A0A087YLS4_POEFO Loading...

E3 ubiquitin-protein ligase CHFR

AlphaFold DB , UniProt , Accession A0A087YLS4, Species POEFO (Poecilia formosa, Amazon molly), Gene RNF8, Length 514 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.2	Very low	31.7	Very low	230 Å²	230	130 Å²	130	100%	1.133	82%	0.816	S	S	*	*				0	147.7	0	-77.4	159.6	166	0	0	107
2	D	33.5	Very low	32	Very low	160 Å²	160	135.3 Å²	135.3	86%	0.856	82%	0.824	S	S	*	*			trans	55.3	86.8	167.7	-44.5	-32.1	0	0	0	116.5
3	S	28.2	Very low	33	Very low	120 Å²	120	140.2 Å²	140.2	84%	0.839	83%	0.832	S	S	*	*			trans	-90	120	167.9	53.3	0	0	0	0	110.9
4	V	36.9	Very low	33.8	Very low	141 Å²	141	140 Å²	140	86%	0.855	83%	0.825	S	S	*	*			trans	-77.4	132.9	168	177.2	0	0	0	0	109.7
5	A	29.9	Very low	34.2	Very low	96 Å²	96	141.2 Å²	141.2	79%	0.793	83%	0.826	S	S	*	*			trans	-145.4	146.8	162.7	0	0	0	0	0	109.1
6	T	31.8	Very low	34.9	Very low	127 Å²	127	138.9 Å²	138.9	78%	0.779	82%	0.819	S	S	*	*			trans	-107.6	151.6	-170.1	-38.1	0	0	0	0	111.4
7	D	28.1	Very low	35.9	Very low	142 Å²	142	133.9 Å²	133.9	76%	0.759	79%	0.793	S	S	*	*				120	143.7	126.7	-139.3	-8.5	0	0	0	119.4
8	C	24.7	Very low	37.1	Very low	103 Å²	103	131.8 Å²	131.8	70%	0.696	78%	0.777	S	S	*	*			trans	69.3	145.9	154.8	-84.2	0	0	0	0	124.3
9	C	23.9	Very low	39.2	Very low	111 Å²	111	128.3 Å²	128.3	75%	0.75	76%	0.761	S	S	*	*			trans	76	101.8	153	-70.5	0	0	0	0	122
10	S	31.4	Very low	41.5	Very low	104 Å²	104	127.5 Å²	127.5	73%	0.727	75%	0.749	S	S	*	*				67.8	121.8	111.2	-53.8	0	0	0	0	122.5
11	A	41	Very low	43.8	Very low	96 Å²	96	122.3 Å²	122.3	79%	0.793	72%	0.718	S	S	*	*			trans	62	67.8	138.2	0	0	0	0	0	119.3
12	E	35	Very low	46.3	Very low	193 Å²	193	112.8 Å²	112.8	90%	0.902	67%	0.672	S	S	*	*			trans	-103.3	70.3	165.4	-64.3	-89.7	121.1	0	0	110.3
13	E	45.7	Very low	49.2	Very low	200 Å²	200	105.1 Å²	105.1	94%	0.935	63%	0.631	S	S	*	*			trans	-108.9	27.2	172.7	-85.1	-154.1	158.5	0	0	113.3
14	D	43.9	Very low	52.3	Low	137 Å²	137	99.5 Å²	99.5	73%	0.733	59%	0.591	S	S	*	*			trans	-152.5	83	174.1	-157.8	10.1	0	0	0	115
15	D	40.1	Very low	55.1	Low	158 Å²	158	95.3 Å²	95.3	85%	0.845	56%	0.563	S	S	*	*	S	Bend	trans	-155.3	60.3	151.1	-158.5	4.9	0	0	0	113.6
16	C	45	Very low	58.2	Low	105 Å²	105	91 Å²	91	71%	0.709	53%	0.526	S	S	*	.			trans	-155	45.6	167.6	-150.2	0	0	0	0	112.8
17	S	52.2	Low	61	Low	53 Å²	53	88 Å²	88	37%	0.371	51%	0.507	S	S	.	.			trans	-98.9	-8.5	-171.4	56	0	0	0	0	115.1
18	D	56.9	Low	63.8	Low	96 Å²	96	85.1 Å²	85.1	51%	0.513	51%	0.512	S	S	.	.			trans	-109.9	9.2	-171.6	-121.2	-23.9	0	0	0	116.1	E20 K133	D18-E20 PolarHBondContact O-N 2.91Å; D18-K133 WeakPolarHBondContact OD1-CE 3.47Å; D18-K133 IonicContact OD1-NZ 2.62Å; D18-K133 PolarHBondContact OD1-NZ 3.18Å; D18-K133 IonicContact OD2-NZ 2.64Å; D18-K133 PolarHBondContact OD2-NZ 2.98Å
19	S	76.5	Confident	66.8	Low	66 Å²	66	84.3 Å²	84.3	46%	0.462	50%	0.497	S	S	.	.			trans	-62.4	123.2	170.4	-53.7	0	0	0	0	110.4	L132	S19-L132 PolarHBondContact O-N 2.98Å; S19-L132 VanDerWaalsContact O-N 3.11Å
20	E	86.3	Confident	69.8	Low	112 Å²	112	85.2 Å²	85.2	52%	0.523	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	134.3	168.3	-67.4	-162.1	133	0	0	110.2	D18 Q129 R130	D18-E20 PolarHBondContact O-N 2.91Å; E20-Q129 HydrophobicContact CB-CG 3.95Å; E20-Q129 PolarHBondContact OE2-NE2 2.88Å; E20-R130 WeakPolarHBondContact CA-O 3.47Å
21	V	89.7	Confident	72.4	Confident	18 Å²	18	82.4 Å²	82.4	11%	0.109	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	148.7	178.7	-66	0	0	0	0	110.1	Q129 R130 L132 I135	V21-Q129 WeakPolarHBondContact O-CA 3.33Å; V21-R130 WeakPolarHBondContact CG2-O 3.45Å; V21-R130 PolarHBondContact N-O 2.9Å; V21-R130 PolarHBondContact O-N 3.29Å; V21-L132 HydrophobicContact CG1-CB 4.37Å; V21-L132 HydrophobicContact CG2-CB 4.1Å; V21-L132 HydrophobicContact CG2-CD1 4.06Å; V21-I135 HydrophobicContact CG2-CD1 3.52Å; V21-I135 HydrophobicContact CG2-CG1 4.31Å
22	L	92.1	Very high	74.7	Confident	30 Å²	30	80.1 Å²	80.1	16%	0.157	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	133.6	173.8	-73	159.1	0	0	0	110.3	L36 W78 L106 L127 I128 Q129	L22-L36 HydrophobicContact CB-CB 4.27Å; L22-L36 HydrophobicContact CB-CD1 4.28Å; L22-L36 WeakPolarHBondContact O-CB 3.45Å; L22-L36 PolarHBondContact O-N 2.98Å; L22-W78 HydrophobicContact CD1-CG 4.28Å; L22-L106 HydrophobicContact CD2-CD2 3.54Å; L22-L127 HydrophobicContact CB-CD1 4.47Å; L22-L127 HydrophobicContact CD2-CD1 4.18Å; L22-I128 WeakPolarHBondContact CA-O 3.46Å; L22-Q129 HydrophobicContact CD2-CB 3.94Å
23	C	93	Very high	77.5	Confident	0 Å²	0	72 Å²	72	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	158.2	175.3	71.3	0	0	0	0	112.4	L34 I128 I135	C23-L34 CarbonylContact C-O 3.5Å; C23-L34 VanDerWaalsContact CA-O 3.27Å; C23-L34 WeakPolarHBondContact CA-O 3.31Å; C23-L34 WeakPolarHBondContact CB-O 3.3Å; C23-I128 PolarHBondContact N-O 3.38Å; C23-I128 PolarHBondContact O-N 3.41Å; C23-I128 VanDerWaalsContact SG-CG1 3.55Å; C23-I135 HydrophobicContact CB-CD1 3.71Å
24	L	95.2	Very high	79.7	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	101.1	174.3	-61.5	171.3	0	0	0	107.7	W33 L34 L36 F70 I110 Y125 L127	L24-W33 WeakPolarHBondContact O-CA 3.45Å; L24-L34 HydrophobicContact CB-CB 4.08Å; L24-L34 HydrophobicContact CB-CG 4.45Å; L24-L34 HydrophobicContact CD1-CB 4.25Å; L24-L34 HydrophobicContact CD1-CD1 4.18Å; L24-L34 PolarHBondContact N-O 3.35Å; L24-L34 PolarHBondContact O-N 2.91Å; L24-L36 HydrophobicContact CD1-CD2 4.16Å; L24-L36 HydrophobicContact CG-CD2 4.37Å; L24-F70 HydrophobicContact CD1-CD1 4.29Å; L24-F70 HydrophobicContact CD1-CD2 4.14Å; L24-F70 HydrophobicContact CD1-CE1 3.79Å; L24-F70 HydrophobicContact CD1-CE2 3.64Å; L24-F70 HydrophobicContact CD1-CG 4.45Å; L24-F70 HydrophobicContact CD1-CZ 3.45Å; L24-F70 VanDerWaalsContact CD1-CZ 3.45Å; L24-F70 HydrophobicContact CD2-CE1 4.18Å; L24-F70 HydrophobicContact CD2-CZ 4.49Å; L24-I110 HydrophobicContact CD2-CD1 3.98Å; L24-Y125 HydrophobicContact CB-CD1 3.73Å; L24-Y125 HydrophobicContact CB-CE1 4.47Å; L24-Y125 HydrophobicContact CB-CG 4.11Å; L24-Y125 WeakPolarHBondContact O-CD1 3.46Å; L24-L127 HydrophobicContact CD2-CB 4.19Å; L24-L127 HydrophobicContact CD2-CD1 4.03Å
25	M	94.6	Very high	82	Confident	54 Å²	54	59.2 Å²	59.2	27%	0.266	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	123.4	175.9	168.6	173.1	72.1	0	0	109.7	V27 W33 Y125 I126 I128	M25-V27 PolarHBondContact O-N 3.14Å; M25-W33 HydrophobicContact CB-CD2 4.13Å; M25-W33 HydrophobicContact CB-CE3 4.22Å; M25-W33 HydrophobicContact CB-CH2 4.45Å; M25-W33 HydrophobicContact CB-CZ2 4.36Å; M25-W33 HydrophobicContact CB-CZ3 4.37Å; M25-W33 HydrophobicContact CG-CD2 4.13Å; M25-W33 HydrophobicContact CG-CE3 4.44Å; M25-W33 HydrophobicContact CG-CH2 3.94Å; M25-W33 HydrophobicContact CG-CZ2 3.56Å; M25-W33 HydrophobicContact CG-CZ3 4.35Å; M25-W33 HydrophobicContact SD-CH2 3.87Å; M25-W33 HydrophobicContact SD-CZ2 3.86Å; M25-Y125 CarbonylContact O-C 3.42Å; M25-Y125 VanDerWaalsContact O-CA 3.23Å; M25-Y125 WeakPolarHBondContact O-CA 3.3Å; M25-I126 HydrophobicContact CE-CB 4.09Å; M25-I126 HydrophobicContact CE-CD1 4.11Å; M25-I126 HydrophobicContact CE-CG2 4.47Å; M25-I126 PolarHBondContact N-O 3.19Å; M25-I126 PolarHBondContact O-N 2.86Å; M25-I128 HydrophobicContact CB-CD1 3.77Å; M25-I128 HydrophobicContact CB-CG1 4.11Å; M25-I128 HydrophobicContact CE-CG2 4.19Å; M25-I128 HydrophobicContact CG-CD1 4.46Å; M25-I128 HydrophobicContact SD-CD1 4.09Å
26	R	94.5	Very high	84.5	Confident	5 Å²	5	52 Å²	52	2%	0.019	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	120.5	179.4	-173.9	65.1	168.1	-81.5	0.4	110.4	G28 K29 S31 D32 W33 E122 F123 D124 Y125	R26-G28 PolarHBondContact O-N 3.24Å; R26-K29 HydrophobicContact CB-CB 4.24Å; R26-K29 HydrophobicContact CG-CB 3.81Å; R26-K29 HydrophobicContact CG-CD 4.21Å; R26-K29 HydrophobicContact CG-CG 4.13Å; R26-K29 PolarHBondContact O-N 2.91Å; R26-K29 VanDerWaalsContact O-O 3.13Å; R26-S31 WeakPolarHBondContact CB-O 3.38Å; R26-D32 HydrophobicContact CG-CB 4.47Å; R26-D32 IonicContact CZ-OD2 2.69Å; R26-D32 VanDerWaalsContact NH1-CB 3.31Å; R26-D32 IonicContact NH1-OD2 3.55Å; R26-D32 PolarHBondContact NH1-OD2 3.2Å; R26-W33 VanDerWaalsContact N-CD1 3.29Å; R26-E122 VanDerWaalsContact CZ-O 3.28Å; R26-E122 PolarHBondContact NE-O 2.82Å; R26-E122 PolarHBondContact NH2-O 3.44Å; R26-F123 VanDerWaalsContact NH2-CE1 3.28Å; R26-D124 WeakPolarHBondContact CD-O 3.4Å; R26-Y125 HydrophobicContact CB-CD1 4.26Å; R26-Y125 HydrophobicContact CB-CE1 4.02Å; R26-Y125 HydrophobicContact CG-CE1 4.39Å; R26-Y125 PolarHBondContact NH1-OH 2.97Å
27	V	91.9	Very high	86.5	Confident	63 Å²	63	50.7 Å²	50.7	38%	0.382	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	126.6	179.4	179.3	0	0	0	0	109.6	M25 K29 D124 I126	M25-V27 PolarHBondContact O-N 3.14Å; V27-K29 VanDerWaalsContact C-N 3.3Å; V27-K29 PolarHBondContact O-N 3.28Å; V27-D124 HydrophobicContact CB-CB 4.05Å; V27-D124 HydrophobicContact CG2-CB 4.17Å; V27-D124 PolarHBondContact N-O 2.78Å; V27-I126 HydrophobicContact CG2-CD1 3.94Å; V27-I126 HydrophobicContact CG2-CG1 3.78Å
28	G	86.8	Confident	88.1	Confident	83 Å²	83	54.6 Å²	54.6	86%	0.856	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	7.6	178.9	0	0	0	0	0	115.8	R26	R26-G28 PolarHBondContact O-N 3.24Å
29	K	86.8	Confident	89.3	Confident	86 Å²	86	57.5 Å²	57.5	37%	0.374	32%	0.315	S	S	.	.			trans	-133	136.7	170.9	-66.7	-164.3	-175.8	-173.2	0	112.8	R26 V27 S31 D32 W33	R26-K29 HydrophobicContact CB-CB 4.24Å; R26-K29 HydrophobicContact CG-CB 3.81Å; R26-K29 HydrophobicContact CG-CD 4.21Å; R26-K29 HydrophobicContact CG-CG 4.13Å; R26-K29 PolarHBondContact O-N 2.91Å; R26-K29 VanDerWaalsContact O-O 3.13Å; V27-K29 VanDerWaalsContact C-N 3.3Å; V27-K29 PolarHBondContact O-N 3.28Å; K29-S31 PolarHBondContact O-N 3.49Å; K29-D32 WeakPolarHBondContact CD-OD2 3.45Å; K29-D32 IonicContact NZ-OD2 3.58Å; K29-D32 PolarHBondContact NZ-OD2 3.32Å; K29-W33 PolarHBondContact O-NE1 3.09Å
30	N	86.3	Confident	89.8	Confident	129 Å²	129	56.3 Å²	56.3	69%	0.69	31%	0.308	S	S	*	.	S	Bend	trans	-87.6	42.8	165.9	-61.3	3.9	0	0	0	110.3	Y138	N30-Y138 HydrophobicContact CB-CD1 4.08Å; N30-Y138 HydrophobicContact CB-CE1 4.07Å; N30-Y138 WeakPolarHBondContact O-CD1 3.49Å
