5	-41	177.9	-70.9	159.7	164.5	0	0	111.8	R108 R109 K114 N115 S116	R108-E112 VanDerWaalsContact CD-OE1 3.31Å; R108-E112 WeakPolarHBondContact CD-OE1 3.43Å; R108-E112 VanDerWaalsContact CG-OE1 3.31Å; R108-E112 WeakPolarHBondContact CG-OE1 3.37Å; R108-E112 IonicContact CZ-OE1 3.71Å; R108-E112 IonicContact NE-OE1 3.39Å; R108-E112 PolarHBondContact NE-OE1 3.27Å; R108-E112 IonicContact NH2-OE1 3.01Å; R108-E112 WeakPolarHBondContact O-CG 3.46Å; R108-E112 PolarHBondContact O-N 2.94Å; R109-E112 PolarHBondContact O-N 2.82Å; R109-E112 VanDerWaalsContact O-N 3.13Å; E112-K114 PolarHBondContact O-N 3.17Å; E112-N115 PolarHBondContact O-N 3.05Å; E112-S116 VanDerWaalsContact O-CB 3.29Å; E112-S116 WeakPolarHBondContact O-CB 3.48Å; E112-S116 PolarHBondContact O-N 3.43Å
113	E	58.9	Low	60.9	Low	109 Å²	109	113.7 Å²	113.7	51%	0.509	53%	0.532	S	S	.	.	H	α-helix	trans	-61.5	-40.6	172	-73.5	164.9	168.5	0	0	112.2	R109 S110 S117	R109-E113 WeakPolarHBondContact O-CB 3.23Å; R109-E113 VanDerWaalsContact O-CG 3.24Å; R109-E113 WeakPolarHBondContact O-CG 3.22Å; R109-E113 PolarHBondContact O-N 2.83Å; S110-E113 WeakPolarHBondContact CA-OE2 3.25Å; E113-S117 VanDerWaalsContact O-CB 3.29Å; E113-S117 WeakPolarHBondContact O-CB 3.46Å; E113-S117 PolarHBondContact O-N 3.01Å; E113-S117 PolarHBondContact O-OG 2.71Å
114	K	59.2	Low	60.1	Low	144 Å²	144	111.7 Å²	111.7	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-71.3	-36.2	177.7	-73.8	177	-171.5	173.5	0	112.1	S110 A111 E112 K118	S110-K114 VanDerWaalsContact O-CD 3.22Å; S110-K114 WeakPolarHBondContact O-CD 3.49Å; S110-K114 WeakPolarHBondContact O-CE 3.33Å; S110-K114 VanDerWaalsContact O-CG 3.27Å; S110-K114 WeakPolarHBondContact O-CG 3.49Å; A111-K114 PolarHBondContact O-N 2.84Å; E112-K114 PolarHBondContact O-N 3.17Å; K114-K118 WeakPolarHBondContact O-CB 3.32Å; K114-K118 WeakPolarHBondContact O-CG 3.4Å; K114-K118 PolarHBondContact O-N 3.39Å
115	N	58.6	Low	59.5	Low	103 Å²	103	114.9 Å²	114.9	55%	0.551	55%	0.554	S	S	*	*	H	α-helix	trans	-70.8	-41.7	173.8	-75.4	-3.3	0	0	0	111.2	A111 E112 S117 K118 T119	A111-N115 PolarHBondContact O-N 3.02Å; E112-N115 PolarHBondContact O-N 3.05Å; N115-S117 VanDerWaalsContact C-N 3.34Å; N115-S117 PolarHBondContact O-N 3.49Å; N115-K118 CarbonylContact O-C 3.52Å; N115-K118 PolarHBondContact O-N 3.44Å; N115-T119 WeakPolarHBondContact O-CG2 3.4Å; N115-T119 PolarHBondContact O-N 3.26Å; N115-T119 PolarHBondContact O-OG1 2.69Å
116	S	57.9	Low	59.1	Low	57 Å²	57	107.9 Å²	107.9	40%	0.399	54%	0.54	S	S	.	.	H	α-helix	trans	-61.6	-39.7	172.5	-173.3	0	0	0	0	112.3	E112 T119 K120	E112-S116 VanDerWaalsContact O-CB 3.29Å; E112-S116 WeakPolarHBondContact O-CB 3.48Å; E112-S116 PolarHBondContact O-N 3.43Å; S116-T119 WeakPolarHBondContact CA-OG1 3.39Å; S116-T119 PolarHBondContact O-N 2.9Å; S116-T119 PolarHBondContact O-OG1 2.86Å; S116-K120 WeakPolarHBondContact O-CB 3.33Å; S116-K120 VanDerWaalsContact O-CG 3.29Å; S116-K120 WeakPolarHBondContact O-CG 3.43Å; S116-K120 PolarHBondContact O-N 3.23Å
117	S	62.1	Low	59.1	Low	78 Å²	78	108.4 Å²	108.4	55%	0.545	55%	0.546	S	S	.	.	H	α-helix	trans	-66.7	-39	173.4	-57.5	0	0	0	0	112.1	E113 N115 K121	E113-S117 VanDerWaalsContact O-CB 3.29Å; E113-S117 WeakPolarHBondContact O-CB 3.46Å; E113-S117 PolarHBondContact O-N 3.01Å; E113-S117 PolarHBondContact O-OG 2.71Å; N115-S117 VanDerWaalsContact C-N 3.34Å; N115-S117 PolarHBondContact O-N 3.49Å; S117-K121 VanDerWaalsContact O-CB 3.31Å; S117-K121 WeakPolarHBondContact O-CB 3.04Å; S117-K121 PolarHBondContact O-N 3.21Å
118	K	61.2	Low	58.4	Low	154 Å²	154	111 Å²	111	67%	0.67	56%	0.559	S	S	*	*	H	α-helix	trans	-66.2	-44.6	173.6	-83.9	-173.9	171.6	-169.4	0	112.4	K114 N115 K121 A122	K114-K118 WeakPolarHBondContact O-CB 3.32Å; K114-K118 WeakPolarHBondContact O-CG 3.4Å; K114-K118 PolarHBondContact O-N 3.39Å; N115-K118 CarbonylContact O-C 3.52Å; N115-K118 PolarHBondContact O-N 3.44Å; K118-K121 PolarHBondContact O-N 3.16Å; K118-A122 WeakPolarHBondContact O-CB 3.18Å; K118-A122 PolarHBondContact O-N 3.27Å
119	T	64.1	Low	57.3	Low	88 Å²	88	108.8 Å²	108.8	54%	0.54	56%	0.564	S	S	.	*	H	α-helix	trans	-70.1	-37	179.8	53.5	0	0	0	0	112	N115 S116 K123	N115-T119 WeakPolarHBondContact O-CG2 3.4Å; N115-T119 PolarHBondContact O-N 3.26Å; N115-T119 PolarHBondContact O-OG1 2.69Å; S116-T119 WeakPolarHBondContact CA-OG1 3.39Å; S116-T119 PolarHBondContact O-N 2.9Å; S116-T119 PolarHBondContact O-OG1 2.86Å; T119-K123 WeakPolarHBondContact O-CB 3.43Å; T119-K123 PolarHBondContact O-N 2.79Å
120	K	60.1	Low	56.8	Low	148 Å²	148	110.2 Å²	110.2	64%	0.643	58%	0.575	S	S	*	*	H	α-helix	trans	-61.8	-47.8	169.9	-74.3	-178.2	-179.8	-169.7	0	111.8	S116 K123 L124	S116-K120 WeakPolarHBondContact O-CB 3.33Å; S116-K120 VanDerWaalsContact O-CG 3.29Å; S116-K120 WeakPolarHBondContact O-CG 3.43Å; S116-K120 PolarHBondContact O-N 3.23Å; K120-K123 PolarHBondContact O-N 2.92Å; K120-L124 PolarHBondContact O-N 2.89Å
121	K	64	Low	55.8	Low	154 Å²	154	115.3 Å²	115.3	67%	0.67	60%	0.598	S	S	*	*	H	α-helix	trans	-67	-37.6	178.7	-166.5	166.4	-174.9	173.4	0	112.3	S117 K118 L124 T125	S117-K121 VanDerWaalsContact O-CB 3.31Å; S117-K121 WeakPolarHBondContact O-CB 3.04Å; S117-K121 PolarHBondContact O-N 3.21Å; K118-K121 PolarHBondContact O-N 3.16Å; K121-L124 PolarHBondContact O-N 3.41Å; K121-T125 PolarHBondContact O-N 2.98Å; K121-T125 PolarHBondContact O-OG1 2.92Å; K121-T125 VanDerWaalsContact O-OG1 3.09Å
122	A	57.6	Low	55	Low	53 Å²	53	118 Å²	118	44%	0.438	61%	0.611	S	S	.	*	H	α-helix	trans	-64.1	-45.3	175.2	0	0	0	0	0	112	K118 L124 T125 S126	K118-A122 WeakPolarHBondContact O-CB 3.18Å; K118-A122 PolarHBondContact O-N 3.27Å; A122-L124 VanDerWaalsContact C-N 3.33Å; A122-L124 PolarHBondContact O-N 2.86Å; A122-T125 WeakPolarHBondContact CA-OG1 3.21Å; A122-T125 PolarHBondContact O-N 3.16Å; A122-T125 PolarHBondContact O-OG1 2.84Å; A122-S126 PolarHBondContact O-N 3.11Å; A122-S126 PolarHBondContact O-OG 2.73Å
123	K	62.3	Low	54	Low	147 Å²	147	119.9 Å²	119.9	64%	0.639	63%	0.629	S	S	*	*	H	α-helix	trans	-59.8	-42.8	172	-86	-164.6	169.8	-168.1	0	111.8	T119 K120 T125 S126 F127	T119-K123 WeakPolarHBondContact O-CB 3.43Å; T119-K123 PolarHBondContact O-N 2.79Å; K120-K123 PolarHBondContact O-N 2.92Å; K123-T125 VanDerWaalsContact C-N 3.29Å; K123-T125 PolarHBondContact O-N 3.47Å; K123-S126 WeakPolarHBondContact CA-OG 3.49Å; K123-S126 PolarHBondContact O-N 3.14Å; K123-S126 PolarHBondContact O-OG 3.1Å; K123-F127 WeakPolarHBondContact O-CD2 3.37Å; K123-F127 PolarHBondContact O-N 2.68Å
124	L	54.4	Low	52.8	Low	133 Å²	133	122.1 Å²	122.1	70%	0.696	64%	0.643	S	S	*	*	H	α-helix	trans	-62.4	-37.2	177.8	-154.1	76.6	0	0	0	111.8	K120 K121 A122	K120-L124 PolarHBondContact O-N 2.89Å; K121-L124 PolarHBondContact O-N 3.41Å; A122-L124 VanDerWaalsContact C-N 3.33Å; A122-L124 PolarHBondContact O-N 2.86Å
125	T	59.8	Low	51.8	Low	81 Å²	81	122.6 Å²	122.6	50%	0.497	65%	0.653	S	S	.	*	H	α-helix	trans	-78.9	-21.4	175.6	50.5	0	0	0	0	114.7	K121 A122 K123 I128	K121-T125 PolarHBondContact O-N 2.98Å; K121-T125 PolarHBondContact O-OG1 2.92Å; K121-T125 VanDerWaalsContact O-OG1 3.09Å; A122-T125 WeakPolarHBondContact CA-OG1 3.21Å; A122-T125 PolarHBondContact O-N 3.16Å; A122-T125 PolarHBondContact O-OG1 2.84Å; K123-T125 VanDerWaalsContact C-N 3.29Å; K123-T125 PolarHBondContact O-N 3.47Å; T125-I128 PolarHBondContact O-N 3.15Å
126	S	57.1	Low	50.6	Low	85 Å²	85	120.7 Å²	120.7	59%	0.594	66%	0.657	S	S	*	*	H	α-helix	trans	-80	-16.7	179.5	62.1	0	0	0	0	113.8	A122 K123	A122-S126 PolarHBondContact O-N 3.11Å; A122-S126 PolarHBondContact O-OG 2.73Å; K123-S126 WeakPolarHBondContact CA-OG 3.49Å; K123-S126 PolarHBondContact O-N 3.14Å; K123-S126 PolarHBondContact O-OG 3.1Å
127	F	56.8	Low	49.6	Very low	171 Å²	171	123.6 Å²	123.6	75%	0.75	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-0.8	171.1	-68.4	-66.2	0	0	0	113.5	K123 P129	K123-F127 WeakPolarHBondContact O-CD2 3.37Å; K123-F127 PolarHBondContact O-N 2.68Å; F127-P129 WeakPolarHBondContact O-CD 3.47Å
128	I	46	Very low	48.4	Very low	113 Å²	113	127.4 Å²	127.4	58%	0.579	69%	0.689	S	S	*	*	S	Bend	trans	-86.9	116.4	170.1	-57.1	174.3	0	0	0	107.1	T125 K130	T125-I128 PolarHBondContact O-N 3.15Å; I128-K130 PolarHBondContact O-N 2.89Å
129	P	39.6	Very low	47.1	Very low	106 Å²	106	123.4 Å²	123.4	69%	0.688	69%	0.692	S	S	*	*			trans	-58.5	136.5	172.9	-21.6	33.9	0	0	0	109.7	F127 L131	F127-P129 WeakPolarHBondContact O-CD 3.47Å; P129-L131 PolarHBondContact O-N 2.92Å
130	K	46.4	Very low	45.5	Very low	205 Å²	205	127 Å²	127	89%	0.891	70%	0.702	S	S	*	*			trans	-69.6	96.5	169.6	-74	-176.9	178.8	178.2	0	108.2	I128 P132	I128-K130 PolarHBondContact O-N 2.89Å; K130-P132 WeakPolarHBondContact O-CD 3.44Å
131	L	33.5	Very low	44.1	Very low	152 Å²	152	127.6 Å²	127.6	80%	0.796	71%	0.705	S	S	*	*			trans	-52.6	126.6	166.8	-69.7	172.1	0	0	0	108.7	P129 V133	P129-L131 PolarHBondContact O-N 2.92Å; L131-V133 PolarHBondContact O-N 3.3Å
132	P	38.4	Very low	42.7	Very low	106 Å²	106	127.9 Å²	127.9	69%	0.688	71%	0.709	S	S	*	*			trans	-60.9	127.7	174.1	-22.8	34	0	0	0	110.1	K130 L134	K130-P132 WeakPolarHBondContact O-CD 3.44Å; P132-L134 VanDerWaalsContact C-N 3.29Å; P132-L134 HydrophobicContact CB-CG 4.39Å; P132-L134 PolarHBondContact O-N 2.89Å
133	V	37.1	Very low	41.4	Very low	131 Å²	131	133.9 Å²	133.9	79%	0.794	73%	0.728	S	S	*	*			trans	-80	86.3	168.7	-178.5	0	0	0	0	107.1	L131 N135	L131-V133 PolarHBondContact O-N 3.3Å; V133-N135 PolarHBondContact O-N 2.99Å
134	L	32.5	Very low	40	Very low	155 Å²	155	134.3 Å²	134.3	81%	0.812	74%	0.735	S	S	*	*			trans	-74.9	116	170.6	-67.1	178.1	0	0	0	108.9	P132 G136	P132-L134 VanDerWaalsContact C-N 3.29Å; P132-L134 HydrophobicContact CB-CG 4.39Å; P132-L134 PolarHBondContact O-N 2.89Å; L134-G136 PolarHBondContact O-N 3.45Å
135	N	37.4	Very low	38.9	Very low	155 Å²	155	135 Å²	135	83%	0.829	74%	0.735	S	S	*	*			trans	-79.9	98.5	165.1	-63.4	-36.2	0	0	0	107.8	V133	V133-N135 PolarHBondContact O-N 2.99Å
136	G	33.6	Very low	37.7	Very low	62 Å²	62	137.9 Å²	137.9	64%	0.639	74%	0.741	S	S	*	*			trans	-86.5	178.2	159.4	0	0	0	0	0	111.4	L134	L134-G136 PolarHBondContact O-N 3.45Å
137	P	38.2	Very low	36.5	Very low	118 Å²	118	140.1 Å²	140.1	77%	0.766	75%	0.746	S	S	*	*			cis	-104.4	158.5	5.5	38.7	-32.3	0	0	0	113.9
138	D	35.9	Very low	35.4	Very low	158 Å²	158	142 Å²	142	85%	0.845	75%	0.749	S	S	*	*			trans	164	133.5	135	-82.4	-13.9	0	0	0	109.3
139	G	33.9	Very low	34.9	Very low	71 Å²	71	142.4 Å²	142.4	73%	0.732	75%	0.753	S	S	*	*			trans	77	102.8	-172.4	0	0	0	0	0	113
140	E	31.9	Very low	35	Very low	162 Å²	162	141.9 Å²	141.9	76%	0.757	75%	0.752	S	S	*	*				84.8	113.9	68	-77.4	-164.7	-144.5	0	0	115.8
141	K	30.9	Very low	34.3	Very low	161 Å²	161	139.2 Å²	139.2	70%	0.7	75%	0.747	S	S	*	*			trans	85.6	141.9	147.6	-68.6	163.8	179.2	143.7	0	121.7
142	E	34.5	Very low	34.6	Very low	160 Å²	160	137.1 Å²	137.1	75%	0.748	75%	0.745	S	S	*	*			trans	55.6	108.6	157.4	-69.1	140.8	-130.1	0	0	117.8
143	E	29.5	Very low	34.6	Very low	180 Å²	180	140.3 Å²	140.3	84%	0.841	75%	0.751	S	S	*	*				89.7	164.9	59.3	-76.8	-163.7	174	0	0	114
144	I	33.6	Very low	34.4	Very low	156 Å²	156	136.9 Å²	136.9	80%	0.8	74%	0.742	S	S	*	*			trans	72.3	96.8	-174.2	-46.4	169.2	0	0	0	112.4
145	E	30.1	Very low	34.4	Very low	146 Å²	146	136.3 Å²	136.3	68%	0.682	74%	0.739	S	S	*	*			cis	81.4	144.7	46	-155.2	-146.9	165.7	0	0	113.8
146	K	34.6	Very low	34.2	Very low	143 Å²	143	135.2 Å²	135.2	62%	0.622	73%	0.732	S	S	*	*			trans	72.3	146.1	175.8	-58	-177.8	176.1	64.5	0	115.7
147	D	32.3	Very low	34.3	Very low	132 Å²	132	141 Å²	141	71%	0.706	74%	0.742	S	S	*	*			cis	-161.1	-178.4	-8.6	-105.4	-25.3	0	0	0	110.6
148	Y	33.2	Very low	33.8	Very low	210 Å²	210	141 Å²	141	82%	0.824	75%	0.745	S	S	*	*			trans	70.1	123.4	172.4	-89	-102.9	0	0	0	118.3
149	N	35.8	Very low	33.7	Very low	122 Å²	122	138.3 Å²	138.3	65%	0.652	74%	0.739	S	S	*	*			cis	88.2	102.1	27	-168.4	21.1	0	0	0	116.2
150	S	40.9	Very low	33.8	Very low	95 Å²	95	142.3 Å²	142.3	66%	0.664	74%	0.744	S	S	*	*				167	139	106.8	50.6	0	0	0	0	115.8
151	N	33.3	Very low	33.8	Very low	148 Å²	148	139.3 Å²	139.3	79%	0.791	74%	0.74	S	S	*	*			trans	29.9	138.3	146.2	-56.9	-24	0	0	0	120.8
152	S	40	Very low	33.9	Very low	108 Å²	108	137.9 Å²	137.9	76%	0.755	75%	0.748	S	S	*	*			cis	-150.2	126.3	40.1	56.5	0	0	0	0	112.6
153	H	37.4	Very low	33.8	Very low	174 Å²	174	138.1 Å²	138.1	81%	0.806	75%	0.749	S	S	*	*				89.1	115.8	84.4	-150	-81.2	0	0	0	113
154	G	33	Very low	33.7	Very low	59 Å²	59	136.5 Å²	136.5	61%	0.608	75%	0.751	S	S	*	*			cis	169.8	177.7	-6.7	0	0	0	0	0	113.6
155	L	32.9	Very low	33.6	Very low	142 Å²	142	134.4 Å²	134.4	74%	0.743	75%	0.746	S	S	*	*			trans	64.8	133.3	158.5	-78.8	77.4	0	0	0	118.1
156	L	33.7	Very low	33.6	Very low	132 Å²	132	138.6 Å²	138.6	69%	0.691	76%	0.755	S	S	*	*			cis	-133.7	126.2	-10.5	-82.8	160.5	0	0	0	106.6
157	Q	34.5	Very low	33.3	Very low	183 Å²	183	138.6 Å²	138.6	86%	0.855	76%	0.761	S	S	*	*				57.9	121.8	93.5	-83	-176.5	-26.5	0	0	115.3
158	S	27.9	Very low	33	Very low	118 Å²	118	137.6 Å²	137.6	83%	0.825	77%	0.765	S	S	*	*			trans	-134.3	119.9	-174	56.3	0	0	0	0	111.1
159	S	34.1	Very low	33	Very low	103 Å²	103	132.7 Å²	132.7	72%	0.72	75%	0.752	S	S	*	*			trans	-168.8	111.5	160.9	52.1	0	0	0	0	109.7
160	D	35.6	Very low	32.6	Very low	154 Å²	154	135.8 Å²	135.8	82%	0.824	76%	0.762	S	S	*	*				161.9	151.1	121.2	-78.8	-15.9	0	0	0	112.9
161	S	32.1	Very low	32.4	Very low	99 Å²	99	138.3 Å²	138.3	69%	0.692	76%	0.761	S	S	*	*			trans	64.8	129.7	178	-156.9	0	0	0	0	118.4	E163	S161-E163 PolarHBondContact O-N 3.42Å
162	P	32.9	Very low	32.6	Very low	131 Å²	131	133.7 Å²	133.7	85%	0.851	75%	0.749	S	S	*	*			trans	-94.2	73.2	179	37.8	-34.7	0	0	0	113.1
163	E	32.7	Very low	32.4	Very low	165 Å²	165	135.8 Å²	135.8	77%	0.771	75%	0.752	S	S	*	*			trans	-102.1	148.9	172.2	-69	-154.4	136.5	0	0	114.1	S161 V165	S161-E163 PolarHBondContact O-N 3.42Å; E163-V165 PolarHBondContact O-N 3.19Å
164	T	28	Very low	32.6	Very low	146 Å²	146	132.7 Å²	132.7	90%	0.896	75%	0.745	S	S	*	*			trans	-85.1	62.7	-162.2	50.7	0	0	0	0	114.3	R166	T164-R166 PolarHBondContact O-N 3.38Å
165	V	31.5	Very low	32.8	Very low	113 Å²	113	134.2 Å²	134.2	69%	0.685	74%	0.738	S	S	*	*			trans	-72.3	114.1	177.8	-176.5	0	0	0	0	111.6	E163 L167	E163-V165 PolarHBondContact O-N 3.19Å; V165-L167 HydrophobicContact CG1-CD2 4.18Å; V165-L167 PolarHBondContact O-N 3.39Å; V165-L167 VanDerWaalsContact O-N 3.09Å
166	R	28.8	Very low	33	Very low	234 Å²	234	133.1 Å²	133.1	88%	0.883	73%	0.733	S	S	*	*			trans	-69.1	99.4	167.6	-79.2	-177.3	165.9	117.8	-6.4	110.1	T164 S168	T164-R166 PolarHBondContact O-N 3.38Å; R166-S168 PolarHBondContact O-N 2.93Å
167	L	27.8	Very low	33.3	Very low	142 Å²	142	132 Å²	132	74%	0.743	74%	0.736	S	S	*	*			trans	-72.6	86.1	174.1	-68.5	176.9	0	0	0	112	V165 I169	V165-L167 HydrophobicContact CG1-CD2 4.18Å; V165-L167 PolarHBondContact O-N 3.39Å; V165-L167 VanDerWaalsContact O-N 3.09Å; L167-I169 HydrophobicContact CB-CG1 4.37Å; L167-I169 PolarHBondContact O-N 2.82Å; L167-I169 VanDerWaalsContact O-N 3.1Å
168	S	26.7	Very low	33.4	Very low	112 Å²	112	129 Å²	129	78%	0.783	73%	0.725	S	S	*	*			trans	-70.7	90.7	162.1	-66.7	0	0	0	0	109.7	R166 E170	R166-S168 PolarHBondContact O-N 2.93Å; S168-E170 PolarHBondContact O-N 3.34Å