31	S	87.6	Confident	90.1	Very high	45 Å²	45	53.8 Å²	53.8	32%	0.315	30%	0.297	S	S	.	.	S	Bend	trans	-163	171.4	177.8	77.9	0	0	0	0	109.7	R26 K29 W33 Y138	R26-S31 WeakPolarHBondContact CB-O 3.38Å; K29-S31 PolarHBondContact O-N 3.49Å; S31-W33 VanDerWaalsContact C-N 3.28Å; S31-W33 VanDerWaalsContact O-CD1 3.29Å; S31-W33 PolarHBondContact O-N 2.96Å; S31-Y138 CarbonylContact C-O 3.51Å
32	D	88.6	Confident	90.3	Very high	48 Å²	48	53 Å²	53	26%	0.257	29%	0.292	S	S	.	.			trans	66.2	25.5	174.8	-37.7	-7	0	0	0	113.7	R26 K29 Y138	R26-D32 HydrophobicContact CG-CB 4.47Å; R26-D32 IonicContact CZ-OD2 2.69Å; R26-D32 VanDerWaalsContact NH1-CB 3.31Å; R26-D32 IonicContact NH1-OD2 3.55Å; R26-D32 PolarHBondContact NH1-OD2 3.2Å; K29-D32 WeakPolarHBondContact CD-OD2 3.45Å; K29-D32 IonicContact NZ-OD2 3.58Å; K29-D32 PolarHBondContact NZ-OD2 3.32Å; D32-Y138 PolarHBondContact N-O 3.35Å
33	W	93.4	Very high	90.6	Very high	23 Å²	23	52.8 Å²	52.8	9%	0.087	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-75.8	140.7	176.7	-64.2	17.7	0	0	0	110.2	L24 M25 R26 K29 S31 I128 I135 Y138 L139 V140	L24-W33 WeakPolarHBondContact O-CA 3.45Å; M25-W33 HydrophobicContact CB-CD2 4.13Å; M25-W33 HydrophobicContact CB-CE3 4.22Å; M25-W33 HydrophobicContact CB-CH2 4.45Å; M25-W33 HydrophobicContact CB-CZ2 4.36Å; M25-W33 HydrophobicContact CB-CZ3 4.37Å; M25-W33 HydrophobicContact CG-CD2 4.13Å; M25-W33 HydrophobicContact CG-CE3 4.44Å; M25-W33 HydrophobicContact CG-CH2 3.94Å; M25-W33 HydrophobicContact CG-CZ2 3.56Å; M25-W33 HydrophobicContact CG-CZ3 4.35Å; M25-W33 HydrophobicContact SD-CH2 3.87Å; M25-W33 HydrophobicContact SD-CZ2 3.86Å; R26-W33 VanDerWaalsContact N-CD1 3.29Å; K29-W33 PolarHBondContact O-NE1 3.09Å; S31-W33 VanDerWaalsContact C-N 3.28Å; S31-W33 VanDerWaalsContact O-CD1 3.29Å; S31-W33 PolarHBondContact O-N 2.96Å; W33-I128 HydrophobicContact CZ3-CD1 3.97Å; W33-I135 HydrophobicContact CE3-CB 4.22Å; W33-I135 HydrophobicContact CE3-CG2 4.21Å; W33-I135 HydrophobicContact CZ3-CB 4.3Å; W33-I135 HydrophobicContact CZ3-CG2 3.9Å; W33-Y138 WeakPolarHBondContact CB-O 3.37Å; W33-Y138 HydrophobicContact CD2-CD2 4.44Å; W33-Y138 HydrophobicContact CD2-CG 4.33Å; W33-Y138 HydrophobicContact CE3-CD2 4.23Å; W33-Y138 AromaticContact CH2-CD2 3.72Å; W33-Y138 HydrophobicContact CH2-CD2 3.72Å; W33-Y138 HydrophobicContact CH2-CE2 4.26Å; W33-Y138 HydrophobicContact CH2-CG 4.34Å; W33-Y138 AromaticContact CZ2-CD2 3.95Å; W33-Y138 HydrophobicContact CZ2-CD2 3.95Å; W33-Y138 HydrophobicContact CZ2-CG 4.12Å; W33-Y138 AromaticContact CZ3-CD2 3.88Å; W33-Y138 HydrophobicContact CZ3-CD2 3.88Å; W33-Y138 PolarHBondContact N-O 3.44Å; W33-L139 HydrophobicContact CB-CD2 4.22Å; W33-L139 WeakPolarHBondContact O-CA 3.41Å; W33-L139 WeakPolarHBondContact O-CD2 3.4Å; W33-V140 PolarHBondContact O-N 3.46Å
34	L	93.1	Very high	90.8	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	118.7	-174.4	-44	-175.4	0	0	0	110.3	C23 L24 V44 H52 L54 Y125 V140	C23-L34 CarbonylContact C-O 3.5Å; C23-L34 VanDerWaalsContact CA-O 3.27Å; C23-L34 WeakPolarHBondContact CA-O 3.31Å; C23-L34 WeakPolarHBondContact CB-O 3.3Å; L24-L34 HydrophobicContact CB-CB 4.08Å; L24-L34 HydrophobicContact CB-CG 4.45Å; L24-L34 HydrophobicContact CD1-CB 4.25Å; L24-L34 HydrophobicContact CD1-CD1 4.18Å; L24-L34 PolarHBondContact N-O 3.35Å; L24-L34 PolarHBondContact O-N 2.91Å; L34-V44 HydrophobicContact CD1-CG1 3.99Å; L34-V44 HydrophobicContact CD1-CG2 4.16Å; L34-H52 HydrophobicContact CD1-CB 4.13Å; L34-H52 HydrophobicContact CD2-CB 3.9Å; L34-H52 HydrophobicContact CG-CB 4.46Å; L34-L54 HydrophobicContact CD1-CD2 4.42Å; L34-L54 HydrophobicContact CD2-CD2 4.28Å; L34-Y125 HydrophobicContact CD1-CE1 4.06Å; L34-Y125 HydrophobicContact CD1-CE2 4.46Å; L34-Y125 HydrophobicContact CD2-CE1 4.43Å; L34-Y125 HydrophobicContact CG-CE1 3.77Å; L34-V140 HydrophobicContact CD2-CG2 3.64Å
35	R	92	Very high	90.8	Very high	69 Å²	69	52.8 Å²	52.8	26%	0.26	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	135	173.1	-176.8	171.4	179.6	-173.4	1.9	110.2	F37 H52 L139	R35-F37 HydrophobicContact CB-CE2 4.36Å; R35-F37 HydrophobicContact CB-CZ 4.25Å; R35-F37 HydrophobicContact CG-CD1 4.4Å; R35-F37 HydrophobicContact CG-CE1 4.14Å; R35-F37 HydrophobicContact CG-CE2 4.45Å; R35-F37 HydrophobicContact CG-CZ 4.16Å; R35-H52 PolarHBondContact O-NE2 3.41Å; R35-L139 HydrophobicContact CB-CD1 4.24Å; R35-L139 HydrophobicContact CB-CD2 3.85Å
36	L	91.1	Very high	90.8	Very high	6 Å²	6	54.1 Å²	54.1	3%	0.031	29%	0.294	C	S	.	.			trans	-93.2	137	165.5	-55.9	-176.9	0	0	0	108.8	L22 L24 I42 F70 W78 L127	L22-L36 HydrophobicContact CB-CB 4.27Å; L22-L36 HydrophobicContact CB-CD1 4.28Å; L22-L36 WeakPolarHBondContact O-CB 3.45Å; L22-L36 PolarHBondContact O-N 2.98Å; L24-L36 HydrophobicContact CD1-CD2 4.16Å; L24-L36 HydrophobicContact CG-CD2 4.37Å; L36-I42 HydrophobicContact CB-CD1 4.25Å; L36-I42 HydrophobicContact CD2-CB 4.3Å; L36-I42 HydrophobicContact CD2-CD1 4.2Å; L36-I42 HydrophobicContact CD2-CG1 4.33Å; L36-I42 HydrophobicContact CD2-CG2 4.27Å; L36-F70 HydrophobicContact CD2-CB 3.91Å; L36-F70 HydrophobicContact CD2-CD2 4.46Å; L36-F70 HydrophobicContact CD2-CG 4.08Å; L36-W78 HydrophobicContact CB-CH2 3.87Å; L36-W78 HydrophobicContact CB-CZ2 4.11Å; L36-W78 HydrophobicContact CB-CZ3 4.11Å; L36-W78 HydrophobicContact CD1-CD2 4.13Å; L36-W78 HydrophobicContact CD1-CE3 3.91Å; L36-W78 HydrophobicContact CD1-CZ3 4.22Å; L36-L127 HydrophobicContact CD1-CD1 3.74Å
37	F	87.8	Confident	90.6	Very high	78 Å²	78	54.4 Å²	54.4	34%	0.342	30%	0.298	S	S	.	.			trans	-112.8	120.8	-178.6	-60.9	-84.9	0	0	0	109.2	R35 A40 I42 W78	R35-F37 HydrophobicContact CB-CE2 4.36Å; R35-F37 HydrophobicContact CB-CZ 4.25Å; R35-F37 HydrophobicContact CG-CD1 4.4Å; R35-F37 HydrophobicContact CG-CE1 4.14Å; R35-F37 HydrophobicContact CG-CE2 4.45Å; R35-F37 HydrophobicContact CG-CZ 4.16Å; F37-A40 HydrophobicContact CB-CB 4.11Å; F37-A40 PolarHBondContact O-N 2.75Å; F37-I42 HydrophobicContact CB-CD1 4.47Å; F37-I42 HydrophobicContact CD2-CG1 4.13Å; F37-W78 WeakPolarHBondContact O-CH2 3.34Å
38	E	85	Confident	90.5	Very high	134 Å²	134	57.4 Å²	57.4	63%	0.626	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	146.6	177.7	-58.3	-174	152.6	0	0	111.4	A40	E38-A40 PolarHBondContact O-N 3.04Å; E38-A40 VanDerWaalsContact O-N 3.11Å
39	N	82.2	Confident	90.7	Very high	158 Å²	158	61.8 Å²	61.8	85%	0.845	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	11.3	-177.6	-52.4	-74.2	0	0	0	115.9
40	A	87	Confident	91	Very high	40 Å²	40	58.8 Å²	58.8	33%	0.331	30%	0.304	S	S	.	.	S	Bend	trans	-115.2	155.4	174.2	0	0	0	0	0	112.7	F37 E38	F37-A40 HydrophobicContact CB-CB 4.11Å; F37-A40 PolarHBondContact O-N 2.75Å; E38-A40 PolarHBondContact O-N 3.04Å; E38-A40 VanDerWaalsContact O-N 3.11Å
41	E	93	Very high	91.3	Very high	59 Å²	59	55.9 Å²	55.9	28%	0.276	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	107.4	163.1	-179	170.3	-178.5	0	0	109	T43 S69 R71 K83	E41-T43 HydrophobicContact CG-CG2 4.36Å; E41-T43 PolarHBondContact O-N 3.45Å; E41-S69 WeakPolarHBondContact OE1-CB 3.37Å; E41-S69 PolarHBondContact OE1-OG 2.92Å; E41-R71 IonicContact OE2-CZ 2.88Å; E41-R71 IonicContact OE2-NE 2.85Å; E41-R71 PolarHBondContact OE2-NE 2.88Å; E41-R71 IonicContact OE2-NH2 2.76Å; E41-R71 PolarHBondContact OE2-NH2 2.81Å; E41-K83 VanDerWaalsContact OE1-CE 3.31Å; E41-K83 WeakPolarHBondContact OE1-CE 3.49Å; E41-K83 IonicContact OE1-NZ 2.72Å; E41-K83 PolarHBondContact OE1-NZ 3.09Å
42	I	95.3	Very high	91.6	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	109.5	178.4	-61.4	94.8	0	0	0	107.8	L36 F37 V44 T51 H52 S69 F70 W78	L36-I42 HydrophobicContact CB-CD1 4.25Å; L36-I42 HydrophobicContact CD2-CB 4.3Å; L36-I42 HydrophobicContact CD2-CD1 4.2Å; L36-I42 HydrophobicContact CD2-CG1 4.33Å; L36-I42 HydrophobicContact CD2-CG2 4.27Å; F37-I42 HydrophobicContact CB-CD1 4.47Å; F37-I42 HydrophobicContact CD2-CG1 4.13Å; I42-V44 HydrophobicContact CG2-CG2 4.3Å; I42-T51 HydrophobicContact CG2-CG2 4.01Å; I42-H52 WeakPolarHBondContact CG2-CD2 3.46Å; I42-S69 CarbonylContact O-C 3.54Å; I42-S69 WeakPolarHBondContact O-CA 3.34Å; I42-S69 WeakPolarHBondContact O-CB 3.43Å; I42-F70 HydrophobicContact CB-CB 4.39Å; I42-F70 PolarHBondContact N-O 2.87Å; I42-F70 PolarHBondContact O-N 3.39Å; I42-W78 HydrophobicContact CD1-CH2 3.49Å; I42-W78 VanDerWaalsContact CD1-CH2 3.49Å; I42-W78 HydrophobicContact CD1-CZ3 3.55Å
43	T	96.9	Very high	91.9	Very high	27 Å²	27	56.2 Å²	56.2	17%	0.166	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	139.9	177.7	50	0	0	0	0	110.7	E41 V50 T51 H52 L66	E41-T43 HydrophobicContact CG-CG2 4.36Å; E41-T43 PolarHBondContact O-N 3.45Å; T43-V50 VanDerWaalsContact OG1-CA 3.3Å; T43-V50 WeakPolarHBondContact OG1-CA 3.47Å; T43-T51 PolarHBondContact N-OG1 3.3Å; T43-T51 WeakPolarHBondContact O-CA 3.19Å; T43-T51 WeakPolarHBondContact O-CB 3.32Å; T43-T51 PolarHBondContact O-N 3.44Å; T43-T51 PolarHBondContact OG1-N 3.48Å; T43-T51 PolarHBondContact OG1-OG1 3.23Å; T43-T51 VanDerWaalsContact OG1-OG1 3.09Å; T43-H52 PolarHBondContact O-N 3.4Å; T43-L66 HydrophobicContact CG2-CD1 3.81Å
44	V	96.9	Very high	91.9	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	135.9	-176.6	-173.3	0	0	0	0	109.4	L34 I42 H52 L54 H67 C68 F70 L112	L34-V44 HydrophobicContact CD1-CG1 3.99Å; L34-V44 HydrophobicContact CD1-CG2 4.16Å; I42-V44 HydrophobicContact CG2-CG2 4.3Å; V44-H52 HydrophobicContact CG2-CB 4.32Å; V44-L54 HydrophobicContact CG1-CD1 3.41Å; V44-L54 VanDerWaalsContact CG1-CD1 3.41Å; V44-L54 HydrophobicContact CG1-CD2 4.44Å; V44-L54 HydrophobicContact CG1-CG 3.72Å; V44-H67 WeakPolarHBondContact O-CA 3.21Å; V44-H67 WeakPolarHBondContact O-CB 3.5Å; V44-H67 PolarHBondContact O-N 3.19Å; V44-C68 PolarHBondContact N-O 2.9Å; V44-C68 PolarHBondContact O-N 3.05Å; V44-C68 VanDerWaalsContact O-N 3.12Å; V44-F70 HydrophobicContact CB-CE2 4.48Å; V44-F70 HydrophobicContact CG2-CD2 3.92Å; V44-F70 HydrophobicContact CG2-CE2 3.77Å; V44-L112 HydrophobicContact CG1-CD1 4.01Å
45	G	95.8	Very high	91.7	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.3	-174.2	-176.1	0	0	0	0	0	111.7	H52 Q53 L54 S64 R65	G45-H52 PolarHBondContact N-O 3.04Å; G45-Q53 CarbonylContact O-C 3.58Å; G45-Q53 WeakPolarHBondContact O-CA 3.22Å; G45-L54 PolarHBondContact O-N 3.37Å; G45-S64 CarbonylContact C-O 3.59Å; G45-S64 VanDerWaalsContact CA-O 3.24Å; G45-S64 WeakPolarHBondContact CA-O 3.47Å; G45-R65 CarbonylContact C-O 3.59Å; G45-R65 WeakPolarHBondContact CA-O 3.3Å
46	R	94.7	Very high	91.5	Very high	81 Å²	81	58.7 Å²	58.7	31%	0.306	31%	0.306	S	S	.	.	S	Bend	trans	-95.5	0.2	179.5	71.6	172.9	175.6	91	-6.9	115.3	Q53 L54 P60 I63 S64 R65	R46-Q53 PolarHBondContact O-NE2 3.31Å; R46-L54 WeakPolarHBondContact CA-O 3.39Å; R46-L54 VanDerWaalsContact CB-O 3.26Å; R46-L54 WeakPolarHBondContact CB-O 3.23Å; R46-P60 WeakPolarHBondContact CD-O 3.21Å; R46-P60 PolarHBondContact NE-O 2.93Å; R46-I63 HydrophobicContact CB-CB 4.43Å; R46-I63 HydrophobicContact CB-CG2 4.28Å; R46-I63 WeakPolarHBondContact CD-O 3.49Å; R46-I63 WeakPolarHBondContact CG-O 3.4Å; R46-I63 PolarHBondContact NE-O 3.48Å; R46-S64 PolarHBondContact N-O 3.43Å; R46-R65 HydrophobicContact CG-CG 4.33Å; R46-R65 PolarHBondContact N-O 2.98Å
47	G	90.9	Very high	91.2	Very high	11 Å²	11	63.9 Å²	63.9	11%	0.113	34%	0.343	C	S	.	.	S	Bend	trans	-73.3	162.8	176	0	0	0	0	0	111.8	E49 V50 Q53 R65	G47-E49 VanDerWaalsContact C-N 3.29Å; G47-V50 WeakPolarHBondContact O-CG2 3.48Å; G47-Q53 WeakPolarHBondContact O-CG 3.35Å; G47-Q53 PolarHBondContact O-NE2 3.47Å; G47-R65 WeakPolarHBondContact CA-O 3.31Å; G47-R65 PolarHBondContact N-O 3.08Å
48	V	89.8	Confident	90.9	Very high	127 Å²	127	64.8 Å²	64.8	77%	0.77	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-8.6	173.7	-63	0	0	0	0	113.1
49	E	89.8	Confident	90.9	Very high	174 Å²	174	60.3 Å²	60.3	81%	0.813	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	6.4	-176.3	-58.5	168.4	154.5	0	0	113.1	G47	G47-E49 VanDerWaalsContact C-N 3.29Å
50	V	93.1	Very high	91.2	Very high	24 Å²	24	56.7 Å²	56.7	15%	0.145	32%	0.323	C	S	.	.	S	Bend	trans	-109	155.4	-173.6	-52.6	0	0	0	0	112.4	T43 G47 H52 Q53 R65 L66	T43-V50 VanDerWaalsContact OG1-CA 3.3Å; T43-V50 WeakPolarHBondContact OG1-CA 3.47Å; G47-V50 WeakPolarHBondContact O-CG2 3.48Å; V50-H52 WeakPolarHBondContact CG2-O 3.45Å; V50-H52 PolarHBondContact O-N 2.87Å; V50-Q53 HydrophobicContact CG2-CB 4.42Å; V50-R65 WeakPolarHBondContact CG1-O 3.18Å; V50-L66 HydrophobicContact CG1-CD1 4.02Å
51	T	93.8	Very high	91.3	Very high	67 Å²	67	60.8 Å²	60.8	41%	0.411	34%	0.339	S	S	.	.	S	Bend	trans	-62.9	-40.4	-178.4	-43.8	0	0	0	0	113.1	I42 T43	I42-T51 HydrophobicContact CG2-CG2 4.01Å; T43-T51 PolarHBondContact N-OG1 3.3Å; T43-T51 WeakPolarHBondContact O-CA 3.19Å; T43-T51 WeakPolarHBondContact O-CB 3.32Å; T43-T51 PolarHBondContact O-N 3.44Å; T43-T51 PolarHBondContact OG1-N 3.48Å; T43-T51 PolarHBondContact OG1-OG1 3.23Å; T43-T51 VanDerWaalsContact OG1-OG1 3.09Å
52	H	93.4	Very high	91.3	Very high	21 Å²	21	59 Å²	59	10%	0.097	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	106.5	174.7	-66.2	-63.9	0	0	0	110.4	L34 R35 I42 T43 V44 G45 V50	L34-H52 HydrophobicContact CD1-CB 4.13Å; L34-H52 HydrophobicContact CD2-CB 3.9Å; L34-H52 HydrophobicContact CG-CB 4.46Å; R35-H52 PolarHBondContact O-NE2 3.41Å; I42-H52 WeakPolarHBondContact CG2-CD2 3.46Å; T43-H52 PolarHBondContact O-N 3.4Å; V44-H52 HydrophobicContact CG2-CB 4.32Å; G45-H52 PolarHBondContact N-O 3.04Å; V50-H52 WeakPolarHBondContact CG2-O 3.45Å; V50-H52 PolarHBondContact O-N 2.87Å
53	Q	94.9	Very high	91.3	Very high	79 Å²	79	59.1 Å²	59.1	37%	0.369	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	123	177.8	-168.3	176.2	25.5	0	0	110.8	G45 R46 G47 V50 L55	G45-Q53 CarbonylContact O-C 3.58Å; G45-Q53 WeakPolarHBondContact O-CA 3.22Å; R46-Q53 PolarHBondContact O-NE2 3.31Å; G47-Q53 WeakPolarHBondContact O-CG 3.35Å; G47-Q53 PolarHBondContact O-NE2 3.47Å; V50-Q53 HydrophobicContact CG2-CB 4.42Å; Q53-L55 HydrophobicContact CG-CD2 4.1Å; Q53-L55 HydrophobicContact CG-CG 4.22Å
54	L	93.3	Very high	91.2	Very high	7 Å²	7	58.9 Å²	58.9	4%	0.037	33%	0.331	C	S	.	.			trans	-103.5	114	175.8	-60.5	-174.4	0	0	0	110.1	L34 V44 G45 R46 I63 L112 F123 Y125	L34-L54 HydrophobicContact CD1-CD2 4.42Å; L34-L54 HydrophobicContact CD2-CD2 4.28Å; V44-L54 HydrophobicContact CG1-CD1 3.41Å; V44-L54 VanDerWaalsContact CG1-CD1 3.41Å; V44-L54 HydrophobicContact CG1-CD2 4.44Å; V44-L54 HydrophobicContact CG1-CG 3.72Å; G45-L54 PolarHBondContact O-N 3.37Å; R46-L54 WeakPolarHBondContact CA-O 3.39Å; R46-L54 VanDerWaalsContact CB-O 3.26Å; R46-L54 WeakPolarHBondContact CB-O 3.23Å; L54-I63 HydrophobicContact CB-CG2 4.27Å; L54-L112 HydrophobicContact CD1-CD1 3.58Å; L54-F123 HydrophobicContact CB-CD1 4.22Å; L54-F123 HydrophobicContact CB-CE1 3.81Å; L54-F123 HydrophobicContact CB-CZ 4.34Å; L54-F123 HydrophobicContact CD1-CD1 3.74Å; L54-F123 HydrophobicContact CD1-CE1 4.21Å; L54-F123 HydrophobicContact CD1-CG 4.32Å; L54-F123 HydrophobicContact CD2-CD1 4.17Å; L54-F123 HydrophobicContact CD2-CE1 4.14Å; L54-F123 HydrophobicContact CG-CD1 4.27Å; L54-F123 HydrophobicContact CG-CE1 4.27Å; L54-Y125 HydrophobicContact CD1-CE2 4.49Å; L54-Y125 VanDerWaalsContact CD2-OH 3.3Å; L54-Y125 WeakPolarHBondContact CD2-OH 3.39Å
55	L	89.9	Confident	91.1	Very high	125 Å²	125	64.9 Å²	64.9	65%	0.654	35%	0.353	S	S	*	.			trans	-110.6	127.6	174.9	-59.7	179.6	0	0	0	109.3	Q53	Q53-L55 HydrophobicContact CG-CD2 4.1Å; Q53-L55 HydrophobicContact CG-CG 4.22Å
56	S	87.6	Confident	91	Very high	13 Å²	13	68.3 Å²	68.3	9%	0.091	37%	0.371	C	S	.	.			trans	-101.9	132.3	173.3	174.8	0	0	0	0	109	T58 C59 P60 E122	S56-T58 PolarHBondContact OG-N 2.91Å; S56-C59 WeakPolarHBondContact CB-O 3.45Å; S56-C59 PolarHBondContact OG-N 3.46Å; S56-C59 PolarHBondContact OG-O 3.33Å; S56-P60 WeakPolarHBondContact O-CG 3.38Å; S56-E122 WeakPolarHBondContact CA-OE1 3.47Å; S56-E122 WeakPolarHBondContact CB-OE1 3.35Å; S56-E122 VanDerWaalsContact CB-OE2 3.3Å; S56-E122 WeakPolarHBondContact CB-OE2 3.44Å; S56-E122 VanDerWaalsContact OG-CD 3.24Å; S56-E122 PolarHBondContact OG-OE1 3.05Å; S56-E122 PolarHBondContact OG-OE2 3.09Å
57	S	83.7	Confident	91.1	Very high	114 Å²	114	64.5 Å²	64.5	80%	0.797	36%	0.357	S	S	*	.	S	Bend	trans	-78.6	-32.5	169.2	50.8	0	0	0	0	112.1
58	T	83.1	Confident	91.4	Very high	97 Å²	97	64 Å²	64	60%	0.595	35%	0.351	S	S	*	.	S	Bend	trans	-82.8	-39.3	-174.9	-49.5	0	0	0	0	112.8	S56 L116	S56-T58 PolarHBondContact OG-N 2.91Å; T58-L116 HydrophobicContact CG2-CD1 4Å
59	C	84.6	Confident	91.8	Very high	40 Å²	40	57.9 Å²	57.9	27%	0.27	32%	0.315	S	S	.	.			trans	-146.9	77.5	-177.5	-88.3	0	0	0	0	111.6	S56 L61 M62 L116	S56-C59 WeakPolarHBondContact CB-O 3.45Å; S56-C59 PolarHBondContact OG-N 3.46Å; S56-C59 PolarHBondContact OG-O 3.33Å; C59-L61 PolarHBondContact O-N 2.73Å; C59-M62 HydrophobicContact CB-CB 4.1Å; C59-M62 VanDerWaalsContact O-CB 3.32Å; C59-M62 WeakPolarHBondContact O-CB 3.46Å; C59-M62 PolarHBondContact O-N 3.39Å; C59-L116 HydrophobicContact CB-CD1 4.43Å
60	P	88.4	Confident	92.1	Very high	82 Å²	82	49.7 Å²	49.7	53%	0.532	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-13.3	-178.4	-25.6	32.2	0	0	0	116.4	R46 S56	R46-P60 WeakPolarHBondContact CD-O 3.21Å; R46-P60 PolarHBondContact NE-O 2.93Å; S56-P60 WeakPolarHBondContact O-CG 3.38Å
61	L	88.9	Confident	92.2	Very high	127 Å²	127	55 Å²	55	67%	0.665	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	-2.7	178.4	-59.4	-178.9	0	0	0	114.1	C59 I63	C59-L61 PolarHBondContact O-N 2.73Å; L61-I63 VanDerWaalsContact C-N 3.28Å; L61-I63 PolarHBondContact O-N 2.89Å
62	M	92.6	Very high	92.2	Very high	21 Å²	21	53.9 Å²	53.9	10%	0.103	28%	0.284	C	S	.	.	S	Bend	trans	-60.8	-38.5	178.1	-178.4	59	74.8	0	0	112	C59 H67 N87 V114 L116	C59-M62 HydrophobicContact CB-CB 4.1Å; C59-M62 VanDerWaalsContact O-CB 3.32Å; C59-M62 WeakPolarHBondContact O-CB 3.46Å; C59-M62 PolarHBondContact O-N 3.39Å; M62-H67 PolarHBondContact O-CE1 3.48Å; M62-N87 PolarHBondContact O-ND2 2.9Å; M62-N87 HydrophobicContact SD-CB 4.25Å; M62-V114 HydrophobicContact CE-CG2 4.02Å; M62-V114 WeakPolarHBondContact CE-O 3.36Å; M62-V114 HydrophobicContact SD-CG2 3.85Å; M62-V114 PolarHBondContact SD-N 3.21Å; M62-L116 HydrophobicContact CE-CD2 3.62Å; M62-L116 HydrophobicContact CE-CG 4.21Å
63	I	95.7	Very high	92	Very high	4 Å²	4	57.1 Å²	57.1	2%	0.021	30%	0.298	C	S	.	.	S	Bend	trans	-95.7	137.6	-179.8	-58.2	-56.5	0	0	0	110.3	R46 L54 L61 H67 L112 F123	R46-I63 HydrophobicContact CB-CB 4.43Å; R46-I63 HydrophobicContact CB-CG2 4.28Å; R46-I63 WeakPolarHBondContact CD-O 3.49Å; R46-I63 WeakPolarHBondContact CG-O 3.4Å; R46-I63 PolarHBondContact NE-O 3.48Å; L54-I63 HydrophobicContact CB-CG2 4.27Å; L61-I63 VanDerWaalsContact C-N 3.28Å; L61-I63 PolarHBondContact O-N 2.89Å; I63-H67 HydrophobicContact CG2-CB 4.03Å; I63-L112 HydrophobicContact CD1-CB 3.79Å; I63-L112 WeakPolarHBondContact CD1-O 3.21Å; I63-F123 HydrophobicContact CD1-CB 4.34Å; I63-F123 HydrophobicContact CD1-CD2 3.72Å; I63-F123 HydrophobicContact CD1-CE2 4.29Å; I63-F123 HydrophobicContact CD1-CG 4.1Å; I63-F123 HydrophobicContact CG1-CD2 3.77Å; I63-F123 HydrophobicContact CG1-CE2 3.81Å; I63-F123 HydrophobicContact CG1-CG 4.34Å; I63-F123 HydrophobicContact CG1-CZ 4.41Å
64	S	95	Very high	91.7	Very high	21 Å²	21	63.4 Å²	63.4	15%	0.147	33%	0.327	C	S	.	.			trans	-78.8	154.9	176.4	-63.5	0	0	0	0	111.2	G45 R46 L66 H67 S85 L86	G45-S64 CarbonylContact C-O 3.59Å; G45-S64 VanDerWaalsContact CA-O 3.24Å; G45-S64 WeakPolarHBondContact CA-O 3.47Å; R46-S64 PolarHBondContact N-O 3.43Å; S64-L66 CarbonylContact C-O 3.55Å; S64-L66 WeakPolarHBondContact CB-O 3.23Å; S64-L66 PolarHBondContact O-N 3.02Å; S64-H67 PolarHBondContact N-ND1 2.93Å; S64-S85 WeakPolarHBondContact OG-CA 3.47Å; S64-L86 PolarHBondContact OG-N 3.16Å
65	R	93.4	Very high	91.3	Very high	128 Å²	128	67.4 Å²	67.4	48%	0.483	35%	0.348	S	S	.	.	S	Bend	trans	-56.4	-49.3	-175.1	-82.4	178.1	-71.6	-148.5	-8.6	112.1	G45 R46 G47 V50	G45-R65 CarbonylContact C-O 3.59Å; G45-R65 WeakPolarHBondContact CA-O 3.3Å; R46-R65 HydrophobicContact CG-CG 4.33Å; R46-R65 PolarHBondContact N-O 2.98Å; G47-R65 WeakPolarHBondContact CA-O 3.31Å; G47-R65 PolarHBondContact N-O 3.08Å; V50-R65 WeakPolarHBondContact CG1-O 3.18Å
66	L	95.4	Very high	91	Very high	72 Å²	72	63.1 Å²	63.1	38%	0.377	34%	0.335	S	S	.	.	S	Bend	trans	-107.4	128.1	152.3	177.8	64.3	0	0	0	104.9	T43 V50 S64 K83	T43-L66 HydrophobicContact CG2-CD1 3.81Å; V50-L66 HydrophobicContact CG1-CD1 4.02Å; S64-L66 CarbonylContact C-O 3.55Å; S64-L66 WeakPolarHBondContact CB-O 3.23Å; S64-L66 PolarHBondContact O-N 3.02Å; L66-K83 HydrophobicContact CD1-CG 4.36Å; L66-K83 HydrophobicContact CD2-CB 3.87Å; L66-K83 HydrophobicContact CD2-CD 4.16Å; L66-K83 HydrophobicContact CD2-CG 3.86Å; L66-K83 HydrophobicContact CG-CB 3.76Å; L66-K83 HydrophobicContact CG-CG 3.88Å