169	I	32.6	Very low	33.9	Very low	106 Å²	106	129.7 Å²	129.7	54%	0.544	71%	0.713	S	S	.	*			trans	-80.1	115.5	179.1	-56.3	173.2	0	0	0	110	L167 F171	L167-I169 HydrophobicContact CB-CG1 4.37Å; L167-I169 PolarHBondContact O-N 2.82Å; L167-I169 VanDerWaalsContact O-N 3.1Å; I169-F171 HydrophobicContact CB-CD2 3.94Å; I169-F171 HydrophobicContact CB-CE2 3.58Å; I169-F171 HydrophobicContact CB-CZ 4.16Å; I169-F171 HydrophobicContact CD1-CE2 4.21Å; I169-F171 HydrophobicContact CD1-CZ 4.19Å; I169-F171 HydrophobicContact CG1-CE2 4.48Å; I169-F171 HydrophobicContact CG2-CD1 4.28Å; I169-F171 HydrophobicContact CG2-CD2 3.72Å; I169-F171 HydrophobicContact CG2-CE1 4.06Å; I169-F171 HydrophobicContact CG2-CE2 3.48Å; I169-F171 VanDerWaalsContact CG2-CE2 3.48Å; I169-F171 HydrophobicContact CG2-CG 4.12Å; I169-F171 HydrophobicContact CG2-CZ 3.66Å; I169-F171 WeakPolarHBondContact O-CD2 3.39Å; I169-F171 PolarHBondContact O-N 3.47Å
170	E	28	Very low	34.3	Very low	187 Å²	187	130 Å²	130	87%	0.874	72%	0.715	S	S	*	*			trans	-76.1	87.7	175.3	-61.8	-167.5	138.5	0	0	111.2	S168 G172	S168-E170 PolarHBondContact O-N 3.34Å; E170-G172 PolarHBondContact O-N 3.18Å
171	F	36.6	Very low	34.7	Very low	148 Å²	148	126.1 Å²	126.1	65%	0.649	70%	0.7	S	S	*	*			trans	-75.4	50.4	-179	-78.3	-77.3	0	0	0	114.3	I169	I169-F171 HydrophobicContact CB-CD2 3.94Å; I169-F171 HydrophobicContact CB-CE2 3.58Å; I169-F171 HydrophobicContact CB-CZ 4.16Å; I169-F171 HydrophobicContact CD1-CE2 4.21Å; I169-F171 HydrophobicContact CD1-CZ 4.19Å; I169-F171 HydrophobicContact CG1-CE2 4.48Å; I169-F171 HydrophobicContact CG2-CD1 4.28Å; I169-F171 HydrophobicContact CG2-CD2 3.72Å; I169-F171 HydrophobicContact CG2-CE1 4.06Å; I169-F171 HydrophobicContact CG2-CE2 3.48Å; I169-F171 VanDerWaalsContact CG2-CE2 3.48Å; I169-F171 HydrophobicContact CG2-CG 4.12Å; I169-F171 HydrophobicContact CG2-CZ 3.66Å; I169-F171 WeakPolarHBondContact O-CD2 3.39Å; I169-F171 PolarHBondContact O-N 3.47Å
172	G	37	Very low	34.8	Very low	52 Å²	52	125.2 Å²	125.2	54%	0.536	68%	0.684	S	S	.	*			trans	-65.7	-73.7	-178	0	0	0	0	0	114.4	E170	E170-G172 PolarHBondContact O-N 3.18Å
173	D	35.5	Very low	35.4	Very low	152 Å²	152	124.5 Å²	124.5	81%	0.813	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-94.2	-19	-151.7	-60.6	-66.3	0	0	0	116.6	M175	D173-M175 VanDerWaalsContact C-N 3.3Å; D173-M175 PolarHBondContact O-N 3.08Å
174	T	43.5	Very low	35.9	Very low	108 Å²	108	121.4 Å²	121.4	66%	0.663	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-79.2	-10.6	-174.5	56.3	0	0	0	0	114.2	N176	T174-N176 PolarHBondContact O-N 2.94Å
175	M	35.4	Very low	36.5	Very low	91 Å²	91	121.1 Å²	121.1	45%	0.448	66%	0.664	S	S	.	*	G	3₁₀ helix	trans	-64.8	-8.2	-174.3	-83.6	-88.4	-90.9	0	0	115.6	D173 K179 F182	D173-M175 VanDerWaalsContact C-N 3.3Å; D173-M175 PolarHBondContact O-N 3.08Å; M175-K179 VanDerWaalsContact O-CE 3.3Å; M175-K179 WeakPolarHBondContact O-CE 3.4Å; M175-K179 WeakPolarHBondContact O-CG 3.48Å; M175-F182 HydrophobicContact CE-CE1 4.36Å
176	N	37.3	Very low	36.9	Very low	120 Å²	120	119.9 Å²	119.9	64%	0.642	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-74.4	-28.7	-176.6	-84.5	-48.2	0	0	0	114.9	T174 K179	T174-N176 PolarHBondContact O-N 2.94Å; N176-K179 PolarHBondContact OD1-NZ 3.41Å
177	S	39.8	Very low	37.2	Very low	108 Å²	108	113.9 Å²	113.9	76%	0.755	64%	0.644	S	S	*	*	S	Bend	trans	-87.9	-17.2	-173.9	-162.3	0	0	0	0	115
178	L	36.9	Very low	37.7	Very low	120 Å²	120	111.4 Å²	111.4	63%	0.628	63%	0.632	S	S	*	*			trans	-101.1	3.4	-169.3	-68.6	169.1	0	0	0	114.8	S180 S181	L178-S180 PolarHBondContact O-N 3.21Å; L178-S181 PolarHBondContact O-N 3.26Å
179	K	39.9	Very low	38.2	Very low	132 Å²	132	112.2 Å²	112.2	57%	0.574	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-16.2	-168.7	-69.3	176.8	171.4	172	0	115.4	M175 N176	M175-K179 VanDerWaalsContact O-CE 3.3Å; M175-K179 WeakPolarHBondContact O-CE 3.4Å; M175-K179 WeakPolarHBondContact O-CG 3.48Å; N176-K179 PolarHBondContact OD1-NZ 3.41Å
180	S	42	Very low	38.6	Very low	110 Å²	110	112.1 Å²	112.1	77%	0.769	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-31.6	178.6	52.6	0	0	0	0	114.4	L178	L178-S180 PolarHBondContact O-N 3.21Å
181	S	42.7	Very low	39.3	Very low	73 Å²	73	110.2 Å²	110.2	51%	0.51	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.2	-23.1	-179.4	-66.5	0	0	0	0	113.5	L178 V183 S184	L178-S181 PolarHBondContact O-N 3.26Å; S181-V183 PolarHBondContact O-N 3.47Å; S181-V183 VanDerWaalsContact O-N 3.13Å; S181-S184 PolarHBondContact O-N 3.09Å; S181-S184 PolarHBondContact O-OG 3.18Å
182	F	35.5	Very low	39.6	Very low	79 Å²	79	111.1 Å²	111.1	35%	0.346	63%	0.628	S	S	.	*	H	α-helix	trans	-63	-26.2	-169.7	-163.6	-128.8	0	0	0	114	M175 S184 M185 L186	M175-F182 HydrophobicContact CE-CE1 4.36Å; F182-S184 PolarHBondContact O-N 3.04Å; F182-M185 HydrophobicContact CD2-CB 4.33Å; F182-M185 PolarHBondContact O-N 3.39Å; F182-L186 HydrophobicContact CD1-CD1 3.58Å; F182-L186 HydrophobicContact CD1-CD2 4.2Å; F182-L186 HydrophobicContact CD1-CG 3.73Å; F182-L186 HydrophobicContact CE1-CD1 3.82Å; F182-L186 HydrophobicContact CE1-CD2 3.6Å; F182-L186 HydrophobicContact CE1-CG 3.66Å; F182-L186 HydrophobicContact CG-CD1 4.32Å; F182-L186 HydrophobicContact CG-CG 4.25Å; F182-L186 HydrophobicContact CZ-CD2 3.9Å; F182-L186 HydrophobicContact CZ-CG 4.11Å; F182-L186 WeakPolarHBondContact O-CG 3.45Å; F182-L186 PolarHBondContact O-N 2.88Å
183	V	44.6	Very low	39.6	Very low	117 Å²	117	112.5 Å²	112.5	71%	0.709	63%	0.63	S	S	*	*	H	α-helix	trans	-60.4	-28.9	179.1	-176	0	0	0	0	113.1	S181	S181-V183 PolarHBondContact O-N 3.47Å; S181-V183 VanDerWaalsContact O-N 3.13Å
184	S	43.3	Very low	39.7	Very low	99 Å²	99	109.1 Å²	109.1	69%	0.692	63%	0.631	S	S	*	*	H	α-helix	trans	-83.5	-18.8	173.4	46	0	0	0	0	114.3	S181 F182 P187	S181-S184 PolarHBondContact O-N 3.09Å; S181-S184 PolarHBondContact O-OG 3.18Å; F182-S184 PolarHBondContact O-N 3.04Å; S184-P187 WeakPolarHBondContact O-CD 3.47Å
185	M	40.9	Very low	39.4	Very low	140 Å²	140	110.7 Å²	110.7	69%	0.69	64%	0.635	S	S	*	*	H	α-helix	trans	-92.7	-14	178.4	-70.3	174	161	0	0	113.1	F182 P187	F182-M185 HydrophobicContact CD2-CB 4.33Å; F182-M185 PolarHBondContact O-N 3.39Å; M185-P187 WeakPolarHBondContact O-CD 3.39Å
186	L	39.8	Very low	39.3	Very low	87 Å²	87	115.3 Å²	115.3	46%	0.455	65%	0.647	S	S	.	*			trans	-70.5	-7.6	-177.3	-90.4	169.3	0	0	0	119.3	F182 N188	F182-L186 HydrophobicContact CD1-CD1 3.58Å; F182-L186 HydrophobicContact CD1-CD2 4.2Å; F182-L186 HydrophobicContact CD1-CG 3.73Å; F182-L186 HydrophobicContact CE1-CD1 3.82Å; F182-L186 HydrophobicContact CE1-CD2 3.6Å; F182-L186 HydrophobicContact CE1-CG 3.66Å; F182-L186 HydrophobicContact CG-CD1 4.32Å; F182-L186 HydrophobicContact CG-CG 4.25Å; F182-L186 HydrophobicContact CZ-CD2 3.9Å; F182-L186 HydrophobicContact CZ-CG 4.11Å; F182-L186 WeakPolarHBondContact O-CG 3.45Å; F182-L186 PolarHBondContact O-N 2.88Å; L186-N188 VanDerWaalsContact C-N 3.35Å; L186-N188 PolarHBondContact O-N 3.16Å
187	P	35.5	Very low	39.3	Very low	108 Å²	108	114.1 Å²	114.1	70%	0.701	65%	0.647	S	S	*	*	S	Bend	trans	-90.6	42.6	-178.5	37.5	-35.5	0	0	0	114.6	S184 M185	S184-P187 WeakPolarHBondContact O-CD 3.47Å; M185-P187 WeakPolarHBondContact O-CD 3.39Å
188	N	38.7	Very low	39.1	Very low	90 Å²	90	119 Å²	119	48%	0.481	65%	0.654	S	S	.	*	S	Bend	trans	-147.7	-14	172	-141.7	23.4	0	0	0	117.1	L186 S190 K191	L186-N188 VanDerWaalsContact C-N 3.35Å; L186-N188 PolarHBondContact O-N 3.16Å; N188-S190 VanDerWaalsContact C-N 3.28Å; N188-S190 PolarHBondContact O-N 2.75Å; N188-K191 WeakPolarHBondContact OD1-CE 3.34Å; N188-K191 PolarHBondContact OD1-NZ 3.24Å
189	M	36.4	Very low	39.1	Very low	130 Å²	130	120.7 Å²	120.7	64%	0.64	66%	0.663	S	S	*	*	S	Bend	trans	-67.5	-23.7	-173.3	-59.7	-90.9	63.2	0	0	114.3	K191	M189-K191 PolarHBondContact O-N 2.96Å
190	S	42	Very low	38.9	Very low	104 Å²	104	123.9 Å²	123.9	73%	0.727	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	37.4	-177.9	-173.8	0	0	0	0	114.2	N188	N188-S190 VanDerWaalsContact C-N 3.28Å; N188-S190 PolarHBondContact O-N 2.75Å
191	K	41.7	Very low	38.8	Very low	147 Å²	147	122.1 Å²	122.1	64%	0.639	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.8	-13.2	-176.3	-73.7	-179.4	-178	164.1	0	115.4	N188 M189	N188-K191 WeakPolarHBondContact OD1-CE 3.34Å; N188-K191 PolarHBondContact OD1-NZ 3.24Å; M189-K191 PolarHBondContact O-N 2.96Å
192	H	42.6	Very low	38.5	Very low	166 Å²	166	130.1 Å²	130.1	77%	0.769	68%	0.682	S	S	*	*	S	Bend	trans	-118.5	6	-170.9	-70.7	-75.9	0	0	0	114.3
193	S	37.4	Very low	38.5	Very low	82 Å²	82	130.6 Å²	130.6	57%	0.573	69%	0.688	S	S	*	*			trans	-143.4	145.2	169.4	52	0	0	0	0	109.5	D195	S193-D195 VanDerWaalsContact C-N 3.32Å
194	G	37.4	Very low	38.1	Very low	81 Å²	81	129.7 Å²	129.7	84%	0.835	69%	0.687	S	S	*	*	S	Bend	trans	-72.6	-25.4	-178.6	0	0	0	0	0	113.6	R196	G194-R196 PolarHBondContact O-N 3.01Å
195	D	37.6	Very low	38.2	Very low	140 Å²	140	130.4 Å²	130.4	75%	0.749	69%	0.692	S	S	*	*			trans	-68	114.1	-179.6	-65	-74.6	0	0	0	112.2	S193 P197	S193-D195 VanDerWaalsContact C-N 3.32Å; D195-P197 WeakPolarHBondContact O-CD 3.44Å
196	R	33.9	Very low	38.5	Very low	188 Å²	188	130.6 Å²	130.6	71%	0.709	70%	0.695	S	S	*	*			trans	-98.8	105.4	176.3	-170.7	-171.6	-162	178.4	12.1	109.9	G194 K198	G194-R196 PolarHBondContact O-N 3.01Å; R196-K198 PolarHBondContact O-N 3.13Å
197	P	37.2	Very low	39.1	Very low	96 Å²	96	129.1 Å²	129.1	62%	0.623	69%	0.692	S	S	*	*			trans	-60.4	136.9	176.4	-21.2	33.7	0	0	0	110.4	D195 L199	D195-P197 WeakPolarHBondContact O-CD 3.44Å; P197-L199 HydrophobicContact CB-CG 4.4Å; P197-L199 PolarHBondContact O-N 3.01Å
198	K	34.7	Very low	40.2	Very low	211 Å²	211	129.8 Å²	129.8	92%	0.917	70%	0.696	S	S	*	*			trans	-72.9	58.9	-179.8	-68.5	-179.5	179.6	173.8	0	112.1	R196 K200	R196-K198 PolarHBondContact O-N 3.13Å; K198-K200 PolarHBondContact O-N 2.96Å
199	L	36.8	Very low	41.3	Very low	154 Å²	154	126.6 Å²	126.6	81%	0.806	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-66.6	123.5	175.5	-70.2	171.9	0	0	0	110.4	P197	P197-L199 HydrophobicContact CB-CG 4.4Å; P197-L199 PolarHBondContact O-N 3.01Å
200	K	37.3	Very low	42.7	Very low	199 Å²	199	122.1 Å²	122.1	87%	0.865	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-58	135.4	-172.3	-61.1	-176.2	-179.8	-176.1	0	111.5	K198 R202	K198-K200 PolarHBondContact O-N 2.96Å; K200-R202 PolarHBondContact O-N 3.2Å
201	P	39.7	Very low	43.9	Very low	73 Å²	73	120.3 Å²	120.3	47%	0.474	66%	0.655	S	S	.	*	P	Polyproline II helix	trans	-68	127.6	-177	27.3	-33.9	0	0	0	111.4	N203	P201-N203 HydrophobicContact CB-CB 4.46Å; P201-N203 PolarHBondContact O-N 3.23Å
202	R	35.9	Very low	45.1	Very low	241 Å²	241	116.6 Å²	116.6	91%	0.909	65%	0.651	S	S	*	*			trans	-79.4	54.7	178.6	-163.6	-178.4	179.7	168.4	2.1	111.9	K200	K200-R202 PolarHBondContact O-N 3.2Å
203	N	34.9	Very low	46.6	Very low	90 Å²	90	108.7 Å²	108.7	48%	0.481	62%	0.615	S	S	.	*			trans	-107.9	59.8	-170.1	-74.1	-5.8	0	0	0	112.4	P201	P201-N203 HydrophobicContact CB-CB 4.46Å; P201-N203 PolarHBondContact O-N 3.23Å
204	S	37.5	Very low	48.2	Very low	97 Å²	97	109.8 Å²	109.8	68%	0.678	61%	0.611	S	S	*	*			trans	-99.3	119	177.9	59.1	0	0	0	0	112.4
205	S	44.3	Very low	50.1	Low	114 Å²	114	113.6 Å²	113.6	80%	0.797	60%	0.604	S	S	*	*	S	Bend	trans	63.9	167.4	176.2	75.6	0	0	0	0	116.9	S207	S205-S207 PolarHBondContact O-N 2.9Å; S205-S207 VanDerWaalsContact O-N 3.08Å
206	L	47.7	Very low	52.1	Low	145 Å²	145	109 Å²	109	76%	0.759	58%	0.577	S	S	*	*			trans	-69.8	102.4	-172.4	-77.9	66.7	0	0	0	111
207	S	53.2	Low	54.4	Low	56 Å²	56	100.4 Å²	100.4	39%	0.392	55%	0.546	S	S	.	.			trans	-68.2	128.9	173.3	62	0	0	0	0	110.6	S205 G209 L210	S205-S207 PolarHBondContact O-N 2.9Å; S205-S207 VanDerWaalsContact O-N 3.08Å; S207-G209 PolarHBondContact O-N 2.85Å; S207-L210 PolarHBondContact O-N 2.82Å
208	P	57.8	Low	56.5	Low	121 Å²	121	99.5 Å²	99.5	79%	0.786	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-56.1	-20.8	-177.6	-29.8	36.2	0	0	0	115.5	L210 A211	P208-L210 PolarHBondContact O-N 3.04Å; P208-A211 PolarHBondContact O-N 3.32Å
209	G	61.2	Low	58.7	Low	24 Å²	24	92.9 Å²	92.9	25%	0.247	51%	0.512	C	S	.	.	G	3₁₀ helix	trans	-63.8	-16.9	173.9	0	0	0	0	0	115	S207	S207-G209 PolarHBondContact O-N 2.85Å
210	L	65.6	Low	60.7	Low	35 Å²	35	86.3 Å²	86.3	18%	0.183	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-70.8	-41	177.6	-175.4	62.3	0	0	0	111.7	S207 P208 A212 V213 Q214 V219 L229 V241	S207-L210 PolarHBondContact O-N 2.82Å; P208-L210 PolarHBondContact O-N 3.04Å; L210-A212 VanDerWaalsContact C-N 3.28Å; L210-A212 PolarHBondContact O-N 2.78Å; L210-V213 HydrophobicContact CD1-CG2 4.18Å; L210-V213 VanDerWaalsContact O-CG2 3.28Å; L210-V213 WeakPolarHBondContact O-CG2 3.35Å; L210-V213 PolarHBondContact O-N 3.19Å; L210-Q214 HydrophobicContact CG-CG 4.37Å; L210-Q214 WeakPolarHBondContact O-CG 3.47Å; L210-Q214 PolarHBondContact O-N 3.43Å; L210-V219 HydrophobicContact CD1-CG2 4.5Å; L210-L229 HydrophobicContact CD1-CD1 4.37Å; L210-L229 HydrophobicContact CD1-CD2 3.79Å; L210-V241 HydrophobicContact CB-CG1 4.31Å; L210-V241 HydrophobicContact CD1-CG2 4.5Å
211	A	67.5	Low	62.6	Low	67 Å²	67	86 Å²	86	55%	0.554	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-58.4	-41.7	178.9	0	0	0	0	0	112	P208 V213 Q214	P208-A211 PolarHBondContact O-N 3.32Å; A211-V213 PolarHBondContact O-N 3.42Å; A211-V213 VanDerWaalsContact O-N 3.12Å; A211-Q214 PolarHBondContact O-N 3.14Å
212	A	67.2	Low	63.9	Low	68 Å²	68	86.7 Å²	86.7	56%	0.562	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-65.7	-11.9	177.6	0	0	0	0	0	114.7	L210	L210-A212 VanDerWaalsContact C-N 3.28Å; L210-A212 PolarHBondContact O-N 2.78Å
213	V	73.3	Confident	65.4	Low	1 Å²	1	82.6 Å²	82.6	1%	0.006	48%	0.475	C	S	.	.	G	3₁₀ helix	trans	-119.5	-7.1	178.8	-59.4	0	0	0	0	114.3	L210 A211 K215 Y216 A217 V241 F244 R245 T248	L210-V213 HydrophobicContact CD1-CG2 4.18Å; L210-V213 VanDerWaalsContact O-CG2 3.28Å; L210-V213 WeakPolarHBondContact O-CG2 3.35Å; L210-V213 PolarHBondContact O-N 3.19Å; A211-V213 PolarHBondContact O-N 3.42Å; A211-V213 VanDerWaalsContact O-N 3.12Å; V213-K215 PolarHBondContact O-N 3.08Å; V213-K215 VanDerWaalsContact O-N 3.12Å; V213-Y216 PolarHBondContact O-N 2.99Å; V213-A217 WeakPolarHBondContact O-CB 3.47Å; V213-A217 PolarHBondContact O-N 3.4Å; V213-A217 VanDerWaalsContact O-N 3.1Å; V213-V241 HydrophobicContact CG2-CG1 4.45Å; V213-F244 HydrophobicContact CB-CD1 3.77Å; V213-F244 HydrophobicContact CB-CE1 4.04Å; V213-F244 HydrophobicContact CG1-CD1 4.32Å; V213-F244 HydrophobicContact CG2-CD1 3.83Å; V213-F244 HydrophobicContact CG2-CE1 4.36Å; V213-R245 HydrophobicContact CG1-CB 3.86Å; V213-R245 HydrophobicContact CG1-CG 3.96Å; V213-T248 HydrophobicContact CB-CG2 4.34Å; V213-T248 HydrophobicContact CG1-CG2 4.33Å
214	Q	72.7	Confident	66.9	Low	104 Å²	104	85.3 Å²	85.3	49%	0.486	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-29.3	179.1	-90.2	172.8	-36.1	0	0	113.7	L210 A211 Y216 A217	L210-Q214 HydrophobicContact CG-CG 4.37Å; L210-Q214 WeakPolarHBondContact O-CG 3.47Å; L210-Q214 PolarHBondContact O-N 3.43Å; A211-Q214 PolarHBondContact O-N 3.14Å; Q214-Y216 PolarHBondContact O-N 3.37Å; Q214-A217 PolarHBondContact O-N 2.62Å
215	K	76.5	Confident	68.5	Low	162 Å²	162	82.9 Å²	82.9	70%	0.704	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-44.4	172.5	-174.6	170.8	-176.3	172.6	0	111.7	V213 K232	V213-K215 PolarHBondContact O-N 3.08Å; V213-K215 VanDerWaalsContact O-N 3.12Å; K215-K232 PolarHBondContact O-NZ 3.27Å; K215-K232 VanDerWaalsContact O-NZ 3.13Å