67	H	96.6	Very high	91.2	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.348	C	S	.	.			trans	-111.2	-52.1	-176.9	-164	122.5	0	0	0	110.2	V44 M62 I63 S64 K83 S85 G88 V89 G113	V44-H67 WeakPolarHBondContact O-CA 3.21Å; V44-H67 WeakPolarHBondContact O-CB 3.5Å; V44-H67 PolarHBondContact O-N 3.19Å; M62-H67 PolarHBondContact O-CE1 3.48Å; I63-H67 HydrophobicContact CG2-CB 4.03Å; S64-H67 PolarHBondContact N-ND1 2.93Å; H67-K83 PolarHBondContact O-N 3.04Å; H67-S85 WeakPolarHBondContact CD2-CB 3.29Å; H67-S85 PolarHBondContact NE2-OG 2.92Å; H67-G88 PolarHBondContact NE2-O 3.14Å; H67-V89 WeakPolarHBondContact NE2-CG2 3.36Å; H67-V89 PolarHBondContact NE2-N 3.48Å; H67-G113 WeakPolarHBondContact CE1-CA 3.25Å; H67-G113 PolarHBondContact CE1-N 3.28Å; H67-G113 PolarHBondContact NE2-N 3.11Å
68	C	97.4	Very high	91.7	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	173.6	174.1	61	0	0	0	0	111	V44 V80 T81 V89	V44-C68 PolarHBondContact N-O 2.9Å; V44-C68 PolarHBondContact O-N 3.05Å; V44-C68 VanDerWaalsContact O-N 3.12Å; C68-V80 HydrophobicContact CB-CG2 4.12Å; C68-T81 CarbonylContact C-O 3.54Å; C68-T81 WeakPolarHBondContact CA-O 3.49Å; C68-T81 VanDerWaalsContact CB-O 3.29Å; C68-T81 WeakPolarHBondContact CB-O 3.28Å; C68-V89 HydrophobicContact CB-CG2 3.86Å
69	S	97	Very high	92.3	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	155.3	157.5	69.6	0	0	0	0	111.8	E41 I42 V80 T81 K83	E41-S69 WeakPolarHBondContact OE1-CB 3.37Å; E41-S69 PolarHBondContact OE1-OG 2.92Å; I42-S69 CarbonylContact O-C 3.54Å; I42-S69 WeakPolarHBondContact O-CA 3.34Å; I42-S69 WeakPolarHBondContact O-CB 3.43Å; S69-V80 CarbonylContact O-C 3.59Å; S69-V80 WeakPolarHBondContact O-CA 3.48Å; S69-T81 PolarHBondContact N-O 2.96Å; S69-T81 PolarHBondContact O-N 3.45Å; S69-K83 WeakPolarHBondContact OG-CE 3.37Å; S69-K83 PolarHBondContact OG-NZ 3.48Å
70	F	96.8	Very high	92.9	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.009	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	132.5	172.4	-59	-97.1	0	0	0	108.1	L24 L36 I42 V44 W78 T79 V80 L104 I110	L24-F70 HydrophobicContact CD1-CD1 4.29Å; L24-F70 HydrophobicContact CD1-CD2 4.14Å; L24-F70 HydrophobicContact CD1-CE1 3.79Å; L24-F70 HydrophobicContact CD1-CE2 3.64Å; L24-F70 HydrophobicContact CD1-CG 4.45Å; L24-F70 HydrophobicContact CD1-CZ 3.45Å; L24-F70 VanDerWaalsContact CD1-CZ 3.45Å; L24-F70 HydrophobicContact CD2-CE1 4.18Å; L24-F70 HydrophobicContact CD2-CZ 4.49Å; L36-F70 HydrophobicContact CD2-CB 3.91Å; L36-F70 HydrophobicContact CD2-CD2 4.46Å; L36-F70 HydrophobicContact CD2-CG 4.08Å; I42-F70 HydrophobicContact CB-CB 4.39Å; I42-F70 PolarHBondContact N-O 2.87Å; I42-F70 PolarHBondContact O-N 3.39Å; V44-F70 HydrophobicContact CB-CE2 4.48Å; V44-F70 HydrophobicContact CG2-CD2 3.92Å; V44-F70 HydrophobicContact CG2-CE2 3.77Å; F70-W78 HydrophobicContact CB-CE3 4.2Å; F70-W78 HydrophobicContact CB-CZ3 4.14Å; F70-T79 CarbonylContact C-O 3.47Å; F70-T79 VanDerWaalsContact CA-O 3.24Å; F70-T79 WeakPolarHBondContact CA-O 3.24Å; F70-V80 HydrophobicContact CD1-CB 3.85Å; F70-V80 HydrophobicContact CD1-CG2 4.05Å; F70-V80 HydrophobicContact CE1-CB 3.72Å; F70-V80 HydrophobicContact CE1-CG2 3.64Å; F70-V80 HydrophobicContact CE2-CG2 4.4Å; F70-V80 HydrophobicContact CZ-CB 4.42Å; F70-V80 HydrophobicContact CZ-CG2 3.83Å; F70-L104 HydrophobicContact CD1-CD1 3.79Å; F70-L104 HydrophobicContact CE1-CD1 3.82Å; F70-I110 HydrophobicContact CE1-CG2 4.45Å; F70-I110 HydrophobicContact CZ-CG2 4.22Å
71	R	94.9	Very high	93.3	Very high	136 Å²	136	52.4 Å²	52.4	51%	0.513	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	135.7	179	-168	-167.5	-84.7	-147.8	-1.5	110.1	E41 T79	E41-R71 IonicContact OE2-CZ 2.88Å; E41-R71 IonicContact OE2-NE 2.85Å; E41-R71 PolarHBondContact OE2-NE 2.88Å; E41-R71 IonicContact OE2-NH2 2.76Å; E41-R71 PolarHBondContact OE2-NH2 2.81Å; R71-T79 PolarHBondContact N-O 3.36Å; R71-T79 PolarHBondContact O-N 3.26Å; R71-T79 PolarHBondContact O-OG1 2.91Å
72	Q	93.5	Very high	93.7	Very high	43 Å²	43	46.4 Å²	46.4	20%	0.201	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	136.1	167.6	-156.3	169.2	17.6	0	0	110.3	G76 Q77 W78	Q72-G76 WeakPolarHBondContact CG-O 3.23Å; Q72-G76 PolarHBondContact NE2-O 3.07Å; Q72-Q77 WeakPolarHBondContact CA-O 3.31Å; Q72-W78 HydrophobicContact CB-CD2 4.09Å; Q72-W78 HydrophobicContact CB-CE3 4.4Å; Q72-W78 HydrophobicContact CB-CH2 4.05Å; Q72-W78 HydrophobicContact CB-CZ2 3.72Å; Q72-W78 HydrophobicContact CB-CZ3 4.38Å; Q72-W78 HydrophobicContact CG-CD2 4.36Å; Q72-W78 HydrophobicContact CG-CZ2 4.15Å
73	K	90.3	Very high	93.9	Very high	89 Å²	89	48.6 Å²	48.6	39%	0.387	23%	0.232	S	C	.	.			trans	-83.8	169.2	171.5	-77.9	168.7	164.3	-174.9	0	111.5	D75 G76 Q77 T79	K73-D75 WeakPolarHBondContact CB-OD1 3.49Å; K73-D75 WeakPolarHBondContact CD-OD1 3.43Å; K73-D75 IonicContact NZ-OD2 3.41Å; K73-D75 PolarHBondContact O-N 3.23Å; K73-G76 PolarHBondContact O-N 3.08Å; K73-Q77 HydrophobicContact CD-CB 4.29Å; K73-Q77 PolarHBondContact N-O 2.7Å; K73-T79 HydrophobicContact CD-CG2 3.99Å; K73-T79 HydrophobicContact CG-CG2 4.16Å
74	E	87	Confident	93.9	Very high	210 Å²	210	54.8 Å²	54.8	98%	0.981	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-23.2	171.8	-62.7	171.3	-168.2	0	0	113.4	G76	E74-G76 PolarHBondContact O-N 2.78Å
75	D	85.1	Confident	93.9	Very high	91 Å²	91	54.1 Å²	54.1	49%	0.487	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	7.2	173	63.8	16.5	0	0	0	113.4	K73 Q77	K73-D75 WeakPolarHBondContact CB-OD1 3.49Å; K73-D75 WeakPolarHBondContact CD-OD1 3.43Å; K73-D75 IonicContact NZ-OD2 3.41Å; K73-D75 PolarHBondContact O-N 3.23Å; D75-Q77 PolarHBondContact O-N 3.35Å; D75-Q77 WeakPolarHBondContact OD1-CB 3.36Å; D75-Q77 VanDerWaalsContact OD1-CG 3.24Å; D75-Q77 WeakPolarHBondContact OD1-CG 3.3Å; D75-Q77 PolarHBondContact OD1-N 3.09Å
76	G	84.9	Confident	93.8	Very high	36 Å²	36	54.6 Å²	54.6	37%	0.371	27%	0.265	S	S	.	.	S	Bend	trans	77.3	-8.8	-177.2	0	0	0	0	0	114.9	Q72 K73 E74	Q72-G76 WeakPolarHBondContact CG-O 3.23Å; Q72-G76 PolarHBondContact NE2-O 3.07Å; K73-G76 PolarHBondContact O-N 3.08Å; E74-G76 PolarHBondContact O-N 2.78Å
77	Q	90.2	Very high	93.8	Very high	80 Å²	80	53.2 Å²	53.2	37%	0.374	26%	0.258	S	S	.	.			trans	-76	144.4	-176.3	-58.7	172.6	12.7	0	0	111.8	Q72 K73 D75 L103	Q72-Q77 WeakPolarHBondContact CA-O 3.31Å; K73-Q77 HydrophobicContact CD-CB 4.29Å; K73-Q77 PolarHBondContact N-O 2.7Å; D75-Q77 PolarHBondContact O-N 3.35Å; D75-Q77 WeakPolarHBondContact OD1-CB 3.36Å; D75-Q77 VanDerWaalsContact OD1-CG 3.24Å; D75-Q77 WeakPolarHBondContact OD1-CG 3.3Å; D75-Q77 PolarHBondContact OD1-N 3.09Å; Q77-L103 HydrophobicContact CB-CD1 3.72Å; Q77-L103 HydrophobicContact CG-CD1 4.27Å
78	W	94.3	Very high	93.7	Very high	13 Å²	13	53.2 Å²	53.2	5%	0.049	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	139.7	176.8	-79.7	82.4	0	0	0	112.1	L22 L36 F37 I42 F70 Q72 L104	L22-W78 HydrophobicContact CD1-CG 4.28Å; L36-W78 HydrophobicContact CB-CH2 3.87Å; L36-W78 HydrophobicContact CB-CZ2 4.11Å; L36-W78 HydrophobicContact CB-CZ3 4.11Å; L36-W78 HydrophobicContact CD1-CD2 4.13Å; L36-W78 HydrophobicContact CD1-CE3 3.91Å; L36-W78 HydrophobicContact CD1-CZ3 4.22Å; F37-W78 WeakPolarHBondContact O-CH2 3.34Å; I42-W78 HydrophobicContact CD1-CH2 3.49Å; I42-W78 VanDerWaalsContact CD1-CH2 3.49Å; I42-W78 HydrophobicContact CD1-CZ3 3.55Å; F70-W78 HydrophobicContact CB-CE3 4.2Å; F70-W78 HydrophobicContact CB-CZ3 4.14Å; Q72-W78 HydrophobicContact CB-CD2 4.09Å; Q72-W78 HydrophobicContact CB-CE3 4.4Å; Q72-W78 HydrophobicContact CB-CH2 4.05Å; Q72-W78 HydrophobicContact CB-CZ2 3.72Å; Q72-W78 HydrophobicContact CB-CZ3 4.38Å; Q72-W78 HydrophobicContact CG-CD2 4.36Å; Q72-W78 HydrophobicContact CG-CZ2 4.15Å; W78-L104 PolarHBondContact O-N 3.42Å
79	T	96.1	Very high	93.7	Very high	7 Å²	7	53.2 Å²	53.2	4%	0.043	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	148	176.2	57.6	0	0	0	0	111.1	F70 R71 K73 P101 H102	F70-T79 CarbonylContact C-O 3.47Å; F70-T79 VanDerWaalsContact CA-O 3.24Å; F70-T79 WeakPolarHBondContact CA-O 3.24Å; R71-T79 PolarHBondContact N-O 3.36Å; R71-T79 PolarHBondContact O-N 3.26Å; R71-T79 PolarHBondContact O-OG1 2.91Å; K73-T79 HydrophobicContact CD-CG2 3.99Å; K73-T79 HydrophobicContact CG-CG2 4.16Å; T79-P101 HydrophobicContact CG2-CB 4.27Å; T79-H102 CarbonylContact C-O 3.5Å; T79-H102 WeakPolarHBondContact CA-O 3.37Å; T79-H102 WeakPolarHBondContact CB-O 3.43Å
80	V	97.2	Very high	93.7	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	137.9	166.7	60.8	0	0	0	0	109.8	C68 S69 F70 V89 V91 I96 H102 L104	C68-V80 HydrophobicContact CB-CG2 4.12Å; S69-V80 CarbonylContact O-C 3.59Å; S69-V80 WeakPolarHBondContact O-CA 3.48Å; F70-V80 HydrophobicContact CD1-CB 3.85Å; F70-V80 HydrophobicContact CD1-CG2 4.05Å; F70-V80 HydrophobicContact CE1-CB 3.72Å; F70-V80 HydrophobicContact CE1-CG2 3.64Å; F70-V80 HydrophobicContact CE2-CG2 4.4Å; F70-V80 HydrophobicContact CZ-CB 4.42Å; F70-V80 HydrophobicContact CZ-CG2 3.83Å; V80-V89 HydrophobicContact CG2-CG1 4.3Å; V80-V91 HydrophobicContact CG1-CG2 3.86Å; V80-I96 HydrophobicContact CG1-CD1 3.92Å; V80-I96 HydrophobicContact CG2-CD1 4.44Å; V80-H102 HydrophobicContact CG1-CB 4.14Å; V80-H102 PolarHBondContact N-O 3.34Å; V80-H102 PolarHBondContact O-N 2.96Å; V80-L104 HydrophobicContact CB-CD1 4.03Å; V80-L104 HydrophobicContact CB-CG 4.35Å; V80-L104 HydrophobicContact CG1-CD1 4.14Å; V80-L104 HydrophobicContact CG1-CD2 3.77Å; V80-L104 HydrophobicContact CG1-CG 3.97Å
81	T	97.4	Very high	93.7	Very high	20 Å²	20	56.9 Å²	56.9	12%	0.123	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	122.2	176.6	-53.7	0	0	0	0	109.7	C68 S69 K83	C68-T81 CarbonylContact C-O 3.54Å; C68-T81 WeakPolarHBondContact CA-O 3.49Å; C68-T81 VanDerWaalsContact CB-O 3.29Å; C68-T81 WeakPolarHBondContact CB-O 3.28Å; S69-T81 PolarHBondContact N-O 2.96Å; S69-T81 PolarHBondContact O-N 3.45Å; T81-K83 PolarHBondContact O-N 3.45Å
82	D	97.7	Very high	93.7	Very high	1 Å²	1	55 Å²	55	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	119.6	169.7	170.8	27.8	0	0	0	110	K84 S85 V89 I96 A98 E99	D82-K84 PolarHBondContact O-N 2.91Å; D82-K84 VanDerWaalsContact O-N 3.12Å; D82-K84 PolarHBondContact OD1-N 2.69Å; D82-S85 WeakPolarHBondContact OD1-CB 3.33Å; D82-S85 PolarHBondContact OD1-N 3.35Å; D82-S85 PolarHBondContact OD1-OG 2.92Å; D82-V89 HydrophobicContact CB-CB 4.21Å; D82-V89 HydrophobicContact CB-CG2 3.92Å; D82-I96 HydrophobicContact CB-CD1 4.21Å; D82-I96 HydrophobicContact CB-CG1 4.12Å; D82-A98 WeakPolarHBondContact OD2-CB 3.34Å; D82-E99 PolarHBondContact O-N 3.01Å
83	K	96.4	Very high	93.6	Very high	67 Å²	67	55.3 Å²	55.3	29%	0.291	29%	0.287	S	S	.	.			trans	-90.6	48.1	-175.7	-64.3	-74.3	-173.5	173	0	111.1	E41 L66 H67 S69 T81 S85	E41-K83 VanDerWaalsContact OE1-CE 3.31Å; E41-K83 WeakPolarHBondContact OE1-CE 3.49Å; E41-K83 IonicContact OE1-NZ 2.72Å; E41-K83 PolarHBondContact OE1-NZ 3.09Å; L66-K83 HydrophobicContact CD1-CG 4.36Å; L66-K83 HydrophobicContact CD2-CB 3.87Å; L66-K83 HydrophobicContact CD2-CD 4.16Å; L66-K83 HydrophobicContact CD2-CG 3.86Å; L66-K83 HydrophobicContact CG-CB 3.76Å; L66-K83 HydrophobicContact CG-CG 3.88Å; H67-K83 PolarHBondContact O-N 3.04Å; S69-K83 WeakPolarHBondContact OG-CE 3.37Å; S69-K83 PolarHBondContact OG-NZ 3.48Å; T81-K83 PolarHBondContact O-N 3.45Å; K83-S85 VanDerWaalsContact C-N 3.35Å
84	K	94.6	Very high	93.8	Very high	135 Å²	135	58.2 Å²	58.2	59%	0.587	30%	0.302	S	S	*	.	S	Bend	trans	55.1	45.6	-171.8	-66.7	173	169.3	135.8	0	112.4	D82 A98 E99	D82-K84 PolarHBondContact O-N 2.91Å; D82-K84 VanDerWaalsContact O-N 3.12Å; D82-K84 PolarHBondContact OD1-N 2.69Å; K84-A98 HydrophobicContact CG-CB 4.27Å; K84-E99 HydrophobicContact CD-CG 4.45Å; K84-E99 WeakPolarHBondContact CD-OE1 3.37Å; K84-E99 VanDerWaalsContact CE-OE1 3.22Å; K84-E99 WeakPolarHBondContact CE-OE1 3.49Å; K84-E99 WeakPolarHBondContact CE-OE2 3.37Å; K84-E99 HydrophobicContact CG-CG 4.04Å; K84-E99 IonicContact NZ-OE1 2.74Å; K84-E99 PolarHBondContact NZ-OE1 3.35Å; K84-E99 IonicContact NZ-OE2 3.39Å; K84-E99 PolarHBondContact NZ-OE2 2.92Å
85	S	95.3	Very high	94.2	Very high	6 Å²	6	53.7 Å²	53.7	4%	0.042	28%	0.276	C	S	.	.			trans	-64	144.2	175.1	64.4	0	0	0	0	111.9	S64 H67 D82 K83 N87 G88	S64-S85 WeakPolarHBondContact OG-CA 3.47Å; H67-S85 WeakPolarHBondContact CD2-CB 3.29Å; H67-S85 PolarHBondContact NE2-OG 2.92Å; D82-S85 WeakPolarHBondContact OD1-CB 3.33Å; D82-S85 PolarHBondContact OD1-N 3.35Å; D82-S85 PolarHBondContact OD1-OG 2.92Å; K83-S85 VanDerWaalsContact C-N 3.35Å; S85-N87 PolarHBondContact O-N 2.98Å; S85-G88 VanDerWaalsContact OG-C 3.32Å; S85-G88 WeakPolarHBondContact OG-CA 3.23Å; S85-G88 PolarHBondContact OG-N 3.37Å
86	L	92.1	Very high	94.8	Very high	138 Å²	138	49.5 Å²	49.5	72%	0.723	25%	0.254	S	S	*	.	S	Bend	trans	-63	-45.3	-177.1	-178.5	62.1	0	0	0	112.3	S64	S64-L86 PolarHBondContact OG-N 3.16Å
87	N	94.4	Very high	95.3	Very high	43 Å²	43	50.7 Å²	50.7	23%	0.23	26%	0.255	C	S	.	.	S	Bend	trans	-97.6	-3.2	-174.4	-62.2	-39.2	0	0	0	113.2	M62 S85 V114	M62-N87 PolarHBondContact O-ND2 2.9Å; M62-N87 HydrophobicContact SD-CB 4.25Å; S85-N87 PolarHBondContact O-N 2.98Å; N87-V114 HydrophobicContact CB-CG2 4.37Å
88	G	94.8	Very high	95.5	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.254	C	S	.	.			trans	84	167.7	178.5	0	0	0	0	0	115.3	H67 S85 R95 G113	H67-G88 PolarHBondContact NE2-O 3.14Å; S85-G88 VanDerWaalsContact OG-C 3.32Å; S85-G88 WeakPolarHBondContact OG-CA 3.23Å; S85-G88 PolarHBondContact OG-N 3.37Å; G88-R95 VanDerWaalsContact CA-NH2 3.34Å; G88-G113 PolarHBondContact O-N 2.94Å
89	V	97.5	Very high	95.5	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	141.1	165.8	177.9	0	0	0	0	107.2	H67 C68 V80 D82 I96 I110 L112	H67-V89 WeakPolarHBondContact NE2-CG2 3.36Å; H67-V89 PolarHBondContact NE2-N 3.48Å; C68-V89 HydrophobicContact CB-CG2 3.86Å; V80-V89 HydrophobicContact CG2-CG1 4.3Å; D82-V89 HydrophobicContact CB-CB 4.21Å; D82-V89 HydrophobicContact CB-CG2 3.92Å; V89-I96 HydrophobicContact CB-CD1 3.85Å; V89-I96 HydrophobicContact CB-CG1 3.85Å; V89-I96 HydrophobicContact CG1-CD1 3.68Å; V89-I96 HydrophobicContact CG1-CG1 4.08Å; V89-I96 PolarHBondContact O-N 3.15Å; V89-I110 HydrophobicContact CG1-CG2 4.06Å; V89-L112 HydrophobicContact CB-CD2 4.5Å; V89-L112 HydrophobicContact CG1-CD2 4.05Å; V89-L112 HydrophobicContact CG2-CD2 3.96Å
90	W	97.6	Very high	95.4	Very high	76 Å²	76	58.9 Å²	58.9	29%	0.288	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	139.6	175.4	-49.2	70.3	0	0	0	109.2	E94 R95 I110 Q111 G113 V114	W90-E94 CarbonylContact C-O 3.59Å; W90-E94 WeakPolarHBondContact CA-O 3.48Å; W90-R95 HydrophobicContact CD2-CB 3.74Å; W90-R95 HydrophobicContact CD2-CG 4.06Å; W90-R95 HydrophobicContact CE3-CB 3.57Å; W90-R95 HydrophobicContact CE3-CG 4.38Å; W90-R95 VanDerWaalsContact CE3-N 3.33Å; W90-R95 HydrophobicContact CG-CB 4.46Å; W90-R95 HydrophobicContact CH2-CB 3.96Å; W90-R95 HydrophobicContact CH2-CG 4.44Å; W90-R95 HydrophobicContact CZ2-CB 4.12Å; W90-R95 HydrophobicContact CZ2-CG 4.13Å; W90-R95 HydrophobicContact CZ3-CB 3.7Å; W90-I110 WeakPolarHBondContact O-CA 3.42Å; W90-Q111 HydrophobicContact CB-CB 4.23Å; W90-Q111 PolarHBondContact N-O 3.21Å; W90-Q111 PolarHBondContact O-N 3.02Å; W90-G113 VanDerWaalsContact CD1-O 3.31Å; W90-G113 PolarHBondContact NE1-O 3.34Å; W90-G113 VanDerWaalsContact NE1-O 3.15Å; W90-V114 HydrophobicContact CZ2-CG1 4.33Å
91	V	96.7	Very high	95.3	Very high	4 Å²	4	62.9 Å²	62.9	2%	0.024	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	125.9	174.2	178.9	0	0	0	0	107.6	V80 G93 E94 I96 L104 D108 S109 I110	V80-V91 HydrophobicContact CG1-CG2 3.86Å; V91-G93 PolarHBondContact O-N 3.3Å; V91-E94 PolarHBondContact N-O 2.98Å; V91-E94 PolarHBondContact O-N 2.93Å; V91-I96 HydrophobicContact CB-CG2 4Å; V91-I96 HydrophobicContact CG2-CG2 3.68Å; V91-L104 HydrophobicContact CG1-CD2 3.94Å; V91-L104 HydrophobicContact CG2-CD2 4.11Å; V91-D108 HydrophobicContact CG1-CB 4.35Å; V91-S109 CarbonylContact C-O 3.5Å; V91-S109 VanDerWaalsContact CA-O 3.29Å; V91-S109 WeakPolarHBondContact CA-O 3.39Å; V91-I110 HydrophobicContact CG2-CG1 4.31Å
92	N	94.1	Very high	95.2	Very high	96 Å²	96	65.1 Å²	65.1	51%	0.513	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.1	28.1	-177.2	-63	-31.2	0	0	0	114.9	D108 S109	N92-D108 PolarHBondContact ND2-OD1 3.4Å; N92-D108 WeakPolarHBondContact OD1-CA 3.4Å; N92-S109 PolarHBondContact N-O 2.87Å; N92-S109 PolarHBondContact OD1-N 3.46Å
93	G	91.5	Very high	95.1	Very high	49 Å²	49	68.1 Å²	68.1	51%	0.505	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.8	-4	-177.9	0	0	0	0	0	115.6	V91	V91-G93 PolarHBondContact O-N 3.3Å
94	E	94.6	Very high	95.1	Very high	150 Å²	150	65.4 Å²	65.4	70%	0.701	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.3	134.3	175.2	-63.5	-167.7	164	0	0	111.6	W90 V91 I96	W90-E94 CarbonylContact C-O 3.59Å; W90-E94 WeakPolarHBondContact CA-O 3.48Å; V91-E94 PolarHBondContact N-O 2.98Å; V91-E94 PolarHBondContact O-N 2.93Å; E94-I96 PolarHBondContact O-N 3.12Å
95	R	96.4	Very high	95	Very high	115 Å²	115	67.3 Å²	67.3	43%	0.434	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	116.9	179.6	-165.2	-179	-179.2	-73	-0.7	110.2	G88 W90	G88-R95 VanDerWaalsContact CA-NH2 3.34Å; W90-R95 HydrophobicContact CD2-CB 3.74Å; W90-R95 HydrophobicContact CD2-CG 4.06Å; W90-R95 HydrophobicContact CE3-CB 3.57Å; W90-R95 HydrophobicContact CE3-CG 4.38Å; W90-R95 VanDerWaalsContact CE3-N 3.33Å; W90-R95 HydrophobicContact CG-CB 4.46Å; W90-R95 HydrophobicContact CH2-CB 3.96Å; W90-R95 HydrophobicContact CH2-CG 4.44Å; W90-R95 HydrophobicContact CZ2-CB 4.12Å; W90-R95 HydrophobicContact CZ2-CG 4.13Å; W90-R95 HydrophobicContact CZ3-CB 3.7Å
96	I	96.5	Very high	95	Very high	4 Å²	4	72 Å²	72	2%	0.021	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-73.1	148.2	-179.4	69.7	175.6	0	0	0	111.3	V80 D82 V89 V91 E94 H102	V80-I96 HydrophobicContact CG1-CD1 3.92Å; V80-I96 HydrophobicContact CG2-CD1 4.44Å; D82-I96 HydrophobicContact CB-CD1 4.21Å; D82-I96 HydrophobicContact CB-CG1 4.12Å; V89-I96 HydrophobicContact CB-CD1 3.85Å; V89-I96 HydrophobicContact CB-CG1 3.85Å; V89-I96 HydrophobicContact CG1-CD1 3.68Å; V89-I96 HydrophobicContact CG1-CG1 4.08Å; V89-I96 PolarHBondContact O-N 3.15Å; V91-I96 HydrophobicContact CB-CG2 4Å; V91-I96 HydrophobicContact CG2-CG2 3.68Å; E94-I96 PolarHBondContact O-N 3.12Å; I96-H102 HydrophobicContact CB-CB 4.27Å; I96-H102 HydrophobicContact CD1-CB 4.17Å; I96-H102 HydrophobicContact CG2-CB 3.91Å
97	P	95.5	Very high	95	Very high	61 Å²	61	67.9 Å²	67.9	40%	0.396	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-68.7	141.2	175.1	22.2	-28.5	0	0	0	112.4	Q100	P97-Q100 HydrophobicContact CB-CB 4.37Å; P97-Q100 HydrophobicContact CB-CG 4.3Å; P97-Q100 HydrophobicContact CG-CB 4Å; P97-Q100 HydrophobicContact CG-CG 4.31Å; P97-Q100 VanDerWaalsContact CG-OE1 3.22Å; P97-Q100 PolarHBondContact O-N 3.33Å
98	A	94.4	Very high	95.1	Very high	43 Å²	43	66.7 Å²	66.7	36%	0.355	35%	0.352	S	S	.	.	B	Isolated β-bridge	trans	-64.8	142.1	-179.8	0	0	0	0	0	112.3	D82 K84 Q100	D82-A98 WeakPolarHBondContact OD2-CB 3.34Å; K84-A98 HydrophobicContact CG-CB 4.27Å; A98-Q100 PolarHBondContact O-N 3.48Å; A98-Q100 VanDerWaalsContact O-N 3.1Å
99	E	94.3	Very high	95.2	Very high	113 Å²	113	67.9 Å²	67.9	53%	0.528	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	7.9	-178.1	-62.6	-178	154.6	0	0	116.2	D82 K84	D82-E99 PolarHBondContact O-N 3.01Å; K84-E99 HydrophobicContact CD-CG 4.45Å; K84-E99 WeakPolarHBondContact CD-OE1 3.37Å; K84-E99 VanDerWaalsContact CE-OE1 3.22Å; K84-E99 WeakPolarHBondContact CE-OE1 3.49Å; K84-E99 WeakPolarHBondContact CE-OE2 3.37Å; K84-E99 HydrophobicContact CG-CG 4.04Å; K84-E99 IonicContact NZ-OE1 2.74Å; K84-E99 PolarHBondContact NZ-OE1 3.35Å; K84-E99 IonicContact NZ-OE2 3.39Å; K84-E99 PolarHBondContact NZ-OE2 2.92Å
100	Q	94.2	Very high	95.2	Very high	116 Å²	116	68 Å²	68	54%	0.542	36%	0.36	S	S	.	.	S	Bend	trans	-102.1	132.6	174.2	-62.5	-177.4	18.2	0	0	110.4	P97 A98 H102	P97-Q100 HydrophobicContact CB-CB 4.37Å; P97-Q100 HydrophobicContact CB-CG 4.3Å; P97-Q100 HydrophobicContact CG-CB 4Å; P97-Q100 HydrophobicContact CG-CG 4.31Å; P97-Q100 VanDerWaalsContact CG-OE1 3.22Å; P97-Q100 PolarHBondContact O-N 3.33Å; A98-Q100 PolarHBondContact O-N 3.48Å; A98-Q100 VanDerWaalsContact O-N 3.1Å; Q100-H102 PolarHBondContact O-N 3.42Å
101	P	95	Very high	95.1	Very high	84 Å²	84	66.6 Å²	66.6	55%	0.545	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	107.4	179	30	-33.1	0	0	0	110.8	T79	T79-P101 HydrophobicContact CG2-CB 4.27Å