216	Y	79	Confident	70	Confident	44 Å²	44	79.1 Å²	79.1	17%	0.173	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-11.7	-175.4	-58.5	-75.9	0	0	0	114.5	V213 Q214 C231 K232 L233 T248 H251 E252	V213-Y216 PolarHBondContact O-N 2.99Å; Q214-Y216 PolarHBondContact O-N 3.37Å; Y216-C231 WeakPolarHBondContact O-CA 3.45Å; Y216-K232 PolarHBondContact O-N 3.33Å; Y216-L233 HydrophobicContact CD1-CD1 3.65Å; Y216-L233 HydrophobicContact CD1-CG 4.37Å; Y216-L233 HydrophobicContact CE1-CD1 3.78Å; Y216-T248 HydrophobicContact CD2-CG2 3.71Å; Y216-T248 HydrophobicContact CG-CG2 3.86Å; Y216-H251 HydrophobicContact CE1-CB 4.5Å; Y216-E252 HydrophobicContact CE2-CG 4.3Å
217	A	83.3	Confident	71.3	Confident	7 Å²	7	77.7 Å²	77.7	6%	0.058	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	137.7	-171.9	0	0	0	0	0	113.4	V213 Q214 V219 L229 K232 F244	V213-A217 WeakPolarHBondContact O-CB 3.47Å; V213-A217 PolarHBondContact O-N 3.4Å; V213-A217 VanDerWaalsContact O-N 3.1Å; Q214-A217 PolarHBondContact O-N 2.62Å; A217-V219 HydrophobicContact CB-CG2 4.45Å; A217-L229 HydrophobicContact CB-CD2 4.43Å; A217-K232 VanDerWaalsContact O-CE 3.27Å; A217-K232 WeakPolarHBondContact O-CE 3.15Å; A217-F244 HydrophobicContact CB-CD1 4.28Å; A217-F244 HydrophobicContact CB-CE1 3.57Å; A217-F244 HydrophobicContact CB-CZ 3.76Å
218	I	81	Confident	72.7	Confident	77 Å²	77	77.9 Å²	77.9	40%	0.395	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	124.8	154.9	-55.6	175.1	0	0	0	105.8	L229 K230 K232	I218-L229 WeakPolarHBondContact O-CA 3.2Å; I218-K230 HydrophobicContact CB-CB 4.32Å; I218-K230 PolarHBondContact N-O 2.72Å; I218-K230 PolarHBondContact O-N 3.42Å; I218-K232 HydrophobicContact CD1-CG 4.19Å; I218-K232 HydrophobicContact CG1-CG 3.68Å
219	V	81	Confident	73.9	Confident	72 Å²	72	72.4 Å²	72.4	44%	0.436	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	116.3	-177	-171.5	0	0	0	0	109.6	L210 A217 W228 L229	L210-V219 HydrophobicContact CD1-CG2 4.5Å; A217-V219 HydrophobicContact CB-CG2 4.45Å; V219-W228 WeakPolarHBondContact CA-O 3.48Å; V219-L229 HydrophobicContact CB-CD2 4.27Å; V219-L229 HydrophobicContact CG1-CD2 4.06Å; V219-L229 HydrophobicContact CG2-CD2 3.76Å
220	G	78.2	Confident	75.1	Confident	15 Å²	15	75 Å²	75	16%	0.155	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	-179.1	175.2	0	0	0	0	0	113.1	K227 W228	G220-K227 WeakPolarHBondContact O-CA 3.46Å; G220-W228 VanDerWaalsContact C-CD1 3.42Å; G220-W228 PolarHBondContact N-O 2.94Å; G220-W228 PolarHBondContact O-N 2.98Å
221	R	77.6	Confident	76.1	Confident	193 Å²	193	73.7 Å²	73.7	73%	0.728	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.4	148.1	169.6	-49.8	-178.7	-154.4	171	9.6	108.8	D226 K227 W228	R221-D226 CarbonylContact C-O 3.49Å; R221-D226 WeakPolarHBondContact CA-O 3.43Å; R221-K227 HydrophobicContact CG-CG 4.44Å; R221-W228 VanDerWaalsContact C-CD1 3.41Å; R221-W228 PolarHBondContact O-NE1 3.24Å
222	N	67.3	Low	76.9	Confident	88 Å²	88	76.3 Å²	76.3	47%	0.471	39%	0.392	S	S	.	.			trans	-82.1	167.4	164	-70.6	34.2	0	0	0	109.4	N224 G225 D226	N222-N224 PolarHBondContact O-N 2.69Å; N222-N224 VanDerWaalsContact O-N 3.15Å; N222-G225 WeakPolarHBondContact O-CA 3.3Å; N222-G225 PolarHBondContact O-N 2.92Å; N222-D226 PolarHBondContact N-O 3.16Å
223	V	65.7	Low	77.7	Confident	154 Å²	154	78.1 Å²	78.1	93%	0.933	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	-39.9	169.2	-175	0	0	0	0	111.4	G225	V223-G225 PolarHBondContact O-N 3.48Å
224	N	67.4	Low	78.4	Confident	147 Å²	147	80 Å²	80	79%	0.786	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	10.4	177.6	-56.2	-2.4	0	0	0	114.6	N222 D226	N222-N224 PolarHBondContact O-N 2.69Å; N222-N224 VanDerWaalsContact O-N 3.15Å; N224-D226 PolarHBondContact O-N 3.22Å
225	G	70.1	Confident	79	Confident	47 Å²	47	81.1 Å²	81.1	49%	0.485	42%	0.421	S	S	.	.	S	Bend	trans	70.6	-11.6	-175.3	0	0	0	0	0	115.9	N222 V223 K227	N222-G225 WeakPolarHBondContact O-CA 3.3Å; N222-G225 PolarHBondContact O-N 2.92Å; V223-G225 PolarHBondContact O-N 3.48Å; G225-K227 PolarHBondContact O-N 2.83Å
226	D	76	Confident	79.5	Confident	34 Å²	34	77.2 Å²	77.2	18%	0.182	40%	0.402	C	S	.	.			trans	-61.4	127.2	-179.8	-135.7	7.2	0	0	0	110.1	R221 N222 N224 K239	R221-D226 CarbonylContact C-O 3.49Å; R221-D226 WeakPolarHBondContact CA-O 3.43Å; N222-D226 PolarHBondContact N-O 3.16Å; N224-D226 PolarHBondContact O-N 3.22Å; D226-K239 IonicContact OD2-NZ 2.72Å; D226-K239 PolarHBondContact OD2-NZ 2.8Å
227	K	75.5	Confident	79.8	Confident	116 Å²	116	79.8 Å²	79.8	50%	0.504	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	136.2	-173.9	-67.9	-179	179.6	179.9	0	112	G220 R221 G225 K239	G220-K227 WeakPolarHBondContact O-CA 3.46Å; R221-K227 HydrophobicContact CG-CG 4.44Å; G225-K227 PolarHBondContact O-N 2.83Å; K227-K239 WeakPolarHBondContact O-CA 3.44Å; K227-K239 WeakPolarHBondContact O-CB 3.14Å
228	W	82.2	Confident	79.9	Confident	59 Å²	59	80.3 Å²	80.3	22%	0.223	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	157.2	174.9	56.6	-86.1	0	0	0	112.8	V219 G220 R221 K230 L237	V219-W228 WeakPolarHBondContact CA-O 3.48Å; G220-W228 VanDerWaalsContact C-CD1 3.42Å; G220-W228 PolarHBondContact N-O 2.94Å; G220-W228 PolarHBondContact O-N 2.98Å; R221-W228 VanDerWaalsContact C-CD1 3.41Å; R221-W228 PolarHBondContact O-NE1 3.24Å; W228-K230 HydrophobicContact CE3-CB 3.83Å; W228-K230 HydrophobicContact CZ3-CB 3.52Å; W228-K230 HydrophobicContact CZ3-CD 3.91Å; W228-K230 HydrophobicContact CZ3-CG 4.37Å; W228-L237 HydrophobicContact CB-CD2 4.33Å; W228-L237 HydrophobicContact CD2-CD1 4.17Å; W228-L237 HydrophobicContact CE3-CD1 3.61Å; W228-L237 HydrophobicContact CE3-CG 4.17Å; W228-L237 HydrophobicContact CZ3-CD1 4.01Å
229	L	84.2	Confident	80	Confident	6 Å²	6	80.6 Å²	80.6	3%	0.031	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	107	-178.7	-56.3	174.4	0	0	0	108.3	L210 A217 I218 V219 L237 T238 V241 F244	L210-L229 HydrophobicContact CD1-CD1 4.37Å; L210-L229 HydrophobicContact CD1-CD2 3.79Å; A217-L229 HydrophobicContact CB-CD2 4.43Å; I218-L229 WeakPolarHBondContact O-CA 3.2Å; V219-L229 HydrophobicContact CB-CD2 4.27Å; V219-L229 HydrophobicContact CG1-CD2 4.06Å; V219-L229 HydrophobicContact CG2-CD2 3.76Å; L229-L237 CarbonylContact O-C 3.25Å; L229-L237 WeakPolarHBondContact O-CA 3.31Å; L229-T238 HydrophobicContact CB-CG2 4.46Å; L229-T238 PolarHBondContact N-O 2.96Å; L229-T238 PolarHBondContact O-N 2.72Å; L229-V241 HydrophobicContact CD1-CB 4.38Å; L229-V241 HydrophobicContact CD1-CG2 4.16Å; L229-F244 HydrophobicContact CB-CB 4.24Å; L229-F244 HydrophobicContact CB-CD2 3.57Å; L229-F244 HydrophobicContact CB-CE2 4.1Å; L229-F244 HydrophobicContact CB-CG 3.88Å; L229-F244 HydrophobicContact CD1-CB 3.65Å; L229-F244 HydrophobicContact CD1-CD1 4.5Å; L229-F244 HydrophobicContact CD1-CD2 4.49Å; L229-F244 HydrophobicContact CD1-CG 3.96Å
230	K	85.1	Confident	80	Confident	80 Å²	80	81.5 Å²	81.5	35%	0.348	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	143.2	171.7	177.8	175.2	-178.5	175.6	0	108.8	I218 W228 Y236 L237	I218-K230 HydrophobicContact CB-CB 4.32Å; I218-K230 PolarHBondContact N-O 2.72Å; I218-K230 PolarHBondContact O-N 3.42Å; W228-K230 HydrophobicContact CE3-CB 3.83Å; W228-K230 HydrophobicContact CZ3-CB 3.52Å; W228-K230 HydrophobicContact CZ3-CD 3.91Å; W228-K230 HydrophobicContact CZ3-CG 4.37Å; K230-Y236 CarbonylContact C-O 3.53Å; K230-Y236 WeakPolarHBondContact CA-O 3.18Å; K230-L237 HydrophobicContact CB-CD1 4.39Å
231	C	87.9	Confident	80.3	Confident	6 Å²	6	82.7 Å²	82.7	4%	0.041	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	139.2	178.3	-169.3	0	0	0	0	111	Y216 L233 C234 Y236 F244 H247 H251	Y216-C231 WeakPolarHBondContact O-CA 3.45Å; C231-L233 PolarHBondContact O-N 3.09Å; C231-L233 PolarHBondContact SG-N 3.12Å; C231-L233 VanDerWaalsContact SG-N 3.4Å; C231-C234 VanDerWaalsContact O-O 3.05Å; C231-Y236 PolarHBondContact N-O 3.02Å; C231-F244 HydrophobicContact CB-CE2 3.96Å; C231-F244 HydrophobicContact CB-CZ 4.11Å; C231-H247 WeakPolarHBondContact CB-NE2 3.3Å; C231-H247 PolarHBondContact SG-NE2 3.16Å; C231-H247 VanDerWaalsContact SG-NE2 3.43Å; C231-H251 PolarHBondContact SG-NE2 3.14Å
232	K	83.5	Confident	80.5	Confident	123 Å²	123	79.6 Å²	79.6	54%	0.535	42%	0.416	S	S	.	.	S	Bend	trans	-69.4	-19.9	172	-65.5	178.5	-173.2	168.3	0	113.6	K215 Y216 A217 I218	K215-K232 PolarHBondContact O-NZ 3.27Å; K215-K232 VanDerWaalsContact O-NZ 3.13Å; Y216-K232 PolarHBondContact O-N 3.33Å; A217-K232 VanDerWaalsContact O-CE 3.27Å; A217-K232 WeakPolarHBondContact O-CE 3.15Å; I218-K232 HydrophobicContact CD1-CG 4.19Å; I218-K232 HydrophobicContact CG1-CG 3.68Å
233	L	84.7	Confident	81.3	Confident	105 Å²	105	77 Å²	77	55%	0.55	41%	0.406	S	S	.	.	S	Bend	trans	-106.1	-6.4	-172.1	-60.1	179.6	0	0	0	114.3	Y216 C231 H251	Y216-L233 HydrophobicContact CD1-CD1 3.65Å; Y216-L233 HydrophobicContact CD1-CG 4.37Å; Y216-L233 HydrophobicContact CE1-CD1 3.78Å; C231-L233 PolarHBondContact O-N 3.09Å; C231-L233 PolarHBondContact SG-N 3.12Å; C231-L233 VanDerWaalsContact SG-N 3.4Å; L233-H251 HydrophobicContact CD1-CB 3.82Å
234	C	86.9	Confident	82.3	Confident	41 Å²	41	69.6 Å²	69.6	28%	0.277	36%	0.362	S	S	.	.	S	Bend	trans	-168.9	168.5	177.8	67.2	0	0	0	0	111.5	C231 Y236 H247 H251	C231-C234 VanDerWaalsContact O-O 3.05Å; C234-Y236 PolarHBondContact O-N 3.4Å; C234-H247 PolarHBondContact SG-CE1 2.8Å; C234-H247 PolarHBondContact SG-NE2 3.05Å; C234-H247 VanDerWaalsContact SG-NE2 3.4Å; C234-H251 VanDerWaalsContact SG-CE1 3.58Å; C234-H251 PolarHBondContact SG-NE2 3.11Å
235	P	86.4	Confident	83.1	Confident	127 Å²	127	68 Å²	68	83%	0.825	35%	0.345	S	S	*	.	S	Bend	trans	-64.8	6.3	-178.8	-23.9	35.6	0	0	0	117.3	L237	P235-L237 PolarHBondContact O-N 3.36Å
236	Y	86.8	Confident	83.8	Confident	80 Å²	80	68.5 Å²	68.5	31%	0.314	34%	0.338	S	S	.	.			trans	-68.8	124.8	-175.4	-177.6	-97.2	0	0	0	112.5	K230 C231 C234 T238 F244 H247	K230-Y236 CarbonylContact C-O 3.53Å; K230-Y236 WeakPolarHBondContact CA-O 3.18Å; C231-Y236 PolarHBondContact N-O 3.02Å; C234-Y236 PolarHBondContact O-N 3.4Å; Y236-T238 HydrophobicContact CE1-CG2 3.64Å; Y236-F244 HydrophobicContact CD1-CD2 4.2Å; Y236-F244 HydrophobicContact CD1-CE2 4.45Å; Y236-F244 HydrophobicContact CE1-CD2 4.22Å; Y236-H247 WeakPolarHBondContact CB-CE1 3.06Å; Y236-H247 HydrophobicContact CD1-CB 3.78Å; Y236-H247 AromaticContact CD1-CD2 3.46Å; Y236-H247 VanDerWaalsContact CD1-CD2 3.46Å; Y236-H247 WeakPolarHBondContact CD1-CD2 3.48Å; Y236-H247 AromaticContact CD1-CE1 3.84Å; Y236-H247 AromaticContact CD1-CG 3.26Å; Y236-H247 AromaticContact CD1-ND1 3.51Å; Y236-H247 AromaticContact CD1-NE2 3.82Å; Y236-H247 AromaticContact CD2-ND1 3.84Å; Y236-H247 HydrophobicContact CE1-CB 3.53Å; Y236-H247 AromaticContact CE1-CG 3.59Å; Y236-H247 HydrophobicContact CG-CB 4.45Å; Y236-H247 AromaticContact CG-CD2 3.99Å; Y236-H247 AromaticContact CG-CE1 3.55Å; Y236-H247 AromaticContact CG-CG 3.68Å; Y236-H247 AromaticContact CG-ND1 3.38Å; Y236-H247 AromaticContact CG-NE2 3.91Å
237	L	85.5	Confident	84.2	Confident	98 Å²	98	67.7 Å²	67.7	51%	0.513	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	139.4	177.3	-175.1	151	0	0	0	110.8	W228 L229 K230 P235	W228-L237 HydrophobicContact CB-CD2 4.33Å; W228-L237 HydrophobicContact CD2-CD1 4.17Å; W228-L237 HydrophobicContact CE3-CD1 3.61Å; W228-L237 HydrophobicContact CE3-CG 4.17Å; W228-L237 HydrophobicContact CZ3-CD1 4.01Å; L229-L237 CarbonylContact O-C 3.25Å; L229-L237 WeakPolarHBondContact O-CA 3.31Å; K230-L237 HydrophobicContact CB-CD1 4.39Å; P235-L237 PolarHBondContact O-N 3.36Å
238	T	84.9	Confident	84.6	Confident	18 Å²	18	62.3 Å²	62.3	11%	0.11	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	153.6	173.6	-170.7	0	0	0	0	112.9	L229 Y236 F240 A243 F244	L229-T238 HydrophobicContact CB-CG2 4.46Å; L229-T238 PolarHBondContact N-O 2.96Å; L229-T238 PolarHBondContact O-N 2.72Å; Y236-T238 HydrophobicContact CE1-CG2 3.64Å; T238-F240 PolarHBondContact OG1-N 3.23Å; T238-A243 HydrophobicContact CG2-CB 4.16Å; T238-F244 HydrophobicContact CG2-CB 3.72Å; T238-F244 HydrophobicContact CG2-CD2 4.06Å; T238-F244 HydrophobicContact CG2-CG 4.4Å
239	K	82.5	Confident	84.7	Confident	84 Å²	84	63.1 Å²	63.1	37%	0.365	32%	0.316	S	S	.	.	S	Bend	trans	-93	9.3	173.8	73.9	-179.1	-164.4	167.5	0	115.2	D226 K227	D226-K239 IonicContact OD2-NZ 2.72Å; D226-K239 PolarHBondContact OD2-NZ 2.8Å; K227-K239 WeakPolarHBondContact O-CA 3.44Å; K227-K239 WeakPolarHBondContact O-CB 3.14Å
240	F	81.7	Confident	84.5	Confident	91 Å²	91	68.1 Å²	68.1	40%	0.399	34%	0.338	S	S	.	.			trans	-124.1	118	-176.8	-59.2	-67.9	0	0	0	112.2	T238 Q242 A243 F244	T238-F240 PolarHBondContact OG1-N 3.23Å; F240-Q242 PolarHBondContact O-N 2.77Å; F240-A243 HydrophobicContact CB-CB 3.98Å; F240-A243 PolarHBondContact O-N 3.07Å; F240-F244 PolarHBondContact O-N 2.99Å
241	V	84.3	Confident	84.4	Confident	40 Å²	40	66.7 Å²	66.7	24%	0.242	33%	0.332	C	S	.	.	H	α-helix	trans	-52.8	-40.4	177.9	-173.7	0	0	0	0	112.2	L210 V213 L229 F244 R245	L210-V241 HydrophobicContact CB-CG1 4.31Å; L210-V241 HydrophobicContact CD1-CG2 4.5Å; V213-V241 HydrophobicContact CG2-CG1 4.45Å; L229-V241 HydrophobicContact CD1-CB 4.38Å; L229-V241 HydrophobicContact CD1-CG2 4.16Å; V241-F244 PolarHBondContact O-N 2.99Å; V241-R245 WeakPolarHBondContact O-CB 3.38Å; V241-R245 PolarHBondContact O-N 3.35Å
242	Q	81.4	Confident	83.8	Confident	127 Å²	127	69.5 Å²	69.5	59%	0.593	35%	0.345	S	S	*	.	H	α-helix	trans	-70.5	-35.2	-179.9	-175.8	62.6	12.5	0	0	112.9	F240 R245 V246	F240-Q242 PolarHBondContact O-N 2.77Å; Q242-R245 PolarHBondContact O-N 3.26Å; Q242-V246 WeakPolarHBondContact O-CG2 3.48Å; Q242-V246 PolarHBondContact O-N 3.32Å; Q242-V246 VanDerWaalsContact O-N 3.16Å
243	A	85.2	Confident	83.1	Confident	33 Å²	33	68.9 Å²	68.9	27%	0.273	35%	0.347	S	S	.	.	H	α-helix	trans	-67.8	-42.3	173.7	0	0	0	0	0	110.4	T238 F240 R245 V246 H247	T238-A243 HydrophobicContact CG2-CB 4.16Å; F240-A243 HydrophobicContact CB-CB 3.98Å; F240-A243 PolarHBondContact O-N 3.07Å; A243-R245 VanDerWaalsContact C-N 3.32Å; A243-R245 PolarHBondContact O-N 2.86Å; A243-V246 PolarHBondContact O-N 3.26Å; A243-H247 WeakPolarHBondContact O-CB 3.5Å; A243-H247 PolarHBondContact O-N 3.04Å
244	F	86.6	Confident	82.5	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-61.5	-39.1	175	-163.5	-91.8	0	0	0	112.2	V213 A217 L229 C231 Y236 T238 F240 V241 H247 T248	V213-F244 HydrophobicContact CB-CD1 3.77Å; V213-F244 HydrophobicContact CB-CE1 4.04Å; V213-F244 HydrophobicContact CG1-CD1 4.32Å; V213-F244 HydrophobicContact CG2-CD1 3.83Å; V213-F244 HydrophobicContact CG2-CE1 4.36Å; A217-F244 HydrophobicContact CB-CD1 4.28Å; A217-F244 HydrophobicContact CB-CE1 3.57Å; A217-F244 HydrophobicContact CB-CZ 3.76Å; L229-F244 HydrophobicContact CB-CB 4.24Å; L229-F244 HydrophobicContact CB-CD2 3.57Å; L229-F244 HydrophobicContact CB-CE2 4.1Å; L229-F244 HydrophobicContact CB-CG 3.88Å; L229-F244 HydrophobicContact CD1-CB 3.65Å; L229-F244 HydrophobicContact CD1-CD1 4.5Å; L229-F244 HydrophobicContact CD1-CD2 4.49Å; L229-F244 HydrophobicContact CD1-CG 3.96Å; C231-F244 HydrophobicContact CB-CE2 3.96Å; C231-F244 HydrophobicContact CB-CZ 4.11Å; Y236-F244 HydrophobicContact CD1-CD2 4.2Å; Y236-F244 HydrophobicContact CD1-CE2 4.45Å; Y236-F244 HydrophobicContact CE1-CD2 4.22Å; T238-F244 HydrophobicContact CG2-CB 3.72Å; T238-F244 HydrophobicContact CG2-CD2 4.06Å; T238-F244 HydrophobicContact CG2-CG 4.4Å; F240-F244 PolarHBondContact O-N 2.99Å; V241-F244 PolarHBondContact O-N 2.99Å; F244-H247 CarbonylContact O-C 3.6Å; F244-H247 WeakPolarHBondContact O-CA 3.31Å; F244-H247 VanDerWaalsContact O-CB 3.31Å; F244-H247 WeakPolarHBondContact O-CB 3.43Å; F244-H247 PolarHBondContact O-N 2.82Å; F244-H247 VanDerWaalsContact O-N 3.11Å; F244-T248 HydrophobicContact CD1-CG2 3.75Å; F244-T248 HydrophobicContact CE1-CG2 3.37Å; F244-T248 HydrophobicContact CZ-CG2 4.14Å; F244-T248 WeakPolarHBondContact O-CG2 3.36Å; F244-T248 PolarHBondContact O-N 3.16Å
245	R	84.4	Confident	82.3	Confident	114 Å²	114	70.6 Å²	70.6	43%	0.43	35%	0.346	S	S	.	.	H	α-helix	trans	-65.2	-37.2	175.4	-169.9	179.4	-176.1	-171.9	4.1	113.8	V213 V241 Q242 A243 H247 T248 Q249	V213-R245 HydrophobicContact CG1-CB 3.86Å; V213-R245 HydrophobicContact CG1-CG 3.96Å; V241-R245 WeakPolarHBondContact O-CB 3.38Å; V241-R245 PolarHBondContact O-N 3.35Å; Q242-R245 PolarHBondContact O-N 3.26Å; A243-R245 VanDerWaalsContact C-N 3.32Å; A243-R245 PolarHBondContact O-N 2.86Å; R245-H247 VanDerWaalsContact C-N 3.26Å; R245-T248 PolarHBondContact O-OG1 3.45Å; R245-Q249 WeakPolarHBondContact O-CG 3.41Å; R245-Q249 PolarHBondContact O-N 3.05Å
246	V	83.4	Confident	82.1	Confident	57 Å²	57	66.4 Å²	66.4	35%	0.345	32%	0.318	S	S	.	.	H	α-helix	trans	-70	-28.5	172.7	173.7	0	0	0	0	110.8	Q242 A243 W268	Q242-V246 WeakPolarHBondContact O-CG2 3.48Å; Q242-V246 PolarHBondContact O-N 3.32Å; Q242-V246 VanDerWaalsContact O-N 3.16Å; A243-V246 PolarHBondContact O-N 3.26Å; V246-W268 HydrophobicContact CG1-CZ2 3.68Å
247	H	85.2	Confident	82.1	Confident	17 Å²	17	64.8 Å²	64.8	8%	0.079	31%	0.313	C	S	.	.	H	α-helix	trans	-71.9	-45.9	173.2	170.8	78	0	0	0	113.3	C231 C234 Y236 A243 F244 R245 Q249 K250 H251	C231-H247 WeakPolarHBondContact CB-NE2 3.3Å; C231-H247 PolarHBondContact SG-NE2 3.16Å; C231-H247 VanDerWaalsContact SG-NE2 3.43Å; C234-H247 PolarHBondContact SG-CE1 2.8Å; C234-H247 PolarHBondContact SG-NE2 3.05Å; C234-H247 VanDerWaalsContact SG-NE2 3.4Å; Y236-H247 WeakPolarHBondContact CB-CE1 3.06Å; Y236-H247 HydrophobicContact CD1-CB 3.78Å; Y236-H247 AromaticContact CD1-CD2 3.46Å; Y236-H247 VanDerWaalsContact CD1-CD2 3.46Å; Y236-H247 WeakPolarHBondContact CD1-CD2 3.48Å; Y236-H247 AromaticContact CD1-CE1 3.84Å; Y236-H247 AromaticContact CD1-CG 3.26Å; Y236-H247 AromaticContact CD1-ND1 3.51Å; Y236-H247 AromaticContact CD1-NE2 3.82Å; Y236-H247 AromaticContact CD2-ND1 3.84Å; Y236-H247 HydrophobicContact CE1-CB 3.53Å; Y236-H247 AromaticContact CE1-CG 3.59Å; Y236-H247 HydrophobicContact CG-CB 4.45Å; Y236-H247 AromaticContact CG-CD2 3.99Å; Y236-H247 AromaticContact CG-CE1 3.55Å; Y236-H247 AromaticContact CG-CG 3.68Å; Y236-H247 AromaticContact CG-ND1 3.38Å; Y236-H247 AromaticContact CG-NE2 3.91Å; A243-H247 WeakPolarHBondContact O-CB 3.5Å; A243-H247 PolarHBondContact O-N 3.04Å; F244-H247 CarbonylContact O-C 3.6Å; F244-H247 WeakPolarHBondContact O-CA 3.31Å; F244-H247 VanDerWaalsContact O-CB 3.31Å; F244-H247 WeakPolarHBondContact O-CB 3.43Å; F244-H247 PolarHBondContact O-N 2.82Å; F244-H247 VanDerWaalsContact O-N 3.11Å; R245-H247 VanDerWaalsContact C-N 3.26Å; H247-Q249 PolarHBondContact O-N 2.98Å; H247-K250 VanDerWaalsContact O-CB 3.3Å; H247-K250 WeakPolarHBondContact O-CB 3.28Å; H247-K250 PolarHBondContact O-N 2.91Å; H247-H251 AromaticContact CD2-NE2 3.92Å; H247-H251 AromaticContact CE1-NE2 3.38Å; H247-H251 PolarHBondContact CE1-NE2 3.26Å; H247-H251 AromaticContact NE2-CD2 3.59Å; H247-H251 AromaticContact NE2-NE2 2.94Å; H247-H251 PolarHBondContact NE2-NE2 3.44Å
248	T	84.8	Confident	82.2	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.018	30%	0.3	C	S	.	.	H	α-helix	trans	-61.4	-30.9	179.7	59.1	0	0	0	0	112.8	V213 Y216 F244 R245 K250 H251 E252	V213-T248 HydrophobicContact CB-CG2 4.34Å; V213-T248 HydrophobicContact CG1-CG2 4.33Å; Y216-T248 HydrophobicContact CD2-CG2 3.71Å; Y216-T248 HydrophobicContact CG-CG2 3.86Å; F244-T248 HydrophobicContact CD1-CG2 3.75Å; F244-T248 HydrophobicContact CE1-CG2 3.37Å; F244-T248 HydrophobicContact CZ-CG2 4.14Å; F244-T248 WeakPolarHBondContact O-CG2 3.36Å; F244-T248 PolarHBondContact O-N 3.16Å; R245-T248 PolarHBondContact O-OG1 3.45Å; T248-K250 PolarHBondContact O-N 3.41Å; T248-K250 VanDerWaalsContact O-N 3.12Å; T248-H251 PolarHBondContact O-N 2.86Å; T248-H251 VanDerWaalsContact O-N 3.08Å; T248-E252 PolarHBondContact O-N 2.97Å; T248-E252 VanDerWaalsContact O-N 3.09Å
249	Q	82.8	Confident	82.4	Confident	76 Å²	76	61.8 Å²	61.8	36%	0.355	30%	0.295	S	S	.	.	H	α-helix	trans	-60.1	-17	172.5	-74.6	-179.3	-21.7	0	0	114.3	R245 H247 N267	R245-Q249 WeakPolarHBondContact O-CG 3.41Å; R245-Q249 PolarHBondContact O-N 3.05Å; H247-Q249 PolarHBondContact O-N 2.98Å; Q249-N267 PolarHBondContact O-ND2 3.19Å
250	K	81.1	Confident	82.5	Confident	111 Å²	111	60.6 Å²	60.6	48%	0.483	30%	0.297	S	S	.	.	H	α-helix	trans	-71	-52.7	169.2	-63.9	-170.3	173.1	-168.5	0	110.8	H247 T248 E252 N253 W268	H247-K250 VanDerWaalsContact O-CB 3.3Å; H247-K250 WeakPolarHBondContact O-CB 3.28Å; H247-K250 PolarHBondContact O-N 2.91Å; T248-K250 PolarHBondContact O-N 3.41Å; T248-K250 VanDerWaalsContact O-N 3.12Å; K250-E252 VanDerWaalsContact C-N 3.31Å; K250-E252 PolarHBondContact O-N 3.39Å; K250-N253 PolarHBondContact O-N 3Å; K250-W268 VanDerWaalsContact CE-CH2 3.41Å; K250-W268 HydrophobicContact CG-CZ2 4.24Å
251	H	82	Confident	82.6	Confident	50 Å²	50	58.6 Å²	58.6	23%	0.231	30%	0.298	C	S	.	.	H	α-helix	trans	-62.1	-36.8	-178.9	-61.6	-55.2	0	0	0	113	Y216 C231 L233 C234 H247 T248 N253	Y216-H251 HydrophobicContact CE1-CB 4.5Å; C231-H251 PolarHBondContact SG-NE2 3.14Å; L233-H251 HydrophobicContact CD1-CB 3.82Å; C234-H251 VanDerWaalsContact SG-CE1 3.58Å; C234-H251 PolarHBondContact SG-NE2 3.11Å; H247-H251 AromaticContact CD2-NE2 3.92Å; H247-H251 AromaticContact CE1-NE2 3.38Å; H247-H251 PolarHBondContact CE1-NE2 3.26Å; H247-H251 AromaticContact NE2-CD2 3.59Å; H247-H251 AromaticContact NE2-NE2 2.94Å; H247-H251 PolarHBondContact NE2-NE2 3.44Å; T248-H251 PolarHBondContact O-N 2.86Å; T248-H251 VanDerWaalsContact O-N 3.08Å; H251-N253 PolarHBondContact O-N 2.93Å; H251-N253 VanDerWaalsContact O-N 3.14Å; H251-N253 PolarHBondContact O-ND2 3.12Å; H251-N253 VanDerWaalsContact O-ND2 3.12Å
252	E	75.6	Confident	82.6	Confident	64 Å²	64	60 Å²	60	30%	0.299	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-17	175.6	-73.3	-174.9	-114.6	0	0	113.5	Y216 T248 K250 K254	Y216-E252 HydrophobicContact CE2-CG 4.3Å; T248-E252 PolarHBondContact O-N 2.97Å; T248-E252 VanDerWaalsContact O-N 3.09Å; K250-E252 VanDerWaalsContact C-N 3.31Å; K250-E252 PolarHBondContact O-N 3.39Å; E252-K254 HydrophobicContact CB-CD 4.24Å; E252-K254 HydrophobicContact CB-CG 4.46Å; E252-K254 PolarHBondContact O-N 3.04Å; E252-K254 WeakPolarHBondContact OE2-CE 3.49Å; E252-K254 IonicContact OE2-NZ 2.72Å; E252-K254 PolarHBondContact OE2-NZ 3.25Å
253	N	69	Low	82.6	Confident	111 Å²	111	55.6 Å²	55.6	59%	0.594	30%	0.297	S	S	*	.			trans	51.8	4.2	179.5	-80.6	-71.2	0	0	0	117.1	K250 H251 K255	K250-N253 PolarHBondContact O-N 3Å; H251-N253 PolarHBondContact O-N 2.93Å; H251-N253 VanDerWaalsContact O-N 3.14Å; H251-N253 PolarHBondContact O-ND2 3.12Å; H251-N253 VanDerWaalsContact O-ND2 3.12Å; N253-K255 PolarHBondContact O-N 3.39Å; N253-K255 VanDerWaalsContact O-N 3.16Å
254	K	71.6	Confident	82.6	Confident	85 Å²	85	58.8 Å²	58.8	37%	0.37	30%	0.303	S	S	.	.			trans	-61.2	116.4	174.2	-70.4	165.1	-167.9	165.9	0	109	E252 P256 N267	E252-K254 HydrophobicContact CB-CD 4.24Å; E252-K254 HydrophobicContact CB-CG 4.46Å; E252-K254 PolarHBondContact O-N 3.04Å; E252-K254 WeakPolarHBondContact OE2-CE 3.49Å; E252-K254 IonicContact OE2-NZ 2.72Å; E252-K254 PolarHBondContact OE2-NZ 3.25Å; K254-P256 WeakPolarHBondContact O-CD 3.46Å; K254-N267 WeakPolarHBondContact O-CA 3.45Å
255	K	82.8	Confident	82.6	Confident	97 Å²	97	64.5 Å²	64.5	42%	0.422	32%	0.324	S	S	.	.			trans	-105.2	78.9	174	-65.8	166.6	-179.8	177.6	0	109.9	N253 F257 R265 S266 N267	N253-K255 PolarHBondContact O-N 3.39Å; N253-K255 VanDerWaalsContact O-N 3.16Å; K255-F257 VanDerWaalsContact C-N 3.34Å; K255-R265 HydrophobicContact CB-CB 3.71Å; K255-R265 HydrophobicContact CD-CB 4.25Å; K255-R265 HydrophobicContact CG-CB 4.49Å; K255-R265 PolarHBondContact O-NE 3.36Å; K255-R265 VanDerWaalsContact O-NE 3.16Å; K255-R265 PolarHBondContact O-NH2 3.24Å; K255-S266 CarbonylContact C-O 3.5Å; K255-S266 WeakPolarHBondContact CA-O 3.5Å; K255-N267 WeakPolarHBondContact CG-OD1 3.33Å
256	P	83	Confident	82.7	Confident	38 Å²	38	59.5 Å²	59.5	25%	0.247	31%	0.307	C	S	.	.			trans	-81.8	-11	-177.1	35.5	-38.2	0	0	0	113	K254 K290 L291	K254-P256 WeakPolarHBondContact O-CD 3.46Å; P256-K290 CarbonylContact O-C 3.58Å; P256-K290 WeakPolarHBondContact O-CA 3.49Å; P256-L291 PolarHBondContact O-N 2.86Å
257	F	86.3	Confident	82.7	Confident	46 Å²	46	58 Å²	58	20%	0.202	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.9	178.3	-58	-73.6	0	0	0	110	K255 R265 S266 N267 W268 V272 V288 V289 K290	K255-F257 VanDerWaalsContact C-N 3.34Å; F257-R265 CarbonylContact O-C 3.55Å; F257-R265 VanDerWaalsContact O-CA 3.23Å; F257-R265 WeakPolarHBondContact O-CA 3.39Å; F257-S266 PolarHBondContact N-O 3.36Å; F257-S266 PolarHBondContact O-N 3.08Å; F257-N267 WeakPolarHBondContact CD2-O 3.46Å; F257-N267 WeakPolarHBondContact CE2-O 3.3Å; F257-W268 VanDerWaalsContact CD2-C 3.43Å; F257-V272 HydrophobicContact CB-CG2 3.73Å; F257-V288 HydrophobicContact CB-CG1 3.93Å; F257-V288 HydrophobicContact CD1-CG1 3.98Å; F257-V288 HydrophobicContact CG-CG1 4.35Å; F257-V289 CarbonylContact C-O 3.37Å; F257-V289 WeakPolarHBondContact CA-O 3.35Å; F257-K290 HydrophobicContact CD1-CB 4.24Å; F257-K290 HydrophobicContact CD1-CG 4.28Å; F257-K290 HydrophobicContact CE1-CB 4.23Å; F257-K290 HydrophobicContact CE1-CG 4.01Å
258	Q	88.1	Confident	82.7	Confident	54 Å²	54	60.9 Å²	60.9	25%	0.252	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	143.4	-177.8	179.8	165.8	-38.9	0	0	111	Y264 R265 V289 L291	Q258-Y264 CarbonylContact C-O 3.53Å; Q258-Y264 WeakPolarHBondContact CA-O 3.28Å; Q258-R265 HydrophobicContact CB-CG 4.13Å; Q258-R265 HydrophobicContact CG-CG 4.06Å; Q258-V289 PolarHBondContact N-O 3.35Å; Q258-V289 PolarHBondContact O-N 2.79Å; Q258-L291 HydrophobicContact CB-CD1 4.39Å; Q258-L291 HydrophobicContact CB-CG 4.44Å
259	C	88.1	Confident	82.8	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	124.9	167.9	-173.7	0	0	0	0	110.1	A261 G263 Y264 V272	C259-A261 PolarHBondContact O-N 3.03Å; C259-G263 PolarHBondContact O-N 3.12Å; C259-Y264 PolarHBondContact N-O 2.97Å; C259-V272 HydrophobicContact CB-CG1 3.76Å
260	S	85.6	Confident	83	Confident	59 Å²	59	62 Å²	62	41%	0.413	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-28.1	179.2	58.8	0	0	0	0	114.2	T285 R287	S260-T285 PolarHBondContact OG-O 2.77Å; S260-R287 PolarHBondContact N-O 2.72Å; S260-R287 PolarHBondContact OG-N 3.38Å; S260-R287 PolarHBondContact OG-O 3.43Å
261	A	82.4	Confident	83.3	Confident	49 Å²	49	58 Å²	58	41%	0.405	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-10.9	-170.3	0	0	0	0	0	115	C259 L281 A286	C259-A261 PolarHBondContact O-N 3.03Å; A261-L281 HydrophobicContact CB-CD1 4.35Å; A261-L281 HydrophobicContact CB-CD2 4.09Å; A261-A286 HydrophobicContact CB-CB 3.81Å
262	C	84.8	Confident	83.4	Confident	70 Å²	70	55.6 Å²	55.6	47%	0.473	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.3	0.9	-174	71.3	0	0	0	0	115	Y264 H275	C262-Y264 VanDerWaalsContact C-N 3.26Å; C262-Y264 PolarHBondContact O-N 3.12Å; C262-Y264 PolarHBondContact SG-N 3.08Å; C262-Y264 VanDerWaalsContact SG-N 3.44Å; C262-H275 PolarHBondContact SG-CE1 3.47Å; C262-H275 PolarHBondContact SG-NE2 3.15Å
263	G	81.5	Confident	83.9	Confident	34 Å²	34	57 Å²	57	35%	0.351	30%	0.303	S	S	.	.			trans	74	-0.6	-179.1	0	0	0	0	0	116.4	C259 R265	C259-G263 PolarHBondContact O-N 3.12Å; G263-R265 WeakPolarHBondContact O-CG 3.38Å; G263-R265 PolarHBondContact O-N 3.02Å
264	Y	85.8	Confident	84.7	Confident	99 Å²	99	56.4 Å²	56.4	39%	0.388	30%	0.295	S	S	.	.			trans	-56.7	125.2	178.7	173.5	-97	0	0	0	112.4	Q258 C259 C262 H275	Q258-Y264 CarbonylContact C-O 3.53Å; Q258-Y264 WeakPolarHBondContact CA-O 3.28Å; C259-Y264 PolarHBondContact N-O 2.97Å; C262-Y264 VanDerWaalsContact C-N 3.26Å; C262-Y264 PolarHBondContact O-N 3.12Å; C262-Y264 PolarHBondContact SG-N 3.08Å; C262-Y264 VanDerWaalsContact SG-N 3.44Å; Y264-H275 HydrophobicContact CD1-CB 3.74Å; Y264-H275 AromaticContact CD1-CG 3.54Å; Y264-H275 AromaticContact CD1-ND1 3.71Å; Y264-H275 AromaticContact CD2-ND1 3.99Å; Y264-H275 HydrophobicContact CE1-CB 3.83Å; Y264-H275 HydrophobicContact CG-CB 4.46Å; Y264-H275 AromaticContact CG-CE1 3.9Å; Y264-H275 AromaticContact CG-CG 3.85Å; Y264-H275 AromaticContact CG-ND1 3.52Å
265	R	87.3	Confident	85.4	Confident	120 Å²	120	53.8 Å²	53.8	45%	0.453	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	137.4	-176.3	-50.3	179.2	56	170.7	-5.5	113	K255 F257 Q258 G263 L291	K255-R265 HydrophobicContact CB-CB 3.71Å; K255-R265 HydrophobicContact CD-CB 4.25Å; K255-R265 HydrophobicContact CG-CB 4.49Å; K255-R265 PolarHBondContact O-NE 3.36Å; K255-R265 VanDerWaalsContact O-NE 3.16Å; K255-R265 PolarHBondContact O-NH2 3.24Å; F257-R265 CarbonylContact O-C 3.55Å; F257-R265 VanDerWaalsContact O-CA 3.23Å; F257-R265 WeakPolarHBondContact O-CA 3.39Å; Q258-R265 HydrophobicContact CB-CG 4.13Å; Q258-R265 HydrophobicContact CG-CG 4.06Å; G263-R265 WeakPolarHBondContact O-CG 3.38Å; G263-R265 PolarHBondContact O-N 3.02Å; R265-L291 VanDerWaalsContact NH2-CD1 3.28Å
266	S	85.5	Confident	85.5	Confident	10 Å²	10	49.4 Å²	49.4	7%	0.07	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	157.8	171.7	-179.4	0	0	0	0	112.6	K255 F257 W268 D271	K255-S266 CarbonylContact C-O 3.5Å; K255-S266 WeakPolarHBondContact CA-O 3.5Å; F257-S266 PolarHBondContact N-O 3.36Å; F257-S266 PolarHBondContact O-N 3.08Å; S266-W268 PolarHBondContact O-N 3.1Å; S266-W268 PolarHBondContact OG-N 2.97Å; S266-W268 PolarHBondContact OG-O 3.13Å; S266-D271 PolarHBondContact OG-OD2 3.1Å
267	N	83.6	Confident	85.5	Confident	26 Å²	26	54.9 Å²	54.9	14%	0.139	28%	0.281	C	S	.	.	S	Bend	trans	-64	-23.7	170.1	-51.8	39.6	0	0	0	111.2	Q249 K254 K255 F257	Q249-N267 PolarHBondContact O-ND2 3.19Å; K254-N267 WeakPolarHBondContact O-CA 3.45Å; K255-N267 WeakPolarHBondContact CG-OD1 3.33Å; F257-N267 WeakPolarHBondContact CD2-O 3.46Å; F257-N267 WeakPolarHBondContact CE2-O 3.3Å
268	W	85.8	Confident	85.3	Confident	76 Å²	76	61 Å²	61	29%	0.288	31%	0.308	S	S	.	.	S	Bend	trans	-127.9	137.7	-178.1	-54.5	-36.1	0	0	0	113.5	V246 K250 F257 S266 S270 D271	V246-W268 HydrophobicContact CG1-CZ2 3.68Å; K250-W268 VanDerWaalsContact CE-CH2 3.41Å; K250-W268 HydrophobicContact CG-CZ2 4.24Å; F257-W268 VanDerWaalsContact CD2-C 3.43Å; S266-W268 PolarHBondContact O-N 3.1Å; S266-W268 PolarHBondContact OG-N 2.97Å; S266-W268 PolarHBondContact OG-O 3.13Å; W268-S270 WeakPolarHBondContact CB-OG 3.5Å; W268-S270 PolarHBondContact O-N 3.36Å; W268-D271 PolarHBondContact O-N 2.87Å
269	S	86.9	Confident	84.7	Confident	48 Å²	48	65.5 Å²	65.5	34%	0.336	33%	0.326	S	S	.	.	H	α-helix	trans	-64.8	-23	176.7	58.4	0	0	0	0	113.5	D271 H273	S269-D271 VanDerWaalsContact C-N 3.27Å; S269-D271 PolarHBondContact O-N 3.04Å; S269-H273 PolarHBondContact O-N 2.88Å; S269-H273 VanDerWaalsContact O-N 3.08Å; S269-H273 PolarHBondContact O-ND1 3.24Å
270	S	86.6	Confident	83.4	Confident	54 Å²	54	75 Å²	75	38%	0.378	37%	0.368	S	S	.	.	H	α-helix	trans	-60	-36.8	174.6	51.2	0	0	0	0	112.4	W268 H273 K274	W268-S270 WeakPolarHBondContact CB-OG 3.5Å; W268-S270 PolarHBondContact O-N 3.36Å; S270-H273 PolarHBondContact O-N 2.95Å; S270-K274 WeakPolarHBondContact O-CG 3.46Å; S270-K274 PolarHBondContact O-N 3.09Å