102	H	96	Very high	95.1	Very high	66 Å²	66	66.5 Å²	66.5	31%	0.306	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	134.6	172.7	-167.2	93.9	0	0	0	110.1	T79 V80 I96 Q100	T79-H102 CarbonylContact C-O 3.5Å; T79-H102 WeakPolarHBondContact CA-O 3.37Å; T79-H102 WeakPolarHBondContact CB-O 3.43Å; V80-H102 HydrophobicContact CG1-CB 4.14Å; V80-H102 PolarHBondContact N-O 3.34Å; V80-H102 PolarHBondContact O-N 2.96Å; I96-H102 HydrophobicContact CB-CB 4.27Å; I96-H102 HydrophobicContact CD1-CB 4.17Å; I96-H102 HydrophobicContact CG2-CB 3.91Å; Q100-H102 PolarHBondContact O-N 3.42Å
103	L	96	Very high	95	Very high	65 Å²	65	61.9 Å²	61.9	34%	0.34	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	129.9	179	172.5	60.2	0	0	0	110.8	Q77	Q77-L103 HydrophobicContact CB-CD1 3.72Å; Q77-L103 HydrophobicContact CG-CD1 4.27Å
104	L	95.4	Very high	94.9	Very high	10 Å²	10	61.9 Å²	61.9	5%	0.052	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-101.3	153	174.7	-64.9	178.9	0	0	0	112.7	F70 W78 V80 V91 D108 I110 L127	F70-L104 HydrophobicContact CD1-CD1 3.79Å; F70-L104 HydrophobicContact CE1-CD1 3.82Å; W78-L104 PolarHBondContact O-N 3.42Å; V80-L104 HydrophobicContact CB-CD1 4.03Å; V80-L104 HydrophobicContact CB-CG 4.35Å; V80-L104 HydrophobicContact CG1-CD1 4.14Å; V80-L104 HydrophobicContact CG1-CD2 3.77Å; V80-L104 HydrophobicContact CG1-CG 3.97Å; V91-L104 HydrophobicContact CG1-CD2 3.94Å; V91-L104 HydrophobicContact CG2-CD2 4.11Å; L104-D108 WeakPolarHBondContact CA-OD2 3.4Å; L104-D108 HydrophobicContact CD2-CB 4.37Å; L104-I110 HydrophobicContact CD1-CD1 4.37Å; L104-I110 HydrophobicContact CD1-CG1 4.45Å; L104-I110 HydrophobicContact CD2-CD1 4.16Å; L104-I110 HydrophobicContact CD2-CG1 3.87Å; L104-L127 HydrophobicContact CB-CD2 3.73Å; L104-L127 HydrophobicContact CD1-CD2 4.12Å
105	R	93.8	Very high	94.6	Very high	174 Å²	174	58.3 Å²	58.3	66%	0.657	31%	0.312	S	S	*	.			trans	-127	157.1	174.5	-60.9	175.8	-180	-105.6	-2.2	109.9	G107 D108	R105-G107 PolarHBondContact O-N 2.89Å; R105-D108 PolarHBondContact N-OD2 3.38Å; R105-D108 WeakPolarHBondContact O-CB 3.25Å; R105-D108 PolarHBondContact O-N 2.94Å
106	L	93.3	Very high	93.9	Very high	105 Å²	105	55.9 Å²	55.9	55%	0.55	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	129.5	170.8	-68.4	176	0	0	0	110.2	L22 Q129	L22-L106 HydrophobicContact CD2-CD2 3.54Å; L106-Q129 HydrophobicContact CD1-CB 4.38Å; L106-Q129 HydrophobicContact CD2-CB 3.8Å
107	G	92.9	Very high	92.9	Very high	52 Å²	52	64.7 Å²	64.7	54%	0.536	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.9	-7.4	-176.3	0	0	0	0	0	115.4	R105 L127	R105-G107 PolarHBondContact O-N 2.89Å; G107-L127 PolarHBondContact N-O 3.03Å
108	D	96.7	Very high	91.7	Very high	18 Å²	18	66.1 Å²	66.1	10%	0.096	38%	0.379	C	S	.	.			trans	-62.5	137.9	175.5	-75	-15.1	0	0	0	111.4	V91 N92 L104 R105 I110 I126 L127	V91-D108 HydrophobicContact CG1-CB 4.35Å; N92-D108 PolarHBondContact ND2-OD1 3.4Å; N92-D108 WeakPolarHBondContact OD1-CA 3.4Å; L104-D108 WeakPolarHBondContact CA-OD2 3.4Å; L104-D108 HydrophobicContact CD2-CB 4.37Å; R105-D108 PolarHBondContact N-OD2 3.38Å; R105-D108 WeakPolarHBondContact O-CB 3.25Å; R105-D108 PolarHBondContact O-N 2.94Å; D108-I110 HydrophobicContact CB-CD1 4.32Å; D108-I110 WeakPolarHBondContact O-CD1 3.37Å; D108-I126 WeakPolarHBondContact O-CA 3.48Å; D108-L127 PolarHBondContact O-N 2.91Å
109	S	96.3	Very high	91.1	Very high	25 Å²	25	67.8 Å²	67.8	18%	0.175	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	133.2	167.3	162.9	0	0	0	0	110	V91 N92 D124 Y125	V91-S109 CarbonylContact C-O 3.5Å; V91-S109 VanDerWaalsContact CA-O 3.29Å; V91-S109 WeakPolarHBondContact CA-O 3.39Å; N92-S109 PolarHBondContact N-O 2.87Å; N92-S109 PolarHBondContact OD1-N 3.46Å; S109-D124 PolarHBondContact OG-OD1 3.42Å; S109-Y125 CarbonylContact C-O 3.55Å; S109-Y125 VanDerWaalsContact CA-O 3.24Å; S109-Y125 WeakPolarHBondContact CA-O 3.34Å
110	I	97.3	Very high	90.7	Very high	1 Å²	1	71.6 Å²	71.6	1%	0.005	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	112.6	177.7	-55.1	94.5	0	0	0	108.7	L24 F70 V89 W90 V91 L104 D108 L112 Y125 L127	L24-I110 HydrophobicContact CD2-CD1 3.98Å; F70-I110 HydrophobicContact CE1-CG2 4.45Å; F70-I110 HydrophobicContact CZ-CG2 4.22Å; V89-I110 HydrophobicContact CG1-CG2 4.06Å; W90-I110 WeakPolarHBondContact O-CA 3.42Å; V91-I110 HydrophobicContact CG2-CG1 4.31Å; L104-I110 HydrophobicContact CD1-CD1 4.37Å; L104-I110 HydrophobicContact CD1-CG1 4.45Å; L104-I110 HydrophobicContact CD2-CD1 4.16Å; L104-I110 HydrophobicContact CD2-CG1 3.87Å; D108-I110 HydrophobicContact CB-CD1 4.32Å; D108-I110 WeakPolarHBondContact O-CD1 3.37Å; I110-L112 HydrophobicContact CG2-CD2 4.22Å; I110-Y125 PolarHBondContact N-O 3.45Å; I110-Y125 PolarHBondContact O-N 2.96Å; I110-L127 HydrophobicContact CD1-CB 4.08Å
111	Q	96.4	Very high	90.4	Very high	47 Å²	47	67.1 Å²	67.1	22%	0.22	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	131	-179.5	-71.6	174.2	-4.3	0	0	110.7	W90 V121 F123 D124	W90-Q111 HydrophobicContact CB-CB 4.23Å; W90-Q111 PolarHBondContact N-O 3.21Å; W90-Q111 PolarHBondContact O-N 3.02Å; Q111-V121 HydrophobicContact CB-CG1 4.25Å; Q111-V121 HydrophobicContact CG-CG1 4.43Å; Q111-F123 WeakPolarHBondContact CA-O 3.34Å; Q111-D124 HydrophobicContact CG-CB 3.86Å; Q111-D124 VanDerWaalsContact CG-CG 3.4Å; Q111-D124 WeakPolarHBondContact CG-OD1 3.2Å; Q111-D124 PolarHBondContact NE2-OD2 2.93Å
112	L	96	Very high	90.2	Very high	2 Å²	2	66 Å²	66	1%	0.01	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	111	-179.2	-53.1	179.9	0	0	0	110	V44 L54 I63 V89 I110 F123 Y125	V44-L112 HydrophobicContact CG1-CD1 4.01Å; L54-L112 HydrophobicContact CD1-CD1 3.58Å; I63-L112 HydrophobicContact CD1-CB 3.79Å; I63-L112 WeakPolarHBondContact CD1-O 3.21Å; V89-L112 HydrophobicContact CB-CD2 4.5Å; V89-L112 HydrophobicContact CG1-CD2 4.05Å; V89-L112 HydrophobicContact CG2-CD2 3.96Å; I110-L112 HydrophobicContact CG2-CD2 4.22Å; L112-F123 HydrophobicContact CB-CB 3.98Å; L112-F123 PolarHBondContact N-O 2.89Å; L112-Y125 HydrophobicContact CD1-CD2 4.44Å; L112-Y125 HydrophobicContact CD1-CE2 4.11Å
113	G	92.2	Very high	90.1	Very high	0 Å²	0	63 Å²	63	0%	0	35%	0.354	C	S	.	.	S	Bend	trans	90.4	-151.4	-173	0	0	0	0	0	113.2	H67 G88 W90	H67-G113 WeakPolarHBondContact CE1-CA 3.25Å; H67-G113 PolarHBondContact CE1-N 3.28Å; H67-G113 PolarHBondContact NE2-N 3.11Å; G88-G113 PolarHBondContact O-N 2.94Å; W90-G113 VanDerWaalsContact CD1-O 3.31Å; W90-G113 PolarHBondContact NE1-O 3.34Å; W90-G113 VanDerWaalsContact NE1-O 3.15Å
114	V	90.3	Very high	90.1	Very high	49 Å²	49	61.3 Å²	61.3	30%	0.297	35%	0.345	S	S	.	.			trans	-135.6	156.4	-173.7	-68.8	0	0	0	0	110.8	M62 N87 W90	M62-V114 HydrophobicContact CE-CG2 4.02Å; M62-V114 WeakPolarHBondContact CE-O 3.36Å; M62-V114 HydrophobicContact SD-CG2 3.85Å; M62-V114 PolarHBondContact SD-N 3.21Å; N87-V114 HydrophobicContact CB-CG2 4.37Å; W90-V114 HydrophobicContact CZ2-CG1 4.33Å
115	P	88.2	Confident	90.1	Very high	75 Å²	75	60.9 Å²	60.9	49%	0.487	34%	0.343	S	S	.	.			trans	-65.7	149.2	173.1	27.8	-34.4	0	0	0	111.2	T119 V121	P115-T119 VanDerWaalsContact CB-O 3.24Å; P115-T119 WeakPolarHBondContact CB-O 3.28Å; P115-V121 HydrophobicContact CB-CG2 4.21Å; P115-V121 HydrophobicContact CG-CG2 4.45Å
116	L	81.1	Confident	90.3	Very high	63 Å²	63	55 Å²	55	33%	0.33	32%	0.324	S	S	.	.			trans	-81.9	163.6	165.6	-59.2	172	0	0	0	109.2	T58 C59 M62 G118 T119	T58-L116 HydrophobicContact CG2-CD1 4Å; C59-L116 HydrophobicContact CB-CD1 4.43Å; M62-L116 HydrophobicContact CE-CD2 3.62Å; M62-L116 HydrophobicContact CE-CG 4.21Å; L116-G118 PolarHBondContact O-N 3.49Å; L116-T119 HydrophobicContact CB-CG2 4.46Å; L116-T119 PolarHBondContact N-OG1 2.92Å; L116-T119 PolarHBondContact O-N 3.47Å; L116-T119 PolarHBondContact O-OG1 3.3Å
117	L	75.1	Confident	90.3	Very high	189 Å²	189	50.2 Å²	50.2	99%	0.99	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	107.4	-177.9	-76.6	157.3	0	0	0	111.5
118	G	71.4	Confident	90.4	Very high	91 Å²	91	49 Å²	49	94%	0.938	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	2	179.3	0	0	0	0	0	116.5	L116	L116-G118 PolarHBondContact O-N 3.49Å
119	T	81.7	Confident	90.2	Very high	79 Å²	79	52 Å²	52	49%	0.485	29%	0.293	S	S	.	.	S	Bend	trans	-110.9	165.6	-179.1	78.5	0	0	0	0	113	P115 L116	P115-T119 VanDerWaalsContact CB-O 3.24Å; P115-T119 WeakPolarHBondContact CB-O 3.28Å; L116-T119 HydrophobicContact CB-CG2 4.46Å; L116-T119 PolarHBondContact N-OG1 2.92Å; L116-T119 PolarHBondContact O-N 3.47Å; L116-T119 PolarHBondContact O-OG1 3.3Å
120	K	84.5	Confident	89.9	Confident	193 Å²	193	57.2 Å²	57.2	84%	0.839	31%	0.309	S	S	*	.			trans	-72.6	165.2	164	-64.7	-172.7	178.3	-175.2	0	110.8
121	V	88.6	Confident	89.6	Confident	22 Å²	22	58 Å²	58	13%	0.133	31%	0.314	C	S	.	.			trans	-64.3	134.3	168.7	-179.4	0	0	0	0	109.1	Q111 P115	Q111-V121 HydrophobicContact CB-CG1 4.25Å; Q111-V121 HydrophobicContact CG-CG1 4.43Å; P115-V121 HydrophobicContact CB-CG2 4.21Å; P115-V121 HydrophobicContact CG-CG2 4.45Å
122	E	90.8	Very high	89.1	Confident	60 Å²	60	57.7 Å²	57.7	28%	0.28	31%	0.314	S	S	.	.	S	Bend	trans	-71.9	-37.4	-179.2	-175	-175.4	171.3	0	0	112.6	R26 S56	R26-E122 VanDerWaalsContact CZ-O 3.28Å; R26-E122 PolarHBondContact NE-O 2.82Å; R26-E122 PolarHBondContact NH2-O 3.44Å; S56-E122 WeakPolarHBondContact CA-OE1 3.47Å; S56-E122 WeakPolarHBondContact CB-OE1 3.35Å; S56-E122 VanDerWaalsContact CB-OE2 3.3Å; S56-E122 WeakPolarHBondContact CB-OE2 3.44Å; S56-E122 VanDerWaalsContact OG-CD 3.24Å; S56-E122 PolarHBondContact OG-OE1 3.05Å; S56-E122 PolarHBondContact OG-OE2 3.09Å
123	F	94.3	Very high	88.6	Confident	3 Å²	3	62.3 Å²	62.3	1%	0.013	33%	0.334	C	S	.	.	S	Bend	trans	-111.5	69	-176.6	-62	-84.9	0	0	0	110.6	R26 L54 I63 Q111 L112 Y125	R26-F123 VanDerWaalsContact NH2-CE1 3.28Å; L54-F123 HydrophobicContact CB-CD1 4.22Å; L54-F123 HydrophobicContact CB-CE1 3.81Å; L54-F123 HydrophobicContact CB-CZ 4.34Å; L54-F123 HydrophobicContact CD1-CD1 3.74Å; L54-F123 HydrophobicContact CD1-CE1 4.21Å; L54-F123 HydrophobicContact CD1-CG 4.32Å; L54-F123 HydrophobicContact CD2-CD1 4.17Å; L54-F123 HydrophobicContact CD2-CE1 4.14Å; L54-F123 HydrophobicContact CG-CD1 4.27Å; L54-F123 HydrophobicContact CG-CE1 4.27Å; I63-F123 HydrophobicContact CD1-CB 4.34Å; I63-F123 HydrophobicContact CD1-CD2 3.72Å; I63-F123 HydrophobicContact CD1-CE2 4.29Å; I63-F123 HydrophobicContact CD1-CG 4.1Å; I63-F123 HydrophobicContact CG1-CD2 3.77Å; I63-F123 HydrophobicContact CG1-CE2 3.81Å; I63-F123 HydrophobicContact CG1-CG 4.34Å; I63-F123 HydrophobicContact CG1-CZ 4.41Å; Q111-F123 WeakPolarHBondContact CA-O 3.34Å; L112-F123 HydrophobicContact CB-CB 3.98Å; L112-F123 PolarHBondContact N-O 2.89Å; F123-Y125 HydrophobicContact CB-CE2 4.07Å; F123-Y125 HydrophobicContact CD1-CE2 4.44Å