271	D	86.2	Confident	82.3	Confident	27 Å²	27	74.2 Å²	74.2	14%	0.144	36%	0.359	C	S	.	.	H	α-helix	trans	-83.7	-30.5	-174.8	-51.1	-38.7	0	0	0	111.3	S266 W268 S269 H273 K274 H275	S266-D271 PolarHBondContact OG-OD2 3.1Å; W268-D271 PolarHBondContact O-N 2.87Å; S269-D271 VanDerWaalsContact C-N 3.27Å; S269-D271 PolarHBondContact O-N 3.04Å; D271-H273 VanDerWaalsContact C-N 3.31Å; D271-K274 WeakPolarHBondContact O-CB 3.38Å; D271-K274 PolarHBondContact O-N 3.04Å; D271-K274 IonicContact OD1-NZ 2.71Å; D271-K274 PolarHBondContact OD1-NZ 3.34Å; D271-H275 VanDerWaalsContact O-CB 3.32Å; D271-H275 WeakPolarHBondContact O-CB 3.5Å; D271-H275 PolarHBondContact O-N 3.39Å
272	V	85.8	Confident	81	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-63.8	-39.1	167.2	-165.3	0	0	0	0	110.3	F257 C259 K274 H275 I276 V288	F257-V272 HydrophobicContact CB-CG2 3.73Å; C259-V272 HydrophobicContact CB-CG1 3.76Å; V272-K274 PolarHBondContact O-N 3.32Å; V272-H275 WeakPolarHBondContact O-CB 3.27Å; V272-H275 PolarHBondContact O-N 2.83Å; V272-I276 HydrophobicContact CG1-CD1 4.22Å; V272-I276 VanDerWaalsContact O-CG1 3.25Å; V272-I276 WeakPolarHBondContact O-CG1 3.37Å; V272-I276 PolarHBondContact O-N 3.39Å; V272-V288 HydrophobicContact CB-CB 4.48Å; V272-V288 HydrophobicContact CB-CG1 3.97Å; V272-V288 HydrophobicContact CB-CG2 3.79Å; V272-V288 HydrophobicContact CG1-CB 4.32Å; V272-V288 HydrophobicContact CG1-CG1 4.12Å; V272-V288 HydrophobicContact CG1-CG2 3.72Å; V272-V288 HydrophobicContact CG2-CG1 4.26Å
273	H	85.9	Confident	79.8	Confident	93 Å²	93	77.8 Å²	77.8	43%	0.431	37%	0.366	S	S	.	.	H	α-helix	trans	-68.5	-25.7	171.5	-76.4	99.1	0	0	0	114.5	S269 S270 D271 R277 V288	S269-H273 PolarHBondContact O-N 2.88Å; S269-H273 VanDerWaalsContact O-N 3.08Å; S269-H273 PolarHBondContact O-ND1 3.24Å; S270-H273 PolarHBondContact O-N 2.95Å; D271-H273 VanDerWaalsContact C-N 3.31Å; H273-R277 PolarHBondContact O-NE 2.88Å; H273-V288 VanDerWaalsContact CE1-CG2 3.44Å; H273-V288 WeakPolarHBondContact CE1-CG2 3.34Å
274	K	86	Confident	78.8	Confident	99 Å²	99	80.2 Å²	80.2	43%	0.43	38%	0.377	S	S	.	.	H	α-helix	trans	-71.7	-49.9	168.7	-70.1	169.5	-168.6	158.7	0	109.8	S270 D271 V272 I276 R277 F278	S270-K274 WeakPolarHBondContact O-CG 3.46Å; S270-K274 PolarHBondContact O-N 3.09Å; D271-K274 WeakPolarHBondContact O-CB 3.38Å; D271-K274 PolarHBondContact O-N 3.04Å; D271-K274 IonicContact OD1-NZ 2.71Å; D271-K274 PolarHBondContact OD1-NZ 3.34Å; V272-K274 PolarHBondContact O-N 3.32Å; K274-I276 PolarHBondContact O-N 2.99Å; K274-R277 PolarHBondContact O-N 3.16Å; K274-F278 HydrophobicContact CB-CD2 4.15Å; K274-F278 HydrophobicContact CB-CE2 4.24Å; K274-F278 VanDerWaalsContact O-CD2 3.25Å; K274-F278 WeakPolarHBondContact O-CD2 3.4Å; K274-F278 PolarHBondContact O-N 3.45Å
275	H	85.8	Confident	77.9	Confident	31 Å²	31	79.5 Å²	79.5	14%	0.144	38%	0.383	C	S	.	.	H	α-helix	trans	-52.4	-50.2	178.5	165.8	91.3	0	0	0	112.1	C262 Y264 D271 V272 R277 F278 K279 L281	C262-H275 PolarHBondContact SG-CE1 3.47Å; C262-H275 PolarHBondContact SG-NE2 3.15Å; Y264-H275 HydrophobicContact CD1-CB 3.74Å; Y264-H275 AromaticContact CD1-CG 3.54Å; Y264-H275 AromaticContact CD1-ND1 3.71Å; Y264-H275 AromaticContact CD2-ND1 3.99Å; Y264-H275 HydrophobicContact CE1-CB 3.83Å; Y264-H275 HydrophobicContact CG-CB 4.46Å; Y264-H275 AromaticContact CG-CE1 3.9Å; Y264-H275 AromaticContact CG-CG 3.85Å; Y264-H275 AromaticContact CG-ND1 3.52Å; D271-H275 VanDerWaalsContact O-CB 3.32Å; D271-H275 WeakPolarHBondContact O-CB 3.5Å; D271-H275 PolarHBondContact O-N 3.39Å; V272-H275 WeakPolarHBondContact O-CB 3.27Å; V272-H275 PolarHBondContact O-N 2.83Å; H275-R277 VanDerWaalsContact C-N 3.33Å; H275-R277 PolarHBondContact O-N 2.8Å; H275-F278 PolarHBondContact O-N 2.94Å; H275-K279 WeakPolarHBondContact O-CB 3.42Å; H275-K279 PolarHBondContact O-N 3.4Å; H275-L281 WeakPolarHBondContact NE2-CD1 3.38Å
276	I	85.2	Confident	77.1	Confident	4 Å²	4	74 Å²	74	2%	0.021	36%	0.364	C	S	.	.	H	α-helix	trans	-55.7	-48.6	179.3	-70.3	164.7	0	0	0	110.7	V272 K274 L281 A286 V288	V272-I276 HydrophobicContact CG1-CD1 4.22Å; V272-I276 VanDerWaalsContact O-CG1 3.25Å; V272-I276 WeakPolarHBondContact O-CG1 3.37Å; V272-I276 PolarHBondContact O-N 3.39Å; K274-I276 PolarHBondContact O-N 2.99Å; I276-L281 HydrophobicContact CG2-CB 4.33Å; I276-L281 PolarHBondContact O-N 3.29Å; I276-A286 HydrophobicContact CD1-CB 4.34Å; I276-A286 HydrophobicContact CG1-CB 4Å; I276-A286 HydrophobicContact CG2-CB 3.96Å; I276-V288 HydrophobicContact CD1-CG2 3.94Å
277	R	83.1	Confident	76.8	Confident	153 Å²	153	81.8 Å²	81.8	58%	0.577	39%	0.392	S	S	*	.	H	α-helix	trans	-64.4	-48.2	178.4	-74.4	-179.9	-73.8	166	-3.7	112.6	H273 K274 H275 K279 K280	H273-R277 PolarHBondContact O-NE 2.88Å; K274-R277 PolarHBondContact O-N 3.16Å; H275-R277 VanDerWaalsContact C-N 3.33Å; H275-R277 PolarHBondContact O-N 2.8Å; R277-K279 PolarHBondContact O-N 3.12Å; R277-K280 PolarHBondContact O-N 3.43Å
278	F	81.8	Confident	76.7	Confident	175 Å²	175	82.3 Å²	82.3	77%	0.768	40%	0.396	S	S	*	.	H	α-helix	trans	-68.9	-30.3	-177.2	-78.3	-61.3	0	0	0	113.8	K274 H275 K280	K274-F278 HydrophobicContact CB-CD2 4.15Å; K274-F278 HydrophobicContact CB-CE2 4.24Å; K274-F278 VanDerWaalsContact O-CD2 3.25Å; K274-F278 WeakPolarHBondContact O-CD2 3.4Å; K274-F278 PolarHBondContact O-N 3.45Å; H275-F278 PolarHBondContact O-N 2.94Å; F278-K280 VanDerWaalsContact C-N 3.27Å; F278-K280 PolarHBondContact O-N 3.38Å
279	K	74	Confident	76.7	Confident	149 Å²	149	81.8 Å²	81.8	65%	0.648	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	8.3	176.3	-77.5	-70.2	-173.2	178.1	0	114.2	H275 R277 L281	H275-K279 WeakPolarHBondContact O-CB 3.42Å; H275-K279 PolarHBondContact O-N 3.4Å; R277-K279 PolarHBondContact O-N 3.12Å; K279-L281 HydrophobicContact CB-CD1 3.96Å; K279-L281 HydrophobicContact CB-CG 3.87Å; K279-L281 PolarHBondContact O-N 3.4Å
280	K	62.8	Low	76.6	Confident	199 Å²	199	86.7 Å²	86.7	87%	0.865	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	25.2	-173.4	-63.5	-174.9	177.2	-179.4	0	113.4	R277 F278 S282	R277-K280 PolarHBondContact O-N 3.43Å; F278-K280 VanDerWaalsContact C-N 3.27Å; F278-K280 PolarHBondContact O-N 3.38Å; K280-S282 PolarHBondContact O-N 3.3Å
281	L	61.5	Low	76.3	Confident	43 Å²	43	87 Å²	87	23%	0.225	41%	0.413	C	S	.	.			trans	-68.7	125.3	178.7	-71.7	168.8	0	0	0	108.4	A261 H275 I276 K279 H283 A286	A261-L281 HydrophobicContact CB-CD1 4.35Å; A261-L281 HydrophobicContact CB-CD2 4.09Å; H275-L281 WeakPolarHBondContact NE2-CD1 3.38Å; I276-L281 HydrophobicContact CG2-CB 4.33Å; I276-L281 PolarHBondContact O-N 3.29Å; K279-L281 HydrophobicContact CB-CD1 3.96Å; K279-L281 HydrophobicContact CB-CG 3.87Å; K279-L281 PolarHBondContact O-N 3.4Å; L281-H283 PolarHBondContact O-N 3.26Å; L281-A286 HydrophobicContact CB-CB 3.66Å; L281-A286 HydrophobicContact CD1-CB 4.34Å
282	S	56.1	Low	75.3	Confident	56 Å²	56	89.6 Å²	89.6	39%	0.392	44%	0.438	S	S	.	.			trans	-60.4	131.1	-173.6	61.7	0	0	0	0	111	K280 S284 T285 A286	K280-S282 PolarHBondContact O-N 3.3Å; S282-S284 PolarHBondContact O-N 3.42Å; S282-S284 PolarHBondContact OG-OG 2.94Å; S282-T285 PolarHBondContact O-N 3.47Å; S282-T285 PolarHBondContact O-OG1 3.47Å; S282-T285 VanDerWaalsContact O-OG1 3.13Å; S282-T285 WeakPolarHBondContact OG-CG2 3.45Å; S282-T285 PolarHBondContact OG-OG1 3.4Å; S282-A286 PolarHBondContact O-N 2.9Å
283	H	59.5	Low	73.8	Confident	137 Å²	137	92.1 Å²	92.1	63%	0.634	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-15.5	-179	-81.5	-74.3	0	0	0	113.7	L281	L281-H283 PolarHBondContact O-N 3.26Å
284	S	60.2	Low	71.5	Confident	85 Å²	85	94 Å²	94	59%	0.594	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-43.4	170.9	46.9	0	0	0	0	113.1	S282	S282-S284 PolarHBondContact O-N 3.42Å; S282-S284 PolarHBondContact OG-OG 2.94Å
285	T	66.5	Low	69.5	Low	84 Å²	84	97 Å²	97	52%	0.515	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-38.9	-174.1	61	0	0	0	0	113.3	S260 S282	S260-T285 PolarHBondContact OG-O 2.77Å; S282-T285 PolarHBondContact O-N 3.47Å; S282-T285 PolarHBondContact O-OG1 3.47Å; S282-T285 VanDerWaalsContact O-OG1 3.13Å; S282-T285 WeakPolarHBondContact OG-CG2 3.45Å; S282-T285 PolarHBondContact OG-OG1 3.4Å
286	A	71.1	Confident	67.1	Low	5 Å²	5	101.3 Å²	101.3	4%	0.041	51%	0.506	C	S	.	.			trans	-97.4	111.4	-172.3	0	0	0	0	0	111.8	A261 I276 L281 S282	A261-A286 HydrophobicContact CB-CB 3.81Å; I276-A286 HydrophobicContact CD1-CB 4.34Å; I276-A286 HydrophobicContact CG1-CB 4Å; I276-A286 HydrophobicContact CG2-CB 3.96Å; L281-A286 HydrophobicContact CB-CB 3.66Å; L281-A286 HydrophobicContact CD1-CB 4.34Å; S282-A286 PolarHBondContact O-N 2.9Å
287	R	77.9	Confident	64.6	Low	174 Å²	174	105.3 Å²	105.3	66%	0.657	54%	0.54	S	S	*	.			trans	-122.3	156.1	179.8	-61.8	-177.9	-176.8	178.8	0.7	110.2	S260 V289	S260-R287 PolarHBondContact N-O 2.72Å; S260-R287 PolarHBondContact OG-N 3.38Å; S260-R287 PolarHBondContact OG-O 3.43Å; R287-V289 PolarHBondContact O-N 2.94Å
288	V	82.6	Confident	62.2	Low	37 Å²	37	104.2 Å²	104.2	22%	0.224	55%	0.55	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	103.5	173.4	-173.4	0	0	0	0	109.2	F257 V272 H273 I276	F257-V288 HydrophobicContact CB-CG1 3.93Å; F257-V288 HydrophobicContact CD1-CG1 3.98Å; F257-V288 HydrophobicContact CG-CG1 4.35Å; V272-V288 HydrophobicContact CB-CB 4.48Å; V272-V288 HydrophobicContact CB-CG1 3.97Å; V272-V288 HydrophobicContact CB-CG2 3.79Å; V272-V288 HydrophobicContact CG1-CB 4.32Å; V272-V288 HydrophobicContact CG1-CG1 4.12Å; V272-V288 HydrophobicContact CG1-CG2 3.72Å; V272-V288 HydrophobicContact CG2-CG1 4.26Å; H273-V288 VanDerWaalsContact CE1-CG2 3.44Å; H273-V288 WeakPolarHBondContact CE1-CG2 3.34Å; I276-V288 HydrophobicContact CD1-CG2 3.94Å
289	V	85.7	Confident	59.7	Low	65 Å²	65	102.5 Å²	102.5	39%	0.394	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	132.6	171	-178.3	0	0	0	0	108.2	F257 Q258 R287 L291	F257-V289 CarbonylContact C-O 3.37Å; F257-V289 WeakPolarHBondContact CA-O 3.35Å; Q258-V289 PolarHBondContact N-O 3.35Å; Q258-V289 PolarHBondContact O-N 2.79Å; R287-V289 PolarHBondContact O-N 2.94Å; V289-L291 HydrophobicContact CG1-CD2 4.35Å
290	K	85.1	Confident	57.6	Low	151 Å²	151	100.9 Å²	100.9	66%	0.657	55%	0.548	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	110.4	165.9	-174.2	-161.2	170.8	-162.1	0	108.2	P256 F257	P256-K290 CarbonylContact O-C 3.58Å; P256-K290 WeakPolarHBondContact O-CA 3.49Å; F257-K290 HydrophobicContact CD1-CB 4.24Å; F257-K290 HydrophobicContact CD1-CG 4.28Å; F257-K290 HydrophobicContact CE1-CB 4.23Å; F257-K290 HydrophobicContact CE1-CG 4.01Å
291	L	79.9	Confident	55.8	Low	61 Å²	61	100 Å²	100	32%	0.319	55%	0.547	S	S	.	.			trans	-64.2	133.5	172.1	-57.5	172.1	0	0	0	109.2	P256 Q258 R265 V289	P256-L291 PolarHBondContact O-N 2.86Å; Q258-L291 HydrophobicContact CB-CD1 4.39Å; Q258-L291 HydrophobicContact CB-CG 4.44Å; R265-L291 VanDerWaalsContact NH2-CD1 3.28Å; V289-L291 HydrophobicContact CG1-CD2 4.35Å
292	A	64.9	Low	54.3	Low	81 Å²	81	106.3 Å²	106.3	67%	0.669	58%	0.576	S	S	*	*			trans	-95.5	155.8	178.4	0	0	0	0	0	110.8	D294	A292-D294 PolarHBondContact O-N 2.95Å
293	G	54.1	Low	53.2	Low	52 Å²	52	108.5 Å²	108.5	54%	0.536	59%	0.587	S	S	.	*	S	Bend	trans	59.4	-78.3	155.7	0	0	0	0	0	117.9	W295	G293-W295 PolarHBondContact O-N 2.88Å; G293-W295 VanDerWaalsContact O-N 3.1Å
294	D	36.9	Very low	51.7	Low	133 Å²	133	110.9 Å²	110.9	71%	0.711	60%	0.598	S	S	*	*				-103.9	53.4	-123.5	-49.2	-42.4	0	0	0	112.6	A292 E296	A292-D294 PolarHBondContact O-N 2.95Å; D294-E296 VanDerWaalsContact C-N 3.34Å
295	W	43.9	Very low	50.5	Low	162 Å²	162	113.8 Å²	113.8	61%	0.614	61%	0.606	S	S	*	*	S	Bend	trans	-88.9	3.7	174.7	62.4	-80.4	0	0	0	113.6	G293	G293-W295 PolarHBondContact O-N 2.88Å; G293-W295 VanDerWaalsContact O-N 3.1Å
296	E	36.4	Very low	48.8	Very low	121 Å²	121	116.5 Å²	116.5	57%	0.565	62%	0.623	S	S	*	*	S	Bend	trans	-86.7	-17.6	169.5	-62.3	-156.8	78.1	0	0	113.1	D294 V298 K299	D294-E296 VanDerWaalsContact C-N 3.34Å; E296-V298 PolarHBondContact O-N 2.96Å; E296-K299 PolarHBondContact O-N 3Å; E296-K299 IonicContact OE1-NZ 2.6Å; E296-K299 PolarHBondContact OE1-NZ 3.43Å
297	A	33.3	Very low	46.9	Very low	89 Å²	89	120 Å²	120	74%	0.736	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	4.9	172.3	0	0	0	0	0	113.5
298	V	33	Very low	44.7	Very low	129 Å²	129	118.5 Å²	118.5	78%	0.782	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	45	164.4	-162.7	0	0	0	0	109	E296	E296-V298 PolarHBondContact O-N 2.96Å
299	K	29.5	Very low	42.3	Very low	140 Å²	140	123.3 Å²	123.3	61%	0.609	69%	0.688	S	S	*	*	S	Bend	trans	-72.5	168.8	147.4	-79	166.3	173.1	161.7	0	108.5	E296	E296-K299 PolarHBondContact O-N 3Å; E296-K299 IonicContact OE1-NZ 2.6Å; E296-K299 PolarHBondContact OE1-NZ 3.43Å
300	C	28	Very low	40	Very low	115 Å²	115	124.9 Å²	124.9	78%	0.777	70%	0.702	S	S	*	*			trans	-49.5	146.4	-176.4	-53.5	0	0	0	0	112.5	Q302	C300-Q302 PolarHBondContact O-N 2.81Å
301	E	26.2	Very low	37.6	Very low	179 Å²	179	126.8 Å²	126.8	84%	0.836	71%	0.711	S	S	*	*			trans	-52.2	103.9	156.7	-174.4	167.4	-170.5	0	0	107.9	V303	E301-V303 HydrophobicContact CG-CG2 4.3Å; E301-V303 PolarHBondContact O-N 3.36Å
302	Q	29.2	Very low	35.3	Very low	177 Å²	177	133.4 Å²	133.4	83%	0.827	74%	0.74	S	S	*	*			trans	-74.8	84.4	173.5	-75.7	-172.8	-109	0	0	107.3	C300 E304	C300-Q302 PolarHBondContact O-N 2.81Å; Q302-E304 PolarHBondContact O-N 3.23Å; Q302-E304 VanDerWaalsContact O-N 3.1Å
303	V	33	Very low	33.9	Very low	102 Å²	102	138 Å²	138	62%	0.618	75%	0.75	S	S	*	*			trans	-60.9	112.6	164.4	-169.1	0	0	0	0	106.6	E301 L305	E301-V303 HydrophobicContact CG-CG2 4.3Å; E301-V303 PolarHBondContact O-N 3.36Å; V303-L305 HydrophobicContact CB-CD1 4.46Å; V303-L305 HydrophobicContact CG1-CD1 3.8Å; V303-L305 HydrophobicContact CG1-CG 3.88Å; V303-L305 PolarHBondContact O-N 3.22Å
304	E	29.3	Very low	33.2	Very low	187 Å²	187	140 Å²	140	87%	0.874	76%	0.761	S	S	*	*			trans	-72.3	75.1	178.8	-66.7	-172.3	131.4	0	0	110.2	Q302	Q302-E304 PolarHBondContact O-N 3.23Å; Q302-E304 VanDerWaalsContact O-N 3.1Å
305	L	35.3	Very low	33.3	Very low	145 Å²	145	138.8 Å²	138.8	76%	0.759	76%	0.761	S	S	*	*			trans	-97.3	95.2	175.4	-85	165.1	0	0	0	110.7	V303 A307	V303-L305 HydrophobicContact CB-CD1 4.46Å; V303-L305 HydrophobicContact CG1-CD1 3.8Å; V303-L305 HydrophobicContact CG1-CG 3.88Å; V303-L305 PolarHBondContact O-N 3.22Å; L305-A307 PolarHBondContact O-N 3.4Å; L305-A307 VanDerWaalsContact O-N 3.15Å
306	T	30.4	Very low	32.9	Very low	142 Å²	142	136.3 Å²	136.3	87%	0.871	77%	0.765	S	S	*	*			trans	-75	86.3	168.1	52.1	0	0	0	0	110.9
307	A	31.1	Very low	33.1	Very low	79 Å²	79	138.1 Å²	138.1	65%	0.653	78%	0.779	S	S	*	*			trans	-162.9	136.5	163.7	0	0	0	0	0	114.1	L305	L305-A307 PolarHBondContact O-N 3.4Å; L305-A307 VanDerWaalsContact O-N 3.15Å
308	D	30.9	Very low	33.2	Very low	141 Å²	141	139 Å²	139	75%	0.754	78%	0.775	S	S	*	*			trans	38.9	117.1	147.3	-54	-22.9	0	0	0	121.9	S310	D308-S310 PolarHBondContact O-N 2.99Å
309	P	33.6	Very low	33.6	Very low	138 Å²	138	139.2 Å²	139.2	90%	0.896	78%	0.776	S	S	*	*	S	Bend	trans	-83.4	44.2	-178.5	38.2	-38.6	0	0	0	113.7
310	S	35.8	Very low	34	Very low	98 Å²	98	137.2 Å²	137.2	69%	0.685	78%	0.776	S	S	*	*			trans	-118	1.5	-159.1	-55.7	0	0	0	0	116.7	D308	D308-S310 PolarHBondContact O-N 2.99Å
311	K	35.7	Very low	34.7	Very low	192 Å²	192	136.5 Å²	136.5	84%	0.835	76%	0.763	S	S	*	*			trans	-143.4	107.8	178.1	-71.8	-174.5	178.2	173	0	113
312	E	31.3	Very low	35.7	Very low	199 Å²	199	138.8 Å²	138.8	93%	0.93	77%	0.771	S	S	*	*			trans	-73.6	138.2	160	-68.1	-169.1	117.3	0	0	110.4
313	M	35.7	Very low	36.4	Very low	178 Å²	178	135.9 Å²	135.9	88%	0.877	76%	0.761	S	S	*	*			trans	-139.5	119.6	169.8	-133.4	100.7	174	0	0	108
314	A	39.9	Very low	36.6	Very low	93 Å²	93	134 Å²	134	77%	0.769	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-71.4	147.4	-172.5	0	0	0	0	0	112.8
315	P	38.3	Very low	36.6	Very low	109 Å²	109	130.8 Å²	130.8	71%	0.708	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-66.6	146	177.2	28.1	-35.1	0	0	0	111.7
316	P	35.5	Very low	36.6	Very low	110 Å²	110	130.6 Å²	130.6	71%	0.714	75%	0.745	S	S	*	*	S	Bend	trans	-71.3	156.1	-172.5	28.9	-36.1	0	0	0	113.4
317	N	40.3	Very low	36.7	Very low	158 Å²	158	132.2 Å²	132.2	85%	0.845	74%	0.743	S	S	*	*	S	Bend	trans	83.1	30.9	173.3	-46	-70.2	0	0	0	117.9
318	V	36.5	Very low	36.5	Very low	108 Å²	108	139.5 Å²	139.5	66%	0.655	75%	0.754	S	S	*	*			trans	-121.4	102	163.6	-173.1	0	0	0	0	110.5	V320	V318-V320 HydrophobicContact CG1-CG2 3.93Å
319	V	39.9	Very low	36.5	Very low	133 Å²	133	142.6 Å²	142.6	81%	0.806	76%	0.761	S	S	*	*			trans	-98.6	112.3	169.1	178.4	0	0	0	0	108.1
320	V	38.5	Very low	36.3	Very low	99 Å²	99	146.9 Å²	146.9	60%	0.6	76%	0.759	S	S	*	*			trans	-92.6	119.4	177.7	-175.5	0	0	0	0	109.3	V318	V318-V320 HydrophobicContact CG1-CG2 3.93Å
321	L	43.1	Very low	36	Very low	99 Å²	99	148.2 Å²	148.2	52%	0.518	77%	0.765	S	S	.	*			trans	-77.8	148.2	171.7	-68.8	166.9	0	0	0	110.3	N323 G324	L321-N323 WeakPolarHBondContact CB-OD1 3.44Å; L321-N323 PolarHBondContact O-N 3Å; L321-G324 PolarHBondContact O-N 2.89Å; L321-G324 VanDerWaalsContact O-N 3.14Å
322	K	46.5	Very low	35.8	Very low	227 Å²	227	144.6 Å²	144.6	99%	0.987	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-3.8	-172.3	-71.6	-173.1	174.2	-176.5	0	115.8
323	N	44.1	Very low	35.8	Very low	116 Å²	116	145 Å²	145	62%	0.62	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	22.8	-177.8	52.7	-3	0	0	0	113.3	L321 L325	L321-N323 WeakPolarHBondContact CB-OD1 3.44Å; L321-N323 PolarHBondContact O-N 3Å; N323-L325 PolarHBondContact O-N 2.86Å
324	G	36.4	Very low	35.5	Very low	62 Å²	62	143.4 Å²	143.4	64%	0.639	75%	0.753	S	S	*	*	S	Bend	trans	73.1	-9.6	165.2	0	0	0	0	0	116.9	L321 Q326	L321-G324 PolarHBondContact O-N 2.89Å; L321-G324 VanDerWaalsContact O-N 3.14Å; G324-Q326 PolarHBondContact O-N 3.01Å
325	L	30	Very low	35.1	Very low	121 Å²	121	143.9 Å²	143.9	63%	0.634	75%	0.75	S	S	*	*			trans	-82.6	105.7	-177.8	-76.9	163.1	0	0	0	112	N323 Q327	N323-L325 PolarHBondContact O-N 2.86Å; L325-Q327 PolarHBondContact O-N 2.96Å
326	Q	36	Very low	35	Very low	140 Å²	140	147.5 Å²	147.5	65%	0.654	76%	0.758	S	S	*	*			trans	-77.7	98.5	174.1	-65.7	-174.3	0.8	0	0	111.7	G324	G324-Q326 PolarHBondContact O-N 3.01Å
327	Q	31.4	Very low	34.6	Very low	177 Å²	177	150.1 Å²	150.1	83%	0.827	77%	0.766	S	S	*	*			trans	-90	123.2	168.9	-74.3	-166.1	-10.3	0	0	112.1	L325 K329	L325-Q327 PolarHBondContact O-N 2.96Å; Q327-K329 PolarHBondContact O-N 3.14Å
328	W	27.3	Very low	34.4	Very low	232 Å²	232	148.6 Å²	148.6	88%	0.879	76%	0.762	S	S	*	*			trans	-87.1	99.7	174.8	-75.1	69	0	0	0	110.9	R330	W328-R330 PolarHBondContact O-N 2.84Å
329	K	31.3	Very low	34.3	Very low	206 Å²	206	151.8 Å²	151.8	90%	0.896	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-69	126.4	168	-119.1	-179.9	-179.3	-179.2	0	109.4	Q327	Q327-K329 PolarHBondContact O-N 3.14Å
330	R	28.7	Very low	34	Very low	227 Å²	227	153.3 Å²	153.3	86%	0.857	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-77	138.3	167.2	-71.1	-174.8	-179.7	177.9	2.5	109.2	W328 V332	W328-R330 PolarHBondContact O-N 2.84Å; R330-V332 PolarHBondContact O-N 3.15Å
331	P	29	Very low	33.7	Very low	127 Å²	127	155.1 Å²	155.1	83%	0.825	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-67	131.4	166.7	28.8	-32.7	0	0	0	109.3
332	V	31.3	Very low	33.3	Very low	116 Å²	116	156.8 Å²	156.8	70%	0.703	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-73.1	146.8	163.2	-177.7	0	0	0	0	107.4	R330 D334	R330-V332 PolarHBondContact O-N 3.15Å; V332-D334 WeakPolarHBondContact CG1-OD1 3.39Å
333	K	31.2	Very low	32.5	Very low	208 Å²	208	150.6 Å²	150.6	90%	0.904	77%	0.77	S	S	*	*			trans	-105.9	91	173.4	-120.7	-164.2	175.5	-157	0	107.6
334	D	30.8	Very low	32	Very low	143 Å²	143	152.7 Å²	152.7	77%	0.765	78%	0.78	S	S	*	*			trans	-73.1	154.2	173.7	-58.7	-51.5	0	0	0	110.4	V332	V332-D334 WeakPolarHBondContact CG1-OD1 3.39Å
335	S	31.6	Very low	32	Very low	103 Å²	103	155.6 Å²	155.6	72%	0.72	79%	0.787	S	S	*	*			trans	-93	134.4	-164.8	51.2	0	0	0	0	113.7
336	E	35.4	Very low	32.1	Very low	185 Å²	185	155.4 Å²	155.4	86%	0.864	80%	0.796	S	S	*	*			trans	51.8	106.6	138.7	-60	-176.4	158	0	0	118.5
337	N	28.3	Very low	32	Very low	166 Å²	166	153.4 Å²	153.4	89%	0.888	80%	0.798	S	S	*	*			trans	-41.4	139.6	172	-48.8	-44.1	0	0	0	115
338	V	35.3	Very low	32.3	Very low	126 Å²	126	149.9 Å²	149.9	76%	0.764	79%	0.793	S	S	*	*			trans	-131	131.9	148	-178.5	0	0	0	0	108.2
339	E	35.2	Very low	32.8	Very low	175 Å²	175	144.6 Å²	144.6	82%	0.818	79%	0.791	S	S	*	*			trans	25.3	108.1	162.2	-61.2	165.8	162.5	0	0	118.7
340	M	32.5	Very low	33.2	Very low	164 Å²	164	138.3 Å²	138.3	81%	0.808	79%	0.785	S	S	*	*				69.7	116.4	72.7	-83.3	-162.1	66.1	0	0	117.6
341	L	33.2	Very low	33.8	Very low	138 Å²	138	133.3 Å²	133.3	72%	0.723	79%	0.785	S	S	*	*			trans	100.1	131.2	150.9	-64.2	174.7	0	0	0	121.5
342	N	32.8	Very low	34.2	Very low	133 Å²	133	131.2 Å²	131.2	71%	0.711	79%	0.786	S	S	*	*			trans	83.5	87.4	147.2	-61.8	-10.3	0	0	0	122.2
343	S	31.8	Very low	34.9	Very low	97 Å²	97	130.1 Å²	130.1	68%	0.678	79%	0.789	S	S	*	*				86.2	113.1	109.3	-62.3	0	0	0	0	122.9
344	I	32.2	Very low	35.4	Very low	161 Å²	161	129 Å²	129	83%	0.826	79%	0.787	S	S	*	*			trans	82	122.8	137.6	-59.3	167.4	0	0	0	118.5
345	P	37.4	Very low	35.9	Very low	122 Å²	122	128.6 Å²	128.6	79%	0.792	79%	0.785	S	S	*	*			trans	-120.2	153.2	179.8	41.4	-31.2	0	0	0	116.6
346	S	31.1	Very low	36.2	Very low	117 Å²	117	128.6 Å²	128.6	82%	0.818	78%	0.781	S	S	*	*			trans	-180	151.7	161.3	52	0	0	0	0	108.8
347	S	34.6	Very low	36.3	Very low	99 Å²	99	129.2 Å²	129.2	69%	0.692	78%	0.777	S	S	*	*			cis	-162.3	177.4	4.8	51.5	0	0	0	0	111.1
348	S	37.4	Very low	36.6	Very low	103 Å²	103	129 Å²	129	72%	0.72	77%	0.77	S	S	*	*			trans	64.1	149.5	147.5	46.9	0	0	0	0	120.9
349	S	38.7	Very low	36.7	Very low	120 Å²	120	129.8 Å²	129.8	84%	0.839	77%	0.769	S	S	*	*			cis	-176.6	149.2	-16.5	50.4	0	0	0	0	112.5
350	G	38.8	Very low	36.6	Very low	74 Å²	74	126.7 Å²	126.7	76%	0.763	77%	0.767	S	S	*	*			trans	89.1	160.3	158.5	0	0	0	0	0	117.7
351	S	41.8	Very low	36.6	Very low	123 Å²	123	123.6 Å²	123.6	86%	0.86	77%	0.768	S	S	*	*			cis	-172.8	145.6	-12	48.5	0	0	0	0	112.5
352	G	37.5	Very low	36.5	Very low	82 Å²	82	120.7 Å²	120.7	85%	0.845	77%	0.771	S	S	*	*			trans	81.3	166.3	172.3	0	0	0	0	0	115.5
353	A	45.5	Very low	36.5	Very low	94 Å²	94	117.9 Å²	117.9	78%	0.777	77%	0.773	S	S	*	*			cis	-176.8	147.2	-6.4	0	0	0	0	0	109.1
354	E	42.1	Very low	36.4	Very low	185 Å²	185	119.3 Å²	119.3	86%	0.864	78%	0.783	S	S	*	*			cis	-143.3	-156.5	-30.5	-70.5	-175.5	124.1	0	0	105.1
355	D	41.3	Very low	36.4	Very low	133 Å²	133	116.4 Å²	116.4	71%	0.711	78%	0.777	S	S	*	*			cis	-157.4	-121.8	6.7	-176	55.9	0	0	0	111.5
356	T	37.8	Very low	36	Very low	103 Å²	103	116.5 Å²	116.5	63%	0.632	78%	0.776	S	S	*	*			trans	-119.7	-177.8	-166.4	57.8	0	0	0	0	113.4
357	Y	37.1	Very low	36.2	Very low	199 Å²	199	116.9 Å²	116.9	78%	0.78	77%	0.773	S	S	*	*			cis	-150.6	146.8	11.5	35.5	-94.5	0	0	0	108.6
358	E	34.7	Very low	36.1	Very low	161 Å²	161	118.1 Å²	118.1	75%	0.752	77%	0.772	S	S	*	*				61.2	134.8	63.1	-64.3	-125.6	120.3	0	0	114.1
359	L	36.7	Very low	36	Very low	142 Å²	142	120.6 Å²	120.6	74%	0.743	77%	0.772	S	S	*	*			cis	-149.4	-164	-3.9	-105.7	166.8	0	0	0	107.6
360	S	33.4	Very low	35.8	Very low	111 Å²	111	122.3 Å²	122.3	78%	0.776	77%	0.772	S	S	*	*			cis	-159.4	-162.9	14.9	-158.5	0	0	0	0	112.2
361	A	33.2	Very low	35.7	Very low	99 Å²	99	127.9 Å²	127.9	82%	0.818	78%	0.778	S	S	*	*			trans	-98.3	-176.5	175.1	0	0	0	0	0	113
362	G	31.3	Very low	35.5	Very low	76 Å²	76	129.9 Å²	129.9	78%	0.784	78%	0.778	S	S	*	*			cis	167.4	-178.2	1.7	0	0	0	0	0	113
363	G	32	Very low	35.7	Very low	74 Å²	74	131.3 Å²	131.3	76%	0.763	77%	0.773	S	S	*	*			trans	97.9	134.8	-179.7	0	0	0	0	0	113.3
364	S	30.1	Very low	35	Very low	127 Å²	127	133.7 Å²	133.7	89%	0.888	78%	0.777	S	S	*	*			cis	66.4	130.6	41.7	-66.7	0	0	0	0	114
365	S	31.3	Very low	34.7	Very low	100 Å²	100	129.7 Å²	129.7	70%	0.699	77%	0.77	S	S	*	*			cis	-164.9	160	5.4	46	0	0	0	0	112.6
366	T	30.1	Very low	34.4	Very low	125 Å²	125	128.5 Å²	128.5	77%	0.767	77%	0.769	S	S	*	*			trans	28.4	137.8	147.5	59.1	0	0	0	0	120.4
367	V	35.4	Very low	33.9	Very low	124 Å²	124	129.7 Å²	129.7	75%	0.752	78%	0.776	S	S	*	*				-172.5	155.8	78.9	158.3	0	0	0	0	111.4
368	N	31.4	Very low	33.6	Very low	126 Å²	126	126.1 Å²	126.1	67%	0.674	78%	0.775	S	S	*	*			trans	-30.5	171.4	159.5	-51.8	32.2	0	0	0	118
369	E	35.7	Very low	33.4	Very low	154 Å²	154	125.2 Å²	125.2	72%	0.72	77%	0.773	S	S	*	*			cis	-163.8	-167.6	-18.9	-105.3	174.2	128.3	0	0	108
370	D	34.6	Very low	33.3	Very low	156 Å²	156	124.3 Å²	124.3	83%	0.834	77%	0.765	S	S	*	*			trans	73.1	149.2	167	-53.2	-44.4	0	0	0	117.4
371	E	37.6	Very low	33.1	Very low	191 Å²	191	122.3 Å²	122.3	89%	0.893	74%	0.744	S	S	*	*			cis	-130.9	-158.7	6.8	-82.3	-157.8	125.4	0	0	113.6
372	L	36.5	Very low	33	Very low	166 Å²	166	121.7 Å²	121.7	87%	0.869	72%	0.724	S	S	*	*			trans	-110.7	-145.6	-157	-63.3	165.4	0	0	0	115.8
373	P	41.6	Very low	32.9	Very low	112 Å²	112	121.5 Å²	121.5	73%	0.727	70%	0.7	S	S	*	*				-130.4	-174.2	-102.9	43	-25.5	0	0	0	116.5
374	V	31.9	Very low	32.8	Very low	144 Å²	144	119.5 Å²	119.5	87%	0.873	68%	0.677	S	S	*	*			trans	169.8	161.8	141.6	151.3	0	0	0	0	113.2
375	S	34.7	Very low	32.8	Very low	101 Å²	101	118.8 Å²	118.8	71%	0.706	67%	0.667	S	S	*	*			trans	-112.2	-165.8	-170.4	60.5	0	0	0	0	114.1
376	P	34.8	Very low	32.9	Very low	107 Å²	107	115.8 Å²	115.8	70%	0.695	65%	0.647	S	S	*	*			cis	-145.5	170.5	1.2	43	-22.2	0	0	0	120.9
377	V	27.8	Very low	33.3	Very low	129 Å²	129	114 Å²	114	78%	0.782	63%	0.633	S	S	*	*			trans	63.8	110.8	147.7	165.9	0	0	0	0	120.9
378	V	31.3	Very low	33.3	Very low	124 Å²	124	114.5 Å²	114.5	75%	0.752	63%	0.631	S	S	*	*				90.3	134.5	66.4	148.1	0	0	0	0	114.2
379	I	30.4	Very low	34	Very low	141 Å²	141	109.6 Å²	109.6	72%	0.723	61%	0.605	S	S	*	*			cis	-160.8	-161.8	-0.6	43.8	176.1	0	0	0	109.4
380	E	34.1	Very low	34.6	Very low	124 Å²	124	110.6 Å²	110.6	58%	0.579	61%	0.607	S	S	*	*			cis	-168.1	133.6	11.1	-174.5	-177.6	-81.9	0	0	112.3
381	E	29.8	Very low	35	Very low	69 Å²	69	107.4 Å²	107.4	32%	0.322	59%	0.59	S	S	.	*			trans	-168.7	159.5	159.4	-86.5	-149.1	145.1	0	0	112.2	Q442 N443	E381-Q442 VanDerWaalsContact OE1-CA 3.25Å; E381-Q442 WeakPolarHBondContact OE1-CA 3.35Å; E381-Q442 WeakPolarHBondContact OE1-CB 3.25Å; E381-N443 PolarHBondContact OE1-N 2.79Å
382	E	30.4	Very low	35.1	Very low	86 Å²	86	103 Å²	103	40%	0.402	58%	0.576	S	S	.	*			trans	-138.4	151.3	-165.2	-61.5	171.5	101.1	0	0	118.8	M440 K441	E382-M440 HydrophobicContact CB-CB 4.26Å; E382-M440 HydrophobicContact CB-CG 3.99Å; E382-M440 VanDerWaalsContact OE2-CA 3.24Å; E382-M440 WeakPolarHBondContact OE2-CA 3.24Å; E382-K441 PolarHBondContact OE2-N 3Å
383	Y	29.3	Very low	35.4	Very low	71 Å²	71	98.5 Å²	98.5	28%	0.278	56%	0.563	S	S	.	*			trans	-153.6	172.2	180	-59.8	-47.8	0	0	0	115.3	R414 A415 M440	Y383-R414 VanDerWaalsContact CZ-CA 3.45Å; Y383-R414 PolarHBondContact OH-N 3.26Å; Y383-A415 VanDerWaalsContact CD1-C 3.4Å; Y383-A415 HydrophobicContact CD1-CB 4.25Å; Y383-A415 WeakPolarHBondContact CD1-O 3.3Å; Y383-A415 HydrophobicContact CG-CB 4.35Å; Y383-M440 WeakPolarHBondContact O-CE 3.35Å
384	A	30	Very low	35.6	Very low	33 Å²	33	97.1 Å²	97.1	27%	0.273	55%	0.549	S	S	.	.			trans	-151.4	163.8	-174.6	0	0	0	0	0	119.9	M440	A384-M440 HydrophobicContact CB-CE 3.47Å; A384-M440 VanDerWaalsContact CB-CE 3.47Å
385	V	30.4	Very low	36.4	Very low	112 Å²	112	90.4 Å²	90.4	68%	0.679	51%	0.508	S	S	*	.			trans	-153.3	175.6	-170.1	-171.4	0	0	0	0	114.4
386	A	33.2	Very low	36.6	Very low	36 Å²	36	91.9 Å²	91.9	30%	0.298	51%	0.506	S	S	.	.			trans	-134.9	159.1	-170.9	0	0	0	0	0	117.9	D420	A386-D420 HydrophobicContact CB-CB 3.38Å
387	L	38.1	Very low	37.4	Very low	87 Å²	87	90.5 Å²	90.5	46%	0.455	50%	0.498	S	S	.	.			trans	-153.9	172.5	169.7	-83.5	-164.4	0	0	0	116.8	L389 D398 I402 T422	L387-L389 HydrophobicContact CB-CD2 4.43Å; L387-D398 HydrophobicContact CD1-CB 4.44Å; L387-I402 HydrophobicContact CB-CD1 3.86Å; L387-I402 HydrophobicContact CD1-CD1 3.63Å; L387-I402 HydrophobicContact CD1-CG1 3.58Å; L387-I402 HydrophobicContact CG-CD1 3.63Å; L387-I402 HydrophobicContact CG-CG1 3.93Å; L387-T422 WeakPolarHBondContact O-CB 2.86Å; L387-T422 PolarHBondContact O-OG1 2.71Å
388	D	36.3	Very low	38.5	Very low	136 Å²	136	87.5 Å²	87.5	73%	0.727	48%	0.478	S	S	*	.			trans	-122.7	142.1	-175.1	-174.5	29.7	0	0	0	114.5
389	L	45.6	Very low	39.4	Very low	23 Å²	23	83.9 Å²	83.9	12%	0.12	45%	0.452	C	S	.	.			trans	-147	148.5	-137.1	-57.8	173.6	0	0	0	116.1	L387 V395 F399 T422 A423 Y424	L387-L389 HydrophobicContact CB-CD2 4.43Å; L389-V395 HydrophobicContact CB-CG2 3.71Å; L389-V395 HydrophobicContact CD1-CG1 3.76Å; L389-V395 HydrophobicContact CD1-CG2 4.2Å; L389-V395 HydrophobicContact CD2-CB 4.13Å; L389-V395 HydrophobicContact CD2-CG1 3.63Å; L389-V395 HydrophobicContact CD2-CG2 3.74Å; L389-V395 HydrophobicContact CG-CG1 4.2Å; L389-V395 HydrophobicContact CG-CG2 4.05Å; L389-F399 HydrophobicContact CD1-CE2 4.38Å; L389-T422 WeakPolarHBondContact CD1-O 3.22Å; L389-A423 HydrophobicContact CD1-CB 4.46Å; L389-Y424 HydrophobicContact CB-CD2 4.13Å; L389-Y424 HydrophobicContact CB-CE2 4.34Å; L389-Y424 HydrophobicContact CD1-CD2 3.83Å; L389-Y424 HydrophobicContact CD1-CG 4.35Å
390	K	48.3	Very low	40.4	Very low	175 Å²	175	80 Å²	80	76%	0.761	44%	0.437	S	S	*	.			trans	-137.1	-30.5	-171	-86.7	179.2	-175.9	69.7	0	122.5
391	D	43.5	Very low	41.3	Very low	88 Å²	88	76.7 Å²	76.7	47%	0.471	43%	0.432	S	S	.	.	S	Bend	trans	-151.3	159.7	175.9	-146.4	-17.8	0	0	0	110.8	A393 D394	D391-A393 PolarHBondContact O-N 2.99Å; D391-D394 PolarHBondContact O-N 3.14Å; D391-D394 VanDerWaalsContact O-N 3.14Å
392	V	39.1	Very low	42.1	Very low	100 Å²	100	75 Å²	75	61%	0.606	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-10.1	-156.2	178.6	0	0	0	0	115.7	Y424	V392-Y424 WeakPolarHBondContact CA-OH 2.78Å; V392-Y424 HydrophobicContact CB-CE1 4Å; V392-Y424 HydrophobicContact CG1-CE1 4.11Å; V392-Y424 HydrophobicContact CG2-CE1 3.86Å; V392-Y424 WeakPolarHBondContact CG2-OH 3.42Å; V392-Y424 PolarHBondContact N-OH 3.31Å
393	A	42.4	Very low	43	Very low	71 Å²	71	74.9 Å²	74.9	59%	0.587	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-39.2	173.3	0	0	0	0	0	112.6	D391 V395 M396 S397	D391-A393 PolarHBondContact O-N 2.99Å; A393-V395 PolarHBondContact O-N 3.08Å; A393-M396 PolarHBondContact O-N 2.98Å; A393-M396 VanDerWaalsContact O-N 3.08Å; A393-S397 PolarHBondContact O-N 3.48Å; A393-S397 VanDerWaalsContact O-N 3.17Å