124	D	94.9	Very high	88.3	Confident	29 Å²	29	65.7 Å²	65.7	16%	0.155	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.6	169.9	-169	-8.2	0	0	0	109.3	R26 V27 S109 Q111	R26-D124 WeakPolarHBondContact CD-O 3.4Å; V27-D124 HydrophobicContact CB-CB 4.05Å; V27-D124 HydrophobicContact CG2-CB 4.17Å; V27-D124 PolarHBondContact N-O 2.78Å; S109-D124 PolarHBondContact OG-OD1 3.42Å; Q111-D124 HydrophobicContact CG-CB 3.86Å; Q111-D124 VanDerWaalsContact CG-CG 3.4Å; Q111-D124 WeakPolarHBondContact CG-OD1 3.2Å; Q111-D124 PolarHBondContact NE2-OD2 2.93Å
125	Y	96.9	Very high	88.1	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.008	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.6	-174.2	-69.7	-85.7	0	0	0	111	L24 M25 R26 L34 L54 S109 I110 L112 F123	L24-Y125 HydrophobicContact CB-CD1 3.73Å; L24-Y125 HydrophobicContact CB-CE1 4.47Å; L24-Y125 HydrophobicContact CB-CG 4.11Å; L24-Y125 WeakPolarHBondContact O-CD1 3.46Å; M25-Y125 CarbonylContact O-C 3.42Å; M25-Y125 VanDerWaalsContact O-CA 3.23Å; M25-Y125 WeakPolarHBondContact O-CA 3.3Å; R26-Y125 HydrophobicContact CB-CD1 4.26Å; R26-Y125 HydrophobicContact CB-CE1 4.02Å; R26-Y125 HydrophobicContact CG-CE1 4.39Å; R26-Y125 PolarHBondContact NH1-OH 2.97Å; L34-Y125 HydrophobicContact CD1-CE1 4.06Å; L34-Y125 HydrophobicContact CD1-CE2 4.46Å; L34-Y125 HydrophobicContact CD2-CE1 4.43Å; L34-Y125 HydrophobicContact CG-CE1 3.77Å; L54-Y125 HydrophobicContact CD1-CE2 4.49Å; L54-Y125 VanDerWaalsContact CD2-OH 3.3Å; L54-Y125 WeakPolarHBondContact CD2-OH 3.39Å; S109-Y125 CarbonylContact C-O 3.55Å; S109-Y125 VanDerWaalsContact CA-O 3.24Å; S109-Y125 WeakPolarHBondContact CA-O 3.34Å; I110-Y125 PolarHBondContact N-O 3.45Å; I110-Y125 PolarHBondContact O-N 2.96Å; L112-Y125 HydrophobicContact CD1-CD2 4.44Å; L112-Y125 HydrophobicContact CD1-CE2 4.11Å; F123-Y125 HydrophobicContact CB-CE2 4.07Å; F123-Y125 HydrophobicContact CD1-CE2 4.44Å
126	I	96.3	Very high	88	Confident	50 Å²	50	67.5 Å²	67.5	26%	0.256	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.2	169.1	-62.3	169.8	0	0	0	109.2	M25 V27 D108 I128	M25-I126 HydrophobicContact CE-CB 4.09Å; M25-I126 HydrophobicContact CE-CD1 4.11Å; M25-I126 HydrophobicContact CE-CG2 4.47Å; M25-I126 PolarHBondContact N-O 3.19Å; M25-I126 PolarHBondContact O-N 2.86Å; V27-I126 HydrophobicContact CG2-CD1 3.94Å; V27-I126 HydrophobicContact CG2-CG1 3.78Å; D108-I126 WeakPolarHBondContact O-CA 3.48Å; I126-I128 HydrophobicContact CG2-CG2 3.9Å; I126-I128 PolarHBondContact O-N 2.8Å
127	L	95.4	Very high	88.2	Confident	4 Å²	4	68.6 Å²	68.6	2%	0.021	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	115.9	174.1	-179.8	61.1	0	0	0	110.4	L22 L24 L36 L104 G107 D108 I110	L22-L127 HydrophobicContact CB-CD1 4.47Å; L22-L127 HydrophobicContact CD2-CD1 4.18Å; L24-L127 HydrophobicContact CD2-CB 4.19Å; L24-L127 HydrophobicContact CD2-CD1 4.03Å; L36-L127 HydrophobicContact CD1-CD1 3.74Å; L104-L127 HydrophobicContact CB-CD2 3.73Å; L104-L127 HydrophobicContact CD1-CD2 4.12Å; G107-L127 PolarHBondContact N-O 3.03Å; D108-L127 PolarHBondContact O-N 2.91Å; I110-L127 HydrophobicContact CD1-CB 4.08Å
128	I	94	Very high	88.8	Confident	28 Å²	28	63.6 Å²	63.6	14%	0.144	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	160	178.5	67.1	170.5	0	0	0	111.7	L22 C23 M25 W33 I126 R130	L22-I128 WeakPolarHBondContact CA-O 3.46Å; C23-I128 PolarHBondContact N-O 3.38Å; C23-I128 PolarHBondContact O-N 3.41Å; C23-I128 VanDerWaalsContact SG-CG1 3.55Å; M25-I128 HydrophobicContact CB-CD1 3.77Å; M25-I128 HydrophobicContact CB-CG1 4.11Å; M25-I128 HydrophobicContact CE-CG2 4.19Å; M25-I128 HydrophobicContact CG-CD1 4.46Å; M25-I128 HydrophobicContact SD-CD1 4.09Å; W33-I128 HydrophobicContact CZ3-CD1 3.97Å; I126-I128 HydrophobicContact CG2-CG2 3.9Å; I126-I128 PolarHBondContact O-N 2.8Å; I128-R130 HydrophobicContact CD1-CG 3.93Å; I128-R130 HydrophobicContact CG1-CG 4.5Å
129	Q	92.8	Very high	89.4	Confident	79 Å²	79	60.9 Å²	60.9	37%	0.369	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.5	171.7	178.6	166.3	-21.2	0	0	108.2	E20 V21 L22 L106	E20-Q129 HydrophobicContact CB-CG 3.95Å; E20-Q129 PolarHBondContact OE2-NE2 2.88Å; V21-Q129 WeakPolarHBondContact O-CA 3.33Å; L22-Q129 HydrophobicContact CD2-CB 3.94Å; L106-Q129 HydrophobicContact CD1-CB 4.38Å; L106-Q129 HydrophobicContact CD2-CB 3.8Å
130	R	90.6	Very high	89.4	Confident	135 Å²	135	60 Å²	60	51%	0.509	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	153.3	-178.1	-74.6	-61.2	178.1	159.1	-5.7	111.6	E20 V21 I128 I135	E20-R130 WeakPolarHBondContact CA-O 3.47Å; V21-R130 WeakPolarHBondContact CG2-O 3.45Å; V21-R130 PolarHBondContact N-O 2.9Å; V21-R130 PolarHBondContact O-N 3.29Å; I128-R130 HydrophobicContact CD1-CG 3.93Å; I128-R130 HydrophobicContact CG1-CG 4.5Å; R130-I135 HydrophobicContact CB-CG2 3.6Å; R130-I135 HydrophobicContact CG-CG2 4.21Å
131	P	90	Very high	88.4	Confident	18 Å²	18	59.5 Å²	59.5	12%	0.117	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.5	138.5	167.6	-28	36.6	0	0	0	112.2	K133 D134	P131-K133 HydrophobicContact CB-CD 4.34Å; P131-K133 HydrophobicContact CB-CG 3.91Å; P131-K133 PolarHBondContact O-N 2.73Å; P131-D134 PolarHBondContact O-N 3.47Å; P131-D134 VanDerWaalsContact O-N 3.1Å
132	L	85.6	Confident	86.5	Confident	41 Å²	41	65 Å²	65	22%	0.215	31%	0.308	C	S	.	.	H	α-helix	trans	-57.7	-36.1	-178.6	-179.8	60.8	0	0	0	112.5	S19 V21 D134 I135 K136 L139	S19-L132 PolarHBondContact O-N 2.98Å; S19-L132 VanDerWaalsContact O-N 3.11Å; V21-L132 HydrophobicContact CG1-CB 4.37Å; V21-L132 HydrophobicContact CG2-CB 4.1Å; V21-L132 HydrophobicContact CG2-CD1 4.06Å; L132-D134 VanDerWaalsContact C-N 3.31Å; L132-D134 PolarHBondContact O-N 3.4Å; L132-I135 HydrophobicContact CD1-CD1 4.48Å; L132-I135 HydrophobicContact CD1-CG1 4.28Å; L132-I135 PolarHBondContact O-N 3.21Å; L132-K136 WeakPolarHBondContact O-CB 2.81Å; L132-K136 PolarHBondContact O-N 2.92Å; L132-L139 HydrophobicContact CD1-CD1 4.44Å
133	K	86.3	Confident	83.8	Confident	98 Å²	98	71.7 Å²	71.7	43%	0.426	34%	0.34	S	S	.	.	H	α-helix	trans	-55.9	-39.7	176.3	68.4	-166.4	-172.2	-172.3	0	113.4	D18 P131	D18-K133 WeakPolarHBondContact OD1-CE 3.47Å; D18-K133 IonicContact OD1-NZ 2.62Å; D18-K133 PolarHBondContact OD1-NZ 3.18Å; D18-K133 IonicContact OD2-NZ 2.64Å; D18-K133 PolarHBondContact OD2-NZ 2.98Å; P131-K133 HydrophobicContact CB-CD 4.34Å; P131-K133 HydrophobicContact CB-CG 3.91Å; P131-K133 PolarHBondContact O-N 2.73Å
134	D	85.5	Confident	80.7	Confident	71 Å²	71	81 Å²	81	38%	0.38	37%	0.374	S	S	.	.	H	α-helix	trans	-71.7	-34.7	-176.7	-66.5	-3	0	0	0	112.1	P131 L132 Y138	P131-D134 PolarHBondContact O-N 3.47Å; P131-D134 VanDerWaalsContact O-N 3.1Å; L132-D134 VanDerWaalsContact C-N 3.31Å; L132-D134 PolarHBondContact O-N 3.4Å; D134-Y138 WeakPolarHBondContact O-CE2 3.26Å
135	I	86.5	Confident	77.6	Confident	2 Å²	2	88.5 Å²	88.5	1%	0.01	41%	0.409	C	S	.	.	H	α-helix	trans	-95.4	-19.4	-173.3	73	169.1	0	0	0	113.6	V21 C23 W33 R130 L132 P137 Y138 L139	V21-I135 HydrophobicContact CG2-CD1 3.52Å; V21-I135 HydrophobicContact CG2-CG1 4.31Å; C23-I135 HydrophobicContact CB-CD1 3.71Å; W33-I135 HydrophobicContact CE3-CB 4.22Å; W33-I135 HydrophobicContact CE3-CG2 4.21Å; W33-I135 HydrophobicContact CZ3-CB 4.3Å; W33-I135 HydrophobicContact CZ3-CG2 3.9Å; R130-I135 HydrophobicContact CB-CG2 3.6Å; R130-I135 HydrophobicContact CG-CG2 4.21Å; L132-I135 HydrophobicContact CD1-CD1 4.48Å; L132-I135 HydrophobicContact CD1-CG1 4.28Å; L132-I135 PolarHBondContact O-N 3.21Å; I135-P137 VanDerWaalsContact C-N 3.26Å; I135-P137 VanDerWaalsContact O-N 3.11Å; I135-Y138 PolarHBondContact O-N 2.87Å; I135-L139 HydrophobicContact CD1-CD1 4.41Å; I135-L139 HydrophobicContact CD1-CD2 4.07Å; I135-L139 HydrophobicContact CD1-CG 4.43Å; I135-L139 HydrophobicContact CG1-CD1 4.35Å; I135-L139 HydrophobicContact CG1-CD2 4.48Å; I135-L139 HydrophobicContact CG1-CG 4.34Å; I135-L139 PolarHBondContact O-N 3.41Å
136	K	85.3	Confident	74.3	Confident	160 Å²	160	94.7 Å²	94.7	70%	0.696	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48	-35.2	-179.1	-164	174.8	-177.9	-179.4	0	114.5	L132	L132-K136 WeakPolarHBondContact O-CB 2.81Å; L132-K136 PolarHBondContact O-N 2.92Å
137	P	86.7	Confident	71.2	Confident	87 Å²	87	99 Å²	99	57%	0.565	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-25.7	175.8	-20.2	34.3	0	0	0	115.1	I135	I135-P137 VanDerWaalsContact C-N 3.26Å; I135-P137 VanDerWaalsContact O-N 3.11Å
138	Y	86.7	Confident	68.1	Low	84 Å²	84	107.4 Å²	107.4	33%	0.329	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-14	-170.2	-48.9	-55.6	0	0	0	113.9	N30 S31 D32 W33 D134 I135	N30-Y138 HydrophobicContact CB-CD1 4.08Å; N30-Y138 HydrophobicContact CB-CE1 4.07Å; N30-Y138 WeakPolarHBondContact O-CD1 3.49Å; S31-Y138 CarbonylContact C-O 3.51Å; D32-Y138 PolarHBondContact N-O 3.35Å; W33-Y138 WeakPolarHBondContact CB-O 3.37Å; W33-Y138 HydrophobicContact CD2-CD2 4.44Å; W33-Y138 HydrophobicContact CD2-CG 4.33Å; W33-Y138 HydrophobicContact CE3-CD2 4.23Å; W33-Y138 AromaticContact CH2-CD2 3.72Å; W33-Y138 HydrophobicContact CH2-CD2 3.72Å; W33-Y138 HydrophobicContact CH2-CE2 4.26Å; W33-Y138 HydrophobicContact CH2-CG 4.34Å; W33-Y138 AromaticContact CZ2-CD2 3.95Å; W33-Y138 HydrophobicContact CZ2-CD2 3.95Å; W33-Y138 HydrophobicContact CZ2-CG 4.12Å; W33-Y138 AromaticContact CZ3-CD2 3.88Å; W33-Y138 HydrophobicContact CZ3-CD2 3.88Å; W33-Y138 PolarHBondContact N-O 3.44Å; D134-Y138 WeakPolarHBondContact O-CE2 3.26Å; I135-Y138 PolarHBondContact O-N 2.87Å
139	L	85.1	Confident	64.9	Low	34 Å²	34	110.8 Å²	110.8	18%	0.178	54%	0.54	C	S	.	.	B	Isolated β-bridge	trans	-59.4	150.2	175.3	-70	179.7	0	0	0	111.7	W33 R35 L132 I135 K141	W33-L139 HydrophobicContact CB-CD2 4.22Å; W33-L139 WeakPolarHBondContact O-CA 3.41Å; W33-L139 WeakPolarHBondContact O-CD2 3.4Å; R35-L139 HydrophobicContact CB-CD1 4.24Å; R35-L139 HydrophobicContact CB-CD2 3.85Å; L132-L139 HydrophobicContact CD1-CD1 4.44Å; I135-L139 HydrophobicContact CD1-CD1 4.41Å; I135-L139 HydrophobicContact CD1-CD2 4.07Å; I135-L139 HydrophobicContact CD1-CG 4.43Å; I135-L139 HydrophobicContact CG1-CD1 4.35Å; I135-L139 HydrophobicContact CG1-CD2 4.48Å; I135-L139 HydrophobicContact CG1-CG 4.34Å; I135-L139 PolarHBondContact O-N 3.41Å; L139-K141 PolarHBondContact O-N 3.01Å; L139-K141 VanDerWaalsContact O-N 3.16Å