394	D	47.1	Very low	43.9	Very low	83 Å²	83	75.6 Å²	75.6	44%	0.444	43%	0.434	S	S	.	.	H	α-helix	trans	-53.2	-44.3	-176.3	-52.4	-10.4	0	0	0	110.1	D391 M396 S397 D398	D391-D394 PolarHBondContact O-N 3.14Å; D391-D394 VanDerWaalsContact O-N 3.14Å; D394-M396 PolarHBondContact O-N 3.31Å; D394-S397 CarbonylContact O-C 3.57Å; D394-S397 WeakPolarHBondContact O-CA 3.35Å; D394-S397 VanDerWaalsContact O-CB 3.25Å; D394-S397 WeakPolarHBondContact O-CB 3.25Å; D394-S397 PolarHBondContact O-N 3.17Å; D394-S397 VanDerWaalsContact O-N 3.12Å; D394-D398 PolarHBondContact O-N 3.21Å
395	V	47.7	Very low	44.8	Very low	2 Å²	2	77.6 Å²	77.6	1%	0.012	45%	0.451	C	S	.	.	H	α-helix	trans	-69.8	-35.5	-178.8	-172	0	0	0	0	114.2	L389 A393 S397 D398 F399 Y424	L389-V395 HydrophobicContact CB-CG2 3.71Å; L389-V395 HydrophobicContact CD1-CG1 3.76Å; L389-V395 HydrophobicContact CD1-CG2 4.2Å; L389-V395 HydrophobicContact CD2-CB 4.13Å; L389-V395 HydrophobicContact CD2-CG1 3.63Å; L389-V395 HydrophobicContact CD2-CG2 3.74Å; L389-V395 HydrophobicContact CG-CG1 4.2Å; L389-V395 HydrophobicContact CG-CG2 4.05Å; A393-V395 PolarHBondContact O-N 3.08Å; V395-S397 PolarHBondContact O-N 2.85Å; V395-D398 PolarHBondContact O-N 3.12Å; V395-F399 HydrophobicContact CG1-CD2 3.55Å; V395-F399 HydrophobicContact CG1-CE2 3.86Å; V395-F399 WeakPolarHBondContact O-CB 3.47Å; V395-F399 PolarHBondContact O-N 3.19Å; V395-Y424 HydrophobicContact CB-CD1 3.72Å; V395-Y424 HydrophobicContact CB-CD2 4.02Å; V395-Y424 HydrophobicContact CB-CE1 4.19Å; V395-Y424 HydrophobicContact CB-CE2 4.4Å; V395-Y424 HydrophobicContact CB-CG 3.61Å; V395-Y424 VanDerWaalsContact CG1-CB 3.41Å; V395-Y424 HydrophobicContact CG1-CD1 4Å; V395-Y424 HydrophobicContact CG1-CD2 4.03Å; V395-Y424 HydrophobicContact CG1-CG 3.5Å; V395-Y424 VanDerWaalsContact CG1-CG 3.5Å; V395-Y424 HydrophobicContact CG2-CD1 3.84Å; V395-Y424 HydrophobicContact CG2-CD2 3.43Å; V395-Y424 VanDerWaalsContact CG2-CD2 3.43Å; V395-Y424 HydrophobicContact CG2-CE1 3.94Å; V395-Y424 HydrophobicContact CG2-CE2 3.48Å; V395-Y424 VanDerWaalsContact CG2-CE2 3.48Å; V395-Y424 HydrophobicContact CG2-CG 3.57Å
396	M	39.1	Very low	45.5	Very low	132 Å²	132	75 Å²	75	65%	0.65	44%	0.441	S	S	*	.	H	α-helix	trans	-66.8	-27.9	175.1	-66.2	-61.8	-49.7	0	0	110.8	A393 D394 S400	A393-M396 PolarHBondContact O-N 2.98Å; A393-M396 VanDerWaalsContact O-N 3.08Å; D394-M396 PolarHBondContact O-N 3.31Å; M396-S400 WeakPolarHBondContact O-CB 3.09Å; M396-S400 PolarHBondContact O-N 2.8Å
397	S	51.7	Low	45.8	Very low	78 Å²	78	79.6 Å²	79.6	55%	0.545	46%	0.456	S	S	.	.	H	α-helix	trans	-74.2	-47.1	171.2	-163.1	0	0	0	0	111.3	A393 D394 V395 S400 A401	A393-S397 PolarHBondContact O-N 3.48Å; A393-S397 VanDerWaalsContact O-N 3.17Å; D394-S397 CarbonylContact O-C 3.57Å; D394-S397 WeakPolarHBondContact O-CA 3.35Å; D394-S397 VanDerWaalsContact O-CB 3.25Å; D394-S397 WeakPolarHBondContact O-CB 3.25Å; D394-S397 PolarHBondContact O-N 3.17Å; D394-S397 VanDerWaalsContact O-N 3.12Å; V395-S397 PolarHBondContact O-N 2.85Å; S397-S400 WeakPolarHBondContact O-CB 3.11Å; S397-S400 PolarHBondContact O-N 3.37Å; S397-A401 PolarHBondContact O-N 3.28Å
398	D	50.9	Low	46	Very low	66 Å²	66	82.8 Å²	82.8	35%	0.353	47%	0.471	S	S	.	.	H	α-helix	trans	-69.6	-40.7	-177	-66.3	-24.2	0	0	0	111.8	L387 D394 V395 S400 A401 I402	L387-D398 HydrophobicContact CD1-CB 4.44Å; D394-D398 PolarHBondContact O-N 3.21Å; V395-D398 PolarHBondContact O-N 3.12Å; D398-S400 VanDerWaalsContact C-N 3.32Å; D398-S400 PolarHBondContact O-N 3.3Å; D398-A401 CarbonylContact O-C 3.49Å; D398-A401 WeakPolarHBondContact O-CA 3.36Å; D398-A401 WeakPolarHBondContact O-CB 3.42Å; D398-A401 PolarHBondContact O-N 3.01Å; D398-I402 VanDerWaalsContact O-CG1 3.32Å; D398-I402 WeakPolarHBondContact O-CG1 3.41Å; D398-I402 PolarHBondContact O-N 2.91Å
399	F	49.6	Very low	46.1	Very low	48 Å²	48	83.9 Å²	83.9	21%	0.211	47%	0.472	C	S	.	.	H	α-helix	trans	-60.8	-40.5	170.9	-95.9	-116.6	0	0	0	112.1	L389 V395 A401 I402 I403 E425	L389-F399 HydrophobicContact CD1-CE2 4.38Å; V395-F399 HydrophobicContact CG1-CD2 3.55Å; V395-F399 HydrophobicContact CG1-CE2 3.86Å; V395-F399 WeakPolarHBondContact O-CB 3.47Å; V395-F399 PolarHBondContact O-N 3.19Å; F399-A401 PolarHBondContact O-N 2.94Å; F399-I402 HydrophobicContact CD2-CD1 4.11Å; F399-I402 HydrophobicContact CE2-CD1 4.39Å; F399-I402 HydrophobicContact CG-CD1 4.41Å; F399-I402 PolarHBondContact O-N 2.69Å; F399-I403 WeakPolarHBondContact O-CB 3.39Å; F399-I403 VanDerWaalsContact O-CG1 3.3Å; F399-I403 WeakPolarHBondContact O-CG1 3.28Å; F399-I403 PolarHBondContact O-N 2.79Å; F399-E425 HydrophobicContact CE1-CG 4.4Å; F399-E425 WeakPolarHBondContact CE1-OE1 3.06Å; F399-E425 HydrophobicContact CZ-CG 4.01Å
400	S	51	Low	45.7	Very low	59 Å²	59	88.9 Å²	88.9	41%	0.413	50%	0.498	S	S	.	.	H	α-helix	trans	-64.1	-30.4	173.3	-170	0	0	0	0	111.9	M396 S397 D398 N404	M396-S400 WeakPolarHBondContact O-CB 3.09Å; M396-S400 PolarHBondContact O-N 2.8Å; S397-S400 WeakPolarHBondContact O-CB 3.11Å; S397-S400 PolarHBondContact O-N 3.37Å; D398-S400 VanDerWaalsContact C-N 3.32Å; D398-S400 PolarHBondContact O-N 3.3Å; S400-N404 VanDerWaalsContact O-CB 3.25Å; S400-N404 WeakPolarHBondContact O-CB 3.32Å; S400-N404 PolarHBondContact O-N 3.41Å; S400-N404 VanDerWaalsContact O-N 3.15Å; S400-N404 PolarHBondContact O-ND2 2.71Å; S400-N404 PolarHBondContact O-OD1 3.43Å
401	A	53	Low	45.3	Very low	55 Å²	55	88.2 Å²	88.2	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-76	-38.7	173.9	0	0	0	0	0	112.7	S397 D398 F399 A405	S397-A401 PolarHBondContact O-N 3.28Å; D398-A401 CarbonylContact O-C 3.49Å; D398-A401 WeakPolarHBondContact O-CA 3.36Å; D398-A401 WeakPolarHBondContact O-CB 3.42Å; D398-A401 PolarHBondContact O-N 3.01Å; F399-A401 PolarHBondContact O-N 2.94Å; A401-A405 WeakPolarHBondContact O-CB 3.4Å; A401-A405 PolarHBondContact O-N 3.26Å
402	I	47.7	Very low	44.8	Very low	35 Å²	35	86.6 Å²	86.6	18%	0.179	51%	0.507	C	S	.	.	H	α-helix	trans	-60	-51	173.4	-60	163.1	0	0	0	109.8	L387 D398 F399 A405 A406	L387-I402 HydrophobicContact CB-CD1 3.86Å; L387-I402 HydrophobicContact CD1-CD1 3.63Å; L387-I402 HydrophobicContact CD1-CG1 3.58Å; L387-I402 HydrophobicContact CG-CD1 3.63Å; L387-I402 HydrophobicContact CG-CG1 3.93Å; D398-I402 VanDerWaalsContact O-CG1 3.32Å; D398-I402 WeakPolarHBondContact O-CG1 3.41Å; D398-I402 PolarHBondContact O-N 2.91Å; F399-I402 HydrophobicContact CD2-CD1 4.11Å; F399-I402 HydrophobicContact CE2-CD1 4.39Å; F399-I402 HydrophobicContact CG-CD1 4.41Å; F399-I402 PolarHBondContact O-N 2.69Å; I402-A405 PolarHBondContact O-N 3.21Å; I402-A406 VanDerWaalsContact O-CB 3.3Å; I402-A406 WeakPolarHBondContact O-CB 3.48Å; I402-A406 PolarHBondContact O-N 3.37Å
403	I	49.1	Very low	44.3	Very low	82 Å²	82	87.2 Å²	87.2	42%	0.421	51%	0.514	S	S	.	.	H	α-helix	trans	-62.3	-52.8	-177	-68.1	166	0	0	0	109.6	F399 A405 A406 E407	F399-I403 WeakPolarHBondContact O-CB 3.39Å; F399-I403 VanDerWaalsContact O-CG1 3.3Å; F399-I403 WeakPolarHBondContact O-CG1 3.28Å; F399-I403 PolarHBondContact O-N 2.79Å; I403-A405 PolarHBondContact O-N 3.19Å; I403-A406 PolarHBondContact O-N 3.28Å; I403-A406 VanDerWaalsContact O-N 3.11Å; I403-E407 HydrophobicContact CG2-CG 4.35Å; I403-E407 WeakPolarHBondContact CG2-OE1 3.45Å; I403-E407 WeakPolarHBondContact O-CB 3.25Å; I403-E407 WeakPolarHBondContact O-CG 3.3Å; I403-E407 PolarHBondContact O-N 3.24Å
404	N	48.4	Very low	43.7	Very low	86 Å²	86	93.4 Å²	93.4	46%	0.46	52%	0.523	S	S	.	.	H	α-helix	trans	-61.8	-30.6	178.7	-64.3	-0.2	0	0	0	112.7	S400 M408	S400-N404 VanDerWaalsContact O-CB 3.25Å; S400-N404 WeakPolarHBondContact O-CB 3.32Å; S400-N404 PolarHBondContact O-N 3.41Å; S400-N404 VanDerWaalsContact O-N 3.15Å; S400-N404 PolarHBondContact O-ND2 2.71Å; S400-N404 PolarHBondContact O-OD1 3.43Å; N404-M408 WeakPolarHBondContact O-CB 3.5Å; N404-M408 VanDerWaalsContact O-CG 3.29Å; N404-M408 WeakPolarHBondContact O-CG 3.41Å; N404-M408 PolarHBondContact O-N 3.15Å
405	A	48.1	Very low	42.9	Very low	75 Å²	75	91 Å²	91	62%	0.62	51%	0.514	S	S	*	.	H	α-helix	trans	-78.7	-31.4	175.8	0	0	0	0	0	113.3	A401 I402 I403	A401-A405 WeakPolarHBondContact O-CB 3.4Å; A401-A405 PolarHBondContact O-N 3.26Å; I402-A405 PolarHBondContact O-N 3.21Å; I403-A405 PolarHBondContact O-N 3.19Å
406	A	46.2	Very low	41.9	Very low	57 Å²	57	94.8 Å²	94.8	47%	0.471	54%	0.537	S	S	.	.	H	α-helix	trans	-76.3	-32.4	176.1	0	0	0	0	0	112.3	I402 I403	I402-A406 VanDerWaalsContact O-CB 3.3Å; I402-A406 WeakPolarHBondContact O-CB 3.48Å; I402-A406 PolarHBondContact O-N 3.37Å; I403-A406 PolarHBondContact O-N 3.28Å; I403-A406 VanDerWaalsContact O-N 3.11Å
407	E	39.3	Very low	41.4	Very low	133 Å²	133	97.1 Å²	97.1	62%	0.621	55%	0.546	S	S	*	.	H	α-helix	trans	-74.9	-27.9	177.7	-72.4	178.1	170.5	0	0	113.3	I403	I403-E407 HydrophobicContact CG2-CG 4.35Å; I403-E407 WeakPolarHBondContact CG2-OE1 3.45Å; I403-E407 WeakPolarHBondContact O-CB 3.25Å; I403-E407 WeakPolarHBondContact O-CG 3.3Å; I403-E407 PolarHBondContact O-N 3.24Å
408	M	41.2	Very low	40.3	Very low	155 Å²	155	97.7 Å²	97.7	76%	0.764	54%	0.542	S	S	*	.	H	α-helix	trans	-78.7	-32.3	-167.7	-88.5	-166.6	71	0	0	116.8	N404	N404-M408 WeakPolarHBondContact O-CB 3.5Å; N404-M408 VanDerWaalsContact O-CG 3.29Å; N404-M408 WeakPolarHBondContact O-CG 3.41Å; N404-M408 PolarHBondContact O-N 3.15Å
409	E	38.3	Very low	39.4	Very low	159 Å²	159	100.4 Å²	100.4	74%	0.743	55%	0.553	S	S	*	*			trans	-128.7	52.4	-172.8	-66.4	-159.5	172	0	0	114.5	N411	E409-N411 PolarHBondContact O-N 3.47Å
410	L	38	Very low	38.5	Very low	128 Å²	128	102.6 Å²	102.6	67%	0.67	57%	0.566	S	S	*	*			trans	-68.1	63	170.6	-89.3	164.2	0	0	0	113.8	G412	L410-G412 PolarHBondContact O-N 3.06Å
411	N	38.9	Very low	37.7	Very low	160 Å²	160	103.7 Å²	103.7	86%	0.856	56%	0.564	S	S	*	*			trans	-79.3	45	167.8	-86.2	-56.5	0	0	0	112.9	E409	E409-N411 PolarHBondContact O-N 3.47Å
412	G	34.7	Very low	36.6	Very low	55 Å²	55	103.2 Å²	103.2	57%	0.567	56%	0.556	S	S	*	*	S	Bend	trans	84.8	126.5	163.4	0	0	0	0	0	118.3	L410	L410-G412 PolarHBondContact O-N 3.06Å
413	C	27.9	Very low	36	Very low	112 Å²	112	104.8 Å²	104.8	76%	0.757	57%	0.574	S	S	*	*			trans	92.5	121.3	161.5	-52.5	0	0	0	0	120.4
414	R	29.8	Very low	35.5	Very low	202 Å²	202	103.4 Å²	103.4	76%	0.762	56%	0.564	S	S	*	*			trans	60.9	111.9	137.3	-69.1	-174.6	172.2	-171	-3.5	121.6	Y383	Y383-R414 VanDerWaalsContact CZ-CA 3.45Å; Y383-R414 PolarHBondContact OH-N 3.26Å
415	A	29.9	Very low	34.9	Very low	31 Å²	31	100.9 Å²	100.9	26%	0.256	55%	0.549	S	S	.	.			trans	-149.8	77.7	139.6	0	0	0	0	0	111.8	Y383	Y383-A415 VanDerWaalsContact CD1-C 3.4Å; Y383-A415 HydrophobicContact CD1-CB 4.25Å; Y383-A415 WeakPolarHBondContact CD1-O 3.3Å; Y383-A415 HydrophobicContact CG-CB 4.35Å
416	T	27.4	Very low	34.3	Very low	82 Å²	82	101.6 Å²	101.6	50%	0.503	54%	0.542	S	S	.	.			trans	-66	130.1	169.1	46.9	0	0	0	0	110.7
417	E	28.2	Very low	34	Very low	181 Å²	181	103.4 Å²	103.4	85%	0.846	55%	0.549	S	S	*	.	S	Bend	trans	55.8	78.1	172.1	-61.3	-174	170.7	0	0	116.1
418	I	29.3	Very low	33.9	Very low	90 Å²	90	107.2 Å²	107.2	46%	0.462	56%	0.557	S	S	.	*			trans	-128.7	114.2	156	-58	-178	0	0	0	109.7
419	H	31.9	Very low	33.4	Very low	123 Å²	123	103.2 Å²	103.2	57%	0.569	54%	0.539	S	S	*	.			trans	-90.6	133.2	161.5	-81.3	-107.7	0	0	0	108.7	F421	H419-F421 HydrophobicContact CB-CE2 4.48Å; H419-F421 AromaticContact CE1-CZ 3.56Å; H419-F421 AromaticContact ND1-CE1 3.77Å; H419-F421 AromaticContact ND1-CE2 3.27Å; H419-F421 VanDerWaalsContact ND1-CE2 3.27Å; H419-F421 WeakPolarHBondContact ND1-CE2 3.16Å; H419-F421 AromaticContact ND1-CZ 2.98Å; H419-F421 WeakPolarHBondContact ND1-CZ 3.24Å
420	D	30.1	Very low	32.9	Very low	94 Å²	94	97.5 Å²	97.5	50%	0.503	52%	0.516	S	S	.	.			trans	-148.8	81.4	164.9	-96.5	-44.3	0	0	0	110.4	A386	A386-D420 HydrophobicContact CB-CB 3.38Å
421	F	33.3	Very low	32.8	Very low	82 Å²	82	95.5 Å²	95.5	36%	0.36	51%	0.506	S	S	.	.			trans	-80.2	126.6	-178	-53	158	0	0	0	112	H419 E425 F436	H419-F421 HydrophobicContact CB-CE2 4.48Å; H419-F421 AromaticContact CE1-CZ 3.56Å; H419-F421 AromaticContact ND1-CE1 3.77Å; H419-F421 AromaticContact ND1-CE2 3.27Å; H419-F421 VanDerWaalsContact ND1-CE2 3.27Å; H419-F421 WeakPolarHBondContact ND1-CE2 3.16Å; H419-F421 AromaticContact ND1-CZ 2.98Å; H419-F421 WeakPolarHBondContact ND1-CZ 3.24Å; F421-E425 HydrophobicContact CB-CB 4.39Å; F421-E425 HydrophobicContact CB-CG 4.29Å; F421-E425 WeakPolarHBondContact CD2-OE2 3.08Å; F421-F436 HydrophobicContact CD1-CB 3.84Å; F421-F436 HydrophobicContact CD2-CB 4.23Å; F421-F436 HydrophobicContact CD2-CD1 4.39Å; F421-F436 HydrophobicContact CD2-CG 4.5Å; F421-F436 HydrophobicContact CE1-CB 3.34Å; F421-F436 HydrophobicContact CE1-CG 4.41Å; F421-F436 HydrophobicContact CE2-CB 3.76Å; F421-F436 HydrophobicContact CE2-CD1 4.26Å; F421-F436 HydrophobicContact CE2-CG 4.36Å; F421-F436 HydrophobicContact CG-CB 4.26Å; F421-F436 HydrophobicContact CZ-CB 3.27Å; F421-F436 HydrophobicContact CZ-CG 4.3Å
422	T	31.8	Very low	32.9	Very low	46 Å²	46	92.8 Å²	92.8	28%	0.282	51%	0.505	S	S	.	.			trans	-134.7	112.1	179.1	38.6	0	0	0	0	112.1	L387 L389 Y424	L387-T422 WeakPolarHBondContact O-CB 2.86Å; L387-T422 PolarHBondContact O-OG1 2.71Å; L389-T422 WeakPolarHBondContact CD1-O 3.22Å; T422-Y424 PolarHBondContact O-N 2.95Å
423	A	33.2	Very low	33.1	Very low	67 Å²	67	96.4 Å²	96.4	55%	0.554	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	-24.5	165.8	0	0	0	0	0	121.8	L389	L389-A423 HydrophobicContact CD1-CB 4.46Å
424	Y	39.1	Very low	33.6	Very low	54 Å²	54	92 Å²	92	21%	0.212	49%	0.485	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.5	-22.6	-162.8	-89.9	-86.2	0	0	0	115.2	L389 V392 V395 T422	L389-Y424 HydrophobicContact CB-CD2 4.13Å; L389-Y424 HydrophobicContact CB-CE2 4.34Å; L389-Y424 HydrophobicContact CD1-CD2 3.83Å; L389-Y424 HydrophobicContact CD1-CG 4.35Å; V392-Y424 WeakPolarHBondContact CA-OH 2.78Å; V392-Y424 HydrophobicContact CB-CE1 4Å; V392-Y424 HydrophobicContact CG1-CE1 4.11Å; V392-Y424 HydrophobicContact CG2-CE1 3.86Å; V392-Y424 WeakPolarHBondContact CG2-OH 3.42Å; V392-Y424 PolarHBondContact N-OH 3.31Å; V395-Y424 HydrophobicContact CB-CD1 3.72Å; V395-Y424 HydrophobicContact CB-CD2 4.02Å; V395-Y424 HydrophobicContact CB-CE1 4.19Å; V395-Y424 HydrophobicContact CB-CE2 4.4Å; V395-Y424 HydrophobicContact CB-CG 3.61Å; V395-Y424 VanDerWaalsContact CG1-CB 3.41Å; V395-Y424 HydrophobicContact CG1-CD1 4Å; V395-Y424 HydrophobicContact CG1-CD2 4.03Å; V395-Y424 HydrophobicContact CG1-CG 3.5Å; V395-Y424 VanDerWaalsContact CG1-CG 3.5Å; V395-Y424 HydrophobicContact CG2-CD1 3.84Å; V395-Y424 HydrophobicContact CG2-CD2 3.43Å; V395-Y424 VanDerWaalsContact CG2-CD2 3.43Å; V395-Y424 HydrophobicContact CG2-CE1 3.94Å; V395-Y424 HydrophobicContact CG2-CE2 3.48Å; V395-Y424 VanDerWaalsContact CG2-CE2 3.48Å; V395-Y424 HydrophobicContact CG2-CG 3.57Å; T422-Y424 PolarHBondContact O-N 2.95Å
425	E	36.9	Very low	33.9	Very low	33 Å²	33	88.9 Å²	88.9	15%	0.154	48%	0.479	C	S	.	.	S	Bend	trans	-36.2	-79.7	140.2	-61.8	-88.1	88.7	0	0	108.6	F399 F421 P427 R428 F436	F399-E425 HydrophobicContact CE1-CG 4.4Å; F399-E425 WeakPolarHBondContact CE1-OE1 3.06Å; F399-E425 HydrophobicContact CZ-CG 4.01Å; F421-E425 HydrophobicContact CB-CB 4.39Å; F421-E425 HydrophobicContact CB-CG 4.29Å; F421-E425 WeakPolarHBondContact CD2-OE2 3.08Å; E425-P427 VanDerWaalsContact C-N 3.32Å; E425-P427 WeakPolarHBondContact O-CD 3.36Å; E425-R428 PolarHBondContact O-N 3.27Å; E425-F436 HydrophobicContact CB-CD1 3.75Å; E425-F436 HydrophobicContact CB-CD2 3.91Å; E425-F436 HydrophobicContact CB-CE1 3.49Å; E425-F436 VanDerWaalsContact CB-CE1 3.49Å; E425-F436 HydrophobicContact CB-CE2 3.81Å; E425-F436 HydrophobicContact CB-CG 4Å; E425-F436 HydrophobicContact CB-CZ 3.58Å; E425-F436 HydrophobicContact CG-CD1 4.15Å; E425-F436 HydrophobicContact CG-CE1 3.93Å; E425-F436 HydrophobicContact CG-CZ 4.44Å; E425-F436 WeakPolarHBondContact O-CE2 3.33Å; E425-F436 WeakPolarHBondContact O-CZ 3.37Å; E425-F436 WeakPolarHBondContact OE1-CE1 3.27Å; E425-F436 WeakPolarHBondContact OE2-CD1 2.98Å; E425-F436 WeakPolarHBondContact OE2-CE1 3.29Å
426	L	34.5	Very low	34.2	Very low	89 Å²	89	88.6 Å²	88.6	47%	0.466	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-34.8	-40.8	-160.5	-80.1	95.3	0	0	0	118.5	R428 C430 G434	L426-R428 VanDerWaalsContact C-N 3.31Å; L426-R428 PolarHBondContact O-N 2.93Å; L426-C430 VanDerWaalsContact O-CB 3.24Å; L426-C430 WeakPolarHBondContact O-CB 3.38Å; L426-C430 PolarHBondContact O-SG 2.84Å; L426-G434 WeakPolarHBondContact CD2-O 3.29Å; L426-G434 WeakPolarHBondContact CG-O 3.3Å; L426-G434 CarbonylContact O-C 3.13Å; L426-G434 WeakPolarHBondContact O-CA 3.49Å
427	P	39.7	Very low	34.3	Very low	95 Å²	95	91.3 Å²	91.3	62%	0.617	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-5.1	174.9	-22	35.2	0	0	0	118.2	E425	E425-P427 VanDerWaalsContact C-N 3.32Å; E425-P427 WeakPolarHBondContact O-CD 3.36Å
428	R	37.1	Very low	34.6	Very low	213 Å²	213	86.4 Å²	86.4	80%	0.804	47%	0.465	S	S	*	.	S	Bend	trans	-128.7	-41.2	-163.2	-96.4	-69.9	173.4	141	2.9	122.2	E425 L426 C430 F436	E425-R428 PolarHBondContact O-N 3.27Å; L426-R428 VanDerWaalsContact C-N 3.31Å; L426-R428 PolarHBondContact O-N 2.93Å; R428-C430 PolarHBondContact O-N 3.22Å; R428-F436 HydrophobicContact CB-CZ 4.33Å
429	L	30.7	Very low	34.6	Very low	72 Å²	72	91 Å²	91	38%	0.377	48%	0.482	S	S	.	.	S	Bend	trans	-89.7	42.1	177.1	-147.9	-176.5	0	0	0	109.5	Q435 F436 L437 V438	L429-Q435 CarbonylContact C-O 3.55Å; L429-Q435 CarbonylContact O-C 3.5Å; L429-F436 HydrophobicContact CB-CB 4.49Å; L429-F436 HydrophobicContact CB-CD1 3.46Å; L429-F436 VanDerWaalsContact CB-CD1 3.46Å; L429-F436 HydrophobicContact CB-CD2 3.9Å; L429-F436 HydrophobicContact CB-CE1 3.17Å; L429-F436 HydrophobicContact CB-CE2 3.51Å; L429-F436 HydrophobicContact CB-CG 3.76Å; L429-F436 HydrophobicContact CB-CZ 3.15Å; L429-F436 HydrophobicContact CD1-CD1 3.59Å; L429-F436 HydrophobicContact CD1-CE1 3.77Å; L429-F436 HydrophobicContact CD1-CG 4.35Å; L429-F436 HydrophobicContact CG-CD1 4.19Å; L429-F436 HydrophobicContact CG-CE1 4.1Å; L429-F436 HydrophobicContact CG-CZ 4.45Å; L429-L437 WeakPolarHBondContact CD1-O 3.47Å; L429-L437 HydrophobicContact CD2-CB 3.88Å; L429-L437 VanDerWaalsContact CD2-O 3.29Å; L429-L437 WeakPolarHBondContact CD2-O 3.5Å; L429-V438 HydrophobicContact CD1-CG2 4.16Å
430	C	29.2	Very low	34.5	Very low	38 Å²	38	88.4 Å²	88.4	26%	0.257	47%	0.471	S	S	.	.			trans	-140.1	133	-138.2	161.3	0	0	0	0	106.6	L426 R428 G434 Q435 F436	L426-C430 VanDerWaalsContact O-CB 3.24Å; L426-C430 WeakPolarHBondContact O-CB 3.38Å; L426-C430 PolarHBondContact O-SG 2.84Å; R428-C430 PolarHBondContact O-N 3.22Å; C430-G434 WeakPolarHBondContact SG-CA 3.1Å; C430-G434 PolarHBondContact SG-N 2.77Å; C430-Q435 WeakPolarHBondContact CA-O 3.48Å; C430-Q435 VanDerWaalsContact CB-O 3.3Å; C430-Q435 WeakPolarHBondContact CB-O 3.1Å; C430-Q435 PolarHBondContact N-O 3.22Å; C430-F436 HydrophobicContact CB-CE2 4.39Å
431	D	35.6	Very low	34.4	Very low	87 Å²	87	90.6 Å²	90.6	47%	0.465	48%	0.476	S	S	.	.	S	Bend	trans	-66.5	-152.9	165.3	59.3	-5.9	0	0	0	110.8	N433 G434	D431-N433 VanDerWaalsContact CG-ND2 3.32Å; D431-N433 PolarHBondContact O-N 2.92Å; D431-N433 WeakPolarHBondContact OD1-CA 3.3Å; D431-N433 VanDerWaalsContact OD1-CB 3.28Å; D431-N433 WeakPolarHBondContact OD1-CB 3.47Å; D431-N433 PolarHBondContact OD1-N 3.11Å; D431-N433 PolarHBondContact OD2-ND2 2.8Å; D431-G434 PolarHBondContact OD1-N 3.47Å
432	A	40.9	Very low	34.3	Very low	102 Å²	102	91.3 Å²	91.3	84%	0.843	48%	0.48	S	S	*	.	S	Bend	trans	-73.9	2.8	173.4	0	0	0	0	0	113.7
433	N	39.6	Very low	34.1	Very low	132 Å²	132	96.2 Å²	96.2	71%	0.706	51%	0.505	S	S	*	.	S	Bend	trans	-121.6	-36.3	-158.4	-53.3	-54.6	0	0	0	115.9	D431	D431-N433 VanDerWaalsContact CG-ND2 3.32Å; D431-N433 PolarHBondContact O-N 2.92Å; D431-N433 WeakPolarHBondContact OD1-CA 3.3Å; D431-N433 VanDerWaalsContact OD1-CB 3.28Å; D431-N433 WeakPolarHBondContact OD1-CB 3.47Å; D431-N433 PolarHBondContact OD1-N 3.11Å; D431-N433 PolarHBondContact OD2-ND2 2.8Å
434	G	37.4	Very low	34.1	Very low	18 Å²	18	99.5 Å²	99.5	19%	0.186	51%	0.51	C	S	.	.			trans	139.8	12.3	170.2	0	0	0	0	0	118.7	L426 C430 D431	L426-G434 WeakPolarHBondContact CD2-O 3.29Å; L426-G434 WeakPolarHBondContact CG-O 3.3Å; L426-G434 CarbonylContact O-C 3.13Å; L426-G434 WeakPolarHBondContact O-CA 3.49Å; C430-G434 WeakPolarHBondContact SG-CA 3.1Å; C430-G434 PolarHBondContact SG-N 2.77Å; D431-G434 PolarHBondContact OD1-N 3.47Å
435	Q	36.2	Very low	33.7	Very low	138 Å²	138	102.5 Å²	102.5	65%	0.645	54%	0.539	S	S	*	.			trans	-95.1	171.3	-165.9	-58.3	-168.3	-2.1	0	0	114.4	L429 C430	L429-Q435 CarbonylContact C-O 3.55Å; L429-Q435 CarbonylContact O-C 3.5Å; C430-Q435 WeakPolarHBondContact CA-O 3.48Å; C430-Q435 VanDerWaalsContact CB-O 3.3Å; C430-Q435 WeakPolarHBondContact CB-O 3.1Å; C430-Q435 PolarHBondContact N-O 3.22Å
436	F	35.7	Very low	33.4	Very low	24 Å²	24	106.9 Å²	106.9	11%	0.105	57%	0.57	C	S	.	*			trans	-138.1	142.3	-176.2	-98	-108.2	0	0	0	113.6	F421 E425 R428 L429 C430	F421-F436 HydrophobicContact CD1-CB 3.84Å; F421-F436 HydrophobicContact CD2-CB 4.23Å; F421-F436 HydrophobicContact CD2-CD1 4.39Å; F421-F436 HydrophobicContact CD2-CG 4.5Å; F421-F436 HydrophobicContact CE1-CB 3.34Å; F421-F436 HydrophobicContact CE1-CG 4.41Å; F421-F436 HydrophobicContact CE2-CB 3.76Å; F421-F436 HydrophobicContact CE2-CD1 4.26Å; F421-F436 HydrophobicContact CE2-CG 4.36Å; F421-F436 HydrophobicContact CG-CB 4.26Å; F421-F436 HydrophobicContact CZ-CB 3.27Å; F421-F436 HydrophobicContact CZ-CG 4.3Å; E425-F436 HydrophobicContact CB-CD1 3.75Å; E425-F436 HydrophobicContact CB-CD2 3.91Å; E425-F436 HydrophobicContact CB-CE1 3.49Å; E425-F436 VanDerWaalsContact CB-CE1 3.49Å; E425-F436 HydrophobicContact CB-CE2 3.81Å; E425-F436 HydrophobicContact CB-CG 4Å; E425-F436 HydrophobicContact CB-CZ 3.58Å; E425-F436 HydrophobicContact CG-CD1 4.15Å; E425-F436 HydrophobicContact CG-CE1 3.93Å; E425-F436 HydrophobicContact CG-CZ 4.44Å; E425-F436 WeakPolarHBondContact O-CE2 3.33Å; E425-F436 WeakPolarHBondContact O-CZ 3.37Å; E425-F436 WeakPolarHBondContact OE1-CE1 3.27Å; E425-F436 WeakPolarHBondContact OE2-CD1 2.98Å; E425-F436 WeakPolarHBondContact OE2-CE1 3.29Å; R428-F436 HydrophobicContact CB-CZ 4.33Å; L429-F436 HydrophobicContact CB-CB 4.49Å; L429-F436 HydrophobicContact CB-CD1 3.46Å; L429-F436 VanDerWaalsContact CB-CD1 3.46Å; L429-F436 HydrophobicContact CB-CD2 3.9Å; L429-F436 HydrophobicContact CB-CE1 3.17Å; L429-F436 HydrophobicContact CB-CE2 3.51Å; L429-F436 HydrophobicContact CB-CG 3.76Å; L429-F436 HydrophobicContact CB-CZ 3.15Å; L429-F436 HydrophobicContact CD1-CD1 3.59Å; L429-F436 HydrophobicContact CD1-CE1 3.77Å; L429-F436 HydrophobicContact CD1-CG 4.35Å; L429-F436 HydrophobicContact CG-CD1 4.19Å; L429-F436 HydrophobicContact CG-CE1 4.1Å; L429-F436 HydrophobicContact CG-CZ 4.45Å; C430-F436 HydrophobicContact CB-CE2 4.39Å
437	L	30.3	Very low	33.1	Very low	140 Å²	140	109.8 Å²	109.8	73%	0.733	59%	0.586	S	S	*	*			trans	-146.3	94.2	-176.4	-78.9	168.2	0	0	0	112.3	L429	L429-L437 WeakPolarHBondContact CD1-O 3.47Å; L429-L437 HydrophobicContact CD2-CB 3.88Å; L429-L437 VanDerWaalsContact CD2-O 3.29Å; L429-L437 WeakPolarHBondContact CD2-O 3.5Å
438	V	35	Very low	32.6	Very low	77 Å²	77	114.1 Å²	114.1	47%	0.467	60%	0.597	S	S	.	*			trans	-87.9	141.9	166.2	-177.4	0	0	0	0	109.1	L429 M440	L429-V438 HydrophobicContact CD1-CG2 4.16Å; V438-M440 HydrophobicContact CG1-CE 4.29Å
439	K	28.2	Very low	32.4	Very low	188 Å²	188	109.5 Å²	109.5	82%	0.817	59%	0.587	S	S	*	*			trans	-117.4	150.5	168	-91.2	-177.8	173	176.9	0	108.3
440	M	30.5	Very low	32.4	Very low	68 Å²	68	112.2 Å²	112.2	34%	0.335	61%	0.609	S	S	.	*			trans	-134.8	149.2	170.1	-69.8	178.6	178.7	0	0	110.9	E382 Y383 A384 V438	E382-M440 HydrophobicContact CB-CB 4.26Å; E382-M440 HydrophobicContact CB-CG 3.99Å; E382-M440 VanDerWaalsContact OE2-CA 3.24Å; E382-M440 WeakPolarHBondContact OE2-CA 3.24Å; Y383-M440 WeakPolarHBondContact O-CE 3.35Å; A384-M440 HydrophobicContact CB-CE 3.47Å; A384-M440 VanDerWaalsContact CB-CE 3.47Å; V438-M440 HydrophobicContact CG1-CE 4.29Å
441	K	28.3	Very low	32.3	Very low	140 Å²	140	114.5 Å²	114.5	61%	0.609	63%	0.631	S	S	*	*			trans	-123.4	151	169.4	-96.5	-176.3	169.8	-174.4	0	111.7	E382	E382-K441 PolarHBondContact OE2-N 3Å
442	Q	29.9	Very low	32.2	Very low	96 Å²	96	119.1 Å²	119.1	45%	0.449	65%	0.647	S	S	.	*			trans	-128.4	147.5	172.6	-61.7	-161.8	-70.1	0	0	110.4	E381	E381-Q442 VanDerWaalsContact OE1-CA 3.25Å; E381-Q442 WeakPolarHBondContact OE1-CA 3.35Å; E381-Q442 WeakPolarHBondContact OE1-CB 3.25Å
443	N	28.8	Very low	31.9	Very low	150 Å²	150	120.7 Å²	120.7	80%	0.802	64%	0.637	S	S	*	*			trans	-165.3	107	167.5	-105.8	-15.5	0	0	0	109.3	E381	E381-N443 PolarHBondContact OE1-N 2.79Å
444	M	31.6	Very low	31.4	Very low	135 Å²	135	122.2 Å²	122.2	67%	0.665	64%	0.639	S	S	*	*			trans	-95.2	148.5	-173.2	-44.2	-148.7	88.1	0	0	113.7
445	S	32.4	Very low	31.1	Very low	118 Å²	118	125.9 Å²	125.9	83%	0.825	66%	0.662	S	S	*	*			trans	163.5	162.7	143.8	-77.5	0	0	0	0	112
446	P	29.4	Very low	30.7	Very low	124 Å²	124	130.9 Å²	130.9	81%	0.805	68%	0.675	S	S	*	*				-127.4	178.7	-56.1	36.8	-19.8	0	0	0	112.5
447	L	28.5	Very low	30.6	Very low	150 Å²	150	135.2 Å²	135.2	79%	0.785	70%	0.703	S	S	*	*			trans	-73	153.9	-170.8	-66.4	87.9	0	0	0	116.1	I449	L447-I449 HydrophobicContact CD2-CD1 4.34Å; L447-I449 HydrophobicContact CD2-CG1 4.38Å
448	H	29.1	Very low	30.7	Very low	187 Å²	187	134.6 Å²	134.6	87%	0.866	71%	0.708	S	S	*	*			trans	-141.1	154.9	133.4	-145.9	-85.7	0	0	0	112.2
449	I	32.6	Very low	30.4	Very low	115 Å²	115	136.2 Å²	136.2	59%	0.59	71%	0.713	S	S	*	*			trans	-121.2	149.1	-169.7	-58.7	163	0	0	0	110.3	L447	L447-I449 HydrophobicContact CD2-CD1 4.34Å; L447-I449 HydrophobicContact CD2-CG1 4.38Å
450	P	31.3	Very low	30.7	Very low	130 Å²	130	135.4 Å²	135.4	84%	0.844	72%	0.716	S	S	*	*			trans	-124.5	162.9	132	36.7	-29.7	0	0	0	112.3
451	A	27.8	Very low	30.7	Very low	85 Å²	85	140.1 Å²	140.1	70%	0.702	73%	0.734	S	S	*	*			trans	-129.1	178.5	-163.7	0	0	0	0	0	114.1
452	K	33.8	Very low	31.1	Very low	184 Å²	184	142.3 Å²	142.3	80%	0.8	74%	0.744	S	S	*	*			trans	101.9	142.1	175.4	-60.4	173.4	176.1	-178.5	0	114.4
453	Q	33.1	Very low	31.3	Very low	136 Å²	136	144.9 Å²	144.9	64%	0.636	76%	0.756	S	S	*	*			cis	-161.9	141.4	-10.3	-116.8	173.1	-63.6	0	0	111.9
454	H	29	Very low	31.3	Very low	163 Å²	163	144.4 Å²	144.4	76%	0.755	75%	0.753	S	S	*	*			trans	62	146	153.3	-65.5	-51.7	0	0	0	120.4
455	S	30.9	Very low	31.2	Very low	96 Å²	96	141.5 Å²	141.5	67%	0.671	75%	0.75	S	S	*	*			cis	-162.5	161.8	-8.2	53.8	0	0	0	0	115.3
456	R	29.3	Very low	31.2	Very low	242 Å²	242	145 Å²	145	91%	0.913	75%	0.75	S	S	*	*			trans	80.9	113	155.2	-82.3	178.6	166.8	142.2	-1.1	120.6
457	V	33	Very low	31.4	Very low	115 Å²	115	146.7 Å²	146.7	70%	0.697	75%	0.753	S	S	*	*			trans	-104.4	167.4	164.3	-137.9	0	0	0	0	108.4	L459	V457-L459 HydrophobicContact CB-CB 4.33Å; V457-L459 HydrophobicContact CG1-CB 3.89Å
458	P	32.9	Very low	31.3	Very low	127 Å²	127	145.2 Å²	145.2	83%	0.825	76%	0.755	S	S	*	*				-139.8	151.9	78.2	36	-19.3	0	0	0	113.9
459	L	28.5	Very low	31.5	Very low	111 Å²	111	145.7 Å²	145.7	58%	0.581	76%	0.755	S	S	*	*			cis	83.4	103.1	22.9	-150.7	-177.9	0	0	0	115.5	V457 K461	V457-L459 HydrophobicContact CB-CB 4.33Å; V457-L459 HydrophobicContact CG1-CB 3.89Å; L459-K461 HydrophobicContact CD2-CD 4.46Å; L459-K461 HydrophobicContact CD2-CG 4.02Å
460	I	33.5	Very low	31.3	Very low	172 Å²	172	147.9 Å²	147.9	88%	0.882	76%	0.762	S	S	*	*			trans	-150	158.7	145.7	-99.6	151.8	0	0	0	107.8
461	K	31.5	Very low	31.2	Very low	166 Å²	166	147.5 Å²	147.5	72%	0.722	75%	0.752	S	S	*	*			trans	-134.9	-178.1	-163.2	-63.4	-178.8	174.7	-178.8	0	112.8	L459	L459-K461 HydrophobicContact CD2-CD 4.46Å; L459-K461 HydrophobicContact CD2-CG 4.02Å
462	K	35.7	Very low	31.2	Very low	187 Å²	187	151 Å²	151	81%	0.813	75%	0.754	S	S	*	*			trans	87.4	142.5	155.5	-72	-178.5	175.7	-176.2	0	116.7
463	Q	34.1	Very low	30.9	Very low	150 Å²	150	152.4 Å²	152.4	70%	0.701	76%	0.76	S	S	*	*			cis	-159.3	168.9	-13.6	-162.3	62.8	0.6	0	0	110.9
464	L	29.1	Very low	30.7	Very low	140 Å²	140	151.3 Å²	151.3	73%	0.733	76%	0.762	S	S	*	*			trans	-43.6	170.4	166.2	-76	83	0	0	0	116.3
465	A	30.6	Very low	30.4	Very low	73 Å²	73	148.6 Å²	148.6	60%	0.603	76%	0.761	S	S	*	*			cis	171.7	175.2	-24.7	0	0	0	0	0	108.4
466	K	31	Very low	30.3	Very low	192 Å²	192	155.2 Å²	155.2	84%	0.835	77%	0.772	S	S	*	*			trans	72.2	153.2	175.2	-52	-178.2	179.4	-178.6	0	113.2
467	D	33.8	Very low	30.3	Very low	160 Å²	160	150.7 Å²	150.7	86%	0.856	76%	0.764	S	S	*	*			cis	-120.5	174.2	19.7	-81	-57.2	0	0	0	115.3
468	S	27.9	Very low	30	Very low	119 Å²	119	154.5 Å²	154.5	83%	0.832	77%	0.772	S	S	*	*			trans	-139.8	113.1	173.2	-167.5	0	0	0	0	113.1
469	K	31.4	Very low	30	Very low	197 Å²	197	155.8 Å²	155.8	86%	0.857	77%	0.771	S	S	*	*			trans	-167.6	139.4	162.3	-93.4	159.6	-173.2	178.7	0	102.2
470	E	30	Very low	30.3	Very low	161 Å²	161	155.6 Å²	155.6	75%	0.752	78%	0.777	S	S	*	*			cis	-165.9	179.2	33.8	-136	179.7	158	0	0	111
471	I	27.8	Very low	30.8	Very low	121 Å²	121	153.5 Å²	153.5	62%	0.621	78%	0.777	S	S	*	*			trans	76.2	116.1	145	-76.3	165.4	0	0	0	121.6
472	Q	29	Very low	30.8	Very low	159 Å²	159	156.9 Å²	156.9	74%	0.743	79%	0.787	S	S	*	*			trans	64.8	92.5	140.9	-63.2	174.9	24.3	0	0	123
473	K	26.5	Very low	31.2	Very low	213 Å²	213	155.1 Å²	155.1	93%	0.926	82%	0.822	S	S	*	*				28.7	96.9	101.5	-169.3	-176.3	-174.4	179.9	0	116.9
474	V	28.9	Very low	31	Very low	113 Å²	113	155.4 Å²	155.4	69%	0.685	83%	0.828	S	S	*	*			trans	-125.7	126.4	161.5	-176.1	0	0	0	0	110.3
475	S	23.8	Very low	31.2	Very low	106 Å²	106	156.2 Å²	156.2	74%	0.741	83%	0.833	S	S	*	*			trans	-87.5	136	174.7	52.8	0	0	0	0	111.3
476	W	28.5	Very low	31.2	Very low	235 Å²	235	160.8 Å²	160.8	89%	0.89	85%	0.846	S	S	*	*			trans	-120.6	141	168.3	-78.8	92.7	0	0	0	112
477	I	28.8	Very low	31.2	Very low	147 Å²	147	158.9 Å²	158.9	75%	0.754	85%	0.846	S	S	*	*			trans	-93.9	137.4	-167.1	-65.7	166.5	0	0	0	109.9
478	F	27.2	Very low	31	Very low	196 Å²	196	158.9 Å²	158.9	86%	0.86	85%	0.846	S	S	*	*			trans	-83.4	117.6	178.3	-141.7	-91.3	0	0	0	110.5
479	L	33.6	Very low	31.2	Very low	153 Å²	153	161.5 Å²	161.5	80%	0.801	85%	0.847	S	S	*	*			trans	-123.1	122.9	172	-85.5	169.4	0	0	0	109.9
480	P	34.1	Very low	31.2	Very low	108 Å²	108	159 Å²	159	70%	0.701	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-93.6	121.6	-178.5	33.9	-31.1	0	0	0	112.2
481	S	43.7	Very low	31.3	Very low	128 Å²	128	158.8 Å²	158.8	90%	0.895	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-88.6	122.4	167.7	-69	0	0	0	0	111.2
482	Y	31.4	Very low	31.6	Very low	236 Å²	236	162 Å²	162	93%	0.925	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-99.5	138.2	158.9	-109.2	-91.1	0	0	0	108.8
483	G	44	Very low	31.9	Very low	150 Å²	150	162.3 Å²	162.3	100%	1.546	88%	0.884	S	S	*	*			trans	-160	0	173.6	0	0	0	0	0	109.7

Retrieved 483 of 483 residues in 425.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).