140	V	79.9	Confident	61.8	Low	61 Å²	61	111.4 Å²	111.4	37%	0.37	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-53.4	121.3	166.6	176	0	0	0	0	108.9	W33 L34 E142	W33-V140 PolarHBondContact O-N 3.46Å; L34-V140 HydrophobicContact CD2-CG2 3.64Å; V140-E142 PolarHBondContact O-N 2.76Å
141	K	64.6	Low	58.9	Low	182 Å²	182	113.1 Å²	113.1	79%	0.791	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-71.4	122.1	171.8	-64.9	-178.8	179.7	-179.5	0	108.4	L139 Q143	L139-K141 PolarHBondContact O-N 3.01Å; L139-K141 VanDerWaalsContact O-N 3.16Å; K141-Q143 PolarHBondContact O-N 2.71Å
142	E	48	Very low	55.9	Low	137 Å²	137	118.2 Å²	118.2	64%	0.64	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-56.1	124.8	164.6	-71.5	-176.4	-173.8	0	0	108.6	V140 R144	V140-E142 PolarHBondContact O-N 2.76Å; E142-R144 VanDerWaalsContact C-N 3.25Å; E142-R144 HydrophobicContact CB-CG 4.34Å; E142-R144 PolarHBondContact O-N 2.96Å; E142-R144 IonicContact OE1-NH2 2.71Å; E142-R144 IonicContact OE2-CZ 2.8Å; E142-R144 IonicContact OE2-NE 2.71Å; E142-R144 PolarHBondContact OE2-NE 3.15Å; E142-R144 IonicContact OE2-NH2 3.57Å; E142-R144 PolarHBondContact OE2-NH2 2.72Å
143	Q	33.5	Very low	53.5	Low	201 Å²	201	121.4 Å²	121.4	94%	0.939	63%	0.625	S	S	*	*			trans	-72.1	88.3	165.1	-79.3	-171.2	-58	0	0	108.6	K141	K141-Q143 PolarHBondContact O-N 2.71Å
144	R	30.8	Very low	50.7	Low	197 Å²	197	127.2 Å²	127.2	74%	0.743	65%	0.645	S	S	*	*			trans	-97.9	114.8	157.8	-62.4	-173.4	-173.6	-139.5	-1.8	107.4	E142	E142-R144 VanDerWaalsContact C-N 3.25Å; E142-R144 HydrophobicContact CB-CG 4.34Å; E142-R144 PolarHBondContact O-N 2.96Å; E142-R144 IonicContact OE1-NH2 2.71Å; E142-R144 IonicContact OE2-CZ 2.8Å; E142-R144 IonicContact OE2-NE 2.71Å; E142-R144 PolarHBondContact OE2-NE 3.15Å; E142-R144 IonicContact OE2-NH2 3.57Å; E142-R144 PolarHBondContact OE2-NH2 2.72Å
145	E	28.6	Very low	47.9	Very low	188 Å²	188	132.1 Å²	132.1	88%	0.879	66%	0.663	S	S	*	*			trans	-73.7	128.2	163.8	-67.6	-175.6	123.1	0	0	108.5	T147	E145-T147 PolarHBondContact O-N 3.24Å
146	D	29.1	Very low	45.1	Very low	131 Å²	131	140.8 Å²	140.8	70%	0.701	70%	0.701	S	S	*	*			trans	-76.3	107.4	-176.5	-107.9	-47.6	0	0	0	110.8
147	T	30.1	Very low	42.3	Very low	142 Å²	142	142.3 Å²	142.3	87%	0.871	71%	0.707	S	S	*	*			trans	-127.5	113.3	150.2	19.6	0	0	0	0	109.2	E145	E145-T147 PolarHBondContact O-N 3.24Å
148	K	30.1	Very low	39.8	Very low	179 Å²	179	149.5 Å²	149.5	78%	0.778	72%	0.723	S	S	*	*			trans	-93.7	128.7	-166.3	-63.1	175.7	180	175.5	0	112.5
149	A	27.2	Very low	37.1	Very low	100 Å²	100	155.1 Å²	155.1	83%	0.826	75%	0.749	S	S	*	*			trans	-163.4	122.9	145.8	0	0	0	0	0	114.3
150	A	27.7	Very low	34.2	Very low	91 Å²	91	161.2 Å²	161.2	75%	0.752	78%	0.781	S	S	*	*			trans	43.7	92.6	145.1	0	0	0	0	0	122.7
151	H	29.2	Very low	31.6	Very low	172 Å²	172	161.8 Å²	161.8	80%	0.796	80%	0.799	S	S	*	*				35.3	114.4	123.2	-70.4	-89.7	0	0	0	123.4
152	T	27.7	Very low	30	Very low	124 Å²	124	157.5 Å²	157.5	76%	0.761	79%	0.788	S	S	*	*				70.1	159.3	129.1	63.9	0	0	0	0	121.8
153	P	34.9	Very low	29.2	Very low	108 Å²	108	157.5 Å²	157.5	70%	0.701	79%	0.788	S	S	*	*			cis	-139.9	172.6	-40	39.3	-23.4	0	0	0	115.7
154	R	28	Very low	28.9	Very low	220 Å²	220	156.5 Å²	156.5	83%	0.83	78%	0.783	S	S	*	*			trans	76.1	117.5	156.6	-73.9	175.5	176.7	-173.8	0.6	121.2
155	K	26.7	Very low	29	Very low	174 Å²	174	153.3 Å²	153.3	76%	0.757	79%	0.785	S	S	*	*			trans	87.2	118.4	131.2	-76.3	-175.1	176.7	-175.4	0	121.7
156	F	27.1	Very low	29	Very low	184 Å²	184	153 Å²	153	81%	0.807	78%	0.784	S	S	*	*			trans	79.4	131.2	144.1	-88.9	-74.5	0	0	0	121.8
157	K	27	Very low	29.1	Very low	192 Å²	192	151.1 Å²	151.1	84%	0.835	78%	0.779	S	S	*	*			trans	79.7	118.5	159.9	-62.7	171.6	-177	174.2	0	118.8
158	R	34.1	Very low	28.9	Very low	239 Å²	239	150.6 Å²	150.6	90%	0.902	78%	0.781	S	S	*	*			trans	13.5	124.8	147.9	-59.3	175.9	-177.3	154.6	-0.8	118.5
159	K	29.5	Very low	29.7	Very low	202 Å²	202	148.3 Å²	148.3	88%	0.878	78%	0.783	S	S	*	*				-168.1	157.1	109.2	-101.8	170.3	-178.7	-173.5	0	110.2
160	L	25.2	Very low	29.9	Very low	162 Å²	162	148 Å²	148	85%	0.848	77%	0.774	S	S	*	*			trans	-86.4	146.1	157.7	-91.9	77	0	0	0	108.5
161	G	24.5	Very low	30.1	Very low	72 Å²	72	152.7 Å²	152.7	74%	0.742	78%	0.778	S	S	*	*			trans	-95.8	163.5	148.9	0	0	0	0	0	109.8
162	V	30.9	Very low	30	Very low	93 Å²	93	151.7 Å²	151.7	56%	0.564	77%	0.773	S	S	*	*			trans	-132.1	176.9	174.9	-177.8	0	0	0	0	106.6	L445	V162-L445 HydrophobicContact CG1-CD1 4.22Å
163	E	31.7	Very low	30.3	Very low	137 Å²	137	152.9 Å²	152.9	64%	0.64	77%	0.767	S	S	*	*			trans	84.1	128.7	-174.1	-49.5	-60.1	79.1	0	0	113.6
164	E	26.8	Very low	30.1	Very low	179 Å²	179	155.7 Å²	155.7	84%	0.836	78%	0.776	S	S	*	*			cis	-126.7	173.8	-1.8	-68.6	-172.4	110.6	0	0	112.2
165	V	32.8	Very low	30.1	Very low	130 Å²	130	154.9 Å²	154.9	79%	0.788	77%	0.774	S	S	*	*			trans	-137.4	140.3	-177.6	168.5	0	0	0	0	110.6
166	E	28	Very low	30.3	Very low	181 Å²	181	158 Å²	158	85%	0.846	78%	0.781	S	S	*	*			trans	-128.1	143	150.6	-102.5	-69.2	106.5	0	0	109.1
167	P	32.1	Very low	30.3	Very low	93 Å²	93	154 Å²	154	60%	0.604	78%	0.775	S	S	*	*			trans	-102.8	115.7	-153	36.3	-32.9	0	0	0	115.3
168	S	26.6	Very low	30.5	Very low	130 Å²	130	150.4 Å²	150.4	91%	0.909	77%	0.774	S	S	*	*			trans	-92.8	128.3	163.9	-89.6	0	0	0	0	112.7
169	T	45.9	Very low	30.3	Very low	132 Å²	132	145 Å²	145	81%	0.81	77%	0.773	S	S	*	*			trans	-77.1	147.6	-176.4	73.2	0	0	0	0	113.2
170	S	31.7	Very low	30.8	Very low	93 Å²	93	140.1 Å²	140.1	65%	0.65	77%	0.77	S	S	*	*				151.6	158.7	111.7	70.4	0	0	0	0	116
171	K	32.1	Very low	31	Very low	190 Å²	190	140.1 Å²	140.1	83%	0.826	77%	0.771	S	S	*	*			trans	65.8	92.7	159.4	-60.2	175.4	-166.1	-178	0	118.1
172	H	27.5	Very low	31.5	Very low	151 Å²	151	145.3 Å²	145.3	70%	0.699	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-61.7	150.1	165.5	-82.3	-109.5	0	0	0	113	K358	H172-K358 PolarHBondContact CD2-NZ 2.87Å; H172-K358 PolarHBondContact NE2-NZ 3Å
173	K	33.2	Very low	31.6	Very low	148 Å²	148	145.5 Å²	145.5	64%	0.643	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-74.9	123.3	164.2	-58.6	171.8	-176.8	168.5	0	108.1
174	L	31.7	Very low	31.6	Very low	167 Å²	167	148.5 Å²	148.5	87%	0.874	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-71.4	132.4	169.2	-75.9	173.5	0	0	0	110.2
175	Y	26.5	Very low	31.6	Very low	203 Å²	203	144.7 Å²	144.7	80%	0.796	79%	0.789	S	S	*	*			trans	-89.6	114.4	175.8	-173.2	-88.5	0	0	0	108.8	C177	Y175-C177 PolarHBondContact O-N 3.34Å
176	R	31.6	Very low	31.7	Very low	240 Å²	240	148.1 Å²	148.1	91%	0.906	79%	0.793	S	S	*	*			trans	-83.9	94.8	175.6	178.4	176.8	-94.7	172.8	-7	109.4
177	C	26.4	Very low	31.8	Very low	101 Å²	101	145.5 Å²	145.5	68%	0.682	79%	0.792	S	S	*	*			trans	-58.6	139.6	159.7	-65.1	0	0	0	0	109.6	Y175	Y175-C177 PolarHBondContact O-N 3.34Å
178	S	32.2	Very low	31.6	Very low	115 Å²	115	146.9 Å²	146.9	80%	0.804	80%	0.803	S	S	*	*			trans	-107.7	107.6	171.2	55.5	0	0	0	0	109.9
179	S	30.5	Very low	32	Very low	126 Å²	126	146.8 Å²	146.8	88%	0.881	80%	0.799	S	S	*	*			trans	-83.4	138.8	154.1	46.5	0	0	0	0	108.5
180	A	39.2	Very low	31.3	Very low	100 Å²	100	148.9 Å²	148.9	83%	0.826	80%	0.804	S	S	*	*			trans	-107.2	124.6	174.2	0	0	0	0	0	108.6
181	D	28.8	Very low	31.2	Very low	162 Å²	162	149.7 Å²	149.7	87%	0.866	81%	0.81	S	S	*	*			trans	-148.4	166.7	154.9	-130.5	-36.4	0	0	0	112
182	K	35.1	Very low	31.4	Very low	181 Å²	181	146.3 Å²	146.3	79%	0.787	81%	0.807	S	S	*	*			trans	-113	155.6	-151	-64.9	169	-177.7	166.9	0	115.2
183	S	34.2	Very low	31.4	Very low	96 Å²	96	146.1 Å²	146.1	67%	0.671	82%	0.816	S	S	*	*			trans	72.8	151.8	160.5	81.7	0	0	0	0	116.4
184	F	30.5	Very low	31.2	Very low	200 Å²	200	148.5 Å²	148.5	88%	0.877	83%	0.827	S	S	*	*			cis	-126.7	149.3	-2.9	-84.9	-92.1	0	0	0	110.7
185	A	27	Very low	31	Very low	100 Å²	100	145.6 Å²	145.6	83%	0.826	83%	0.827	S	S	*	*			trans	-140.8	132.1	161.2	0	0	0	0	0	109.8
186	K	34.8	Very low	31	Very low	201 Å²	201	147.6 Å²	147.6	87%	0.874	83%	0.833	S	S	*	*			trans	-104.5	149.3	164.9	-83.1	-175.7	174.3	-179.9	0	108.7
187	P	30.8	Very low	30.8	Very low	126 Å²	126	148 Å²	148	82%	0.818	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-81.7	147.4	-174.4	32.4	-33.9	0	0	0	112.3
188	C	27.8	Very low	30.7	Very low	123 Å²	123	151.8 Å²	151.8	83%	0.831	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-95.9	150.5	163.4	-69	0	0	0	0	110.3
189	P	34.8	Very low	30.4	Very low	128 Å²	128	154.7 Å²	154.7	83%	0.831	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-89.5	144.5	-167.5	-3.8	24.2	0	0	0	112.8
190	L	31.2	Very low	30.1	Very low	176 Å²	176	153.2 Å²	153.2	92%	0.921	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-88.1	136.5	163.6	-69.6	171.6	0	0	0	109.9
191	S	30.4	Very low	29.3	Very low	110 Å²	110	156.7 Å²	156.7	77%	0.769	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-80.3	146.8	177.1	49.2	0	0	0	0	112
192	P	34.5	Very low	29	Very low	118 Å²	118	155.5 Å²	155.5	77%	0.766	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-85.7	124.3	-172.6	31.8	-34	0	0	0	113.3	K194	P192-K194 PolarHBondContact O-N 3.08Å
193	V	28.2	Very low	28.3	Very low	147 Å²	147	155.1 Å²	155.1	89%	0.891	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-74.9	120.1	164.7	178.9	0	0	0	0	109
194	K	29.2	Very low	28.6	Very low	199 Å²	199	155 Å²	155	87%	0.865	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-79.2	131.9	176.3	-77.8	-174.8	176.1	178.5	0	111.5	P192	P192-K194 PolarHBondContact O-N 3.08Å
195	A	27.3	Very low	28.3	Very low	106 Å²	106	153.1 Å²	153.1	88%	0.876	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-76.8	151.4	175.6	0	0	0	0	0	112.6
196	R	26.6	Very low	28.3	Very low	244 Å²	244	155.9 Å²	155.9	92%	0.921	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-96.9	120.5	177.9	176.9	-173.6	-177	-174.6	3	110.6
197	R	27	Very low	27.8	Very low	248 Å²	248	151.6 Å²	151.6	94%	0.936	81%	0.814	S	S	*	*			trans	-152.7	144.6	158	-111.5	176.7	-171.4	-153.9	-0.4	111.7
198	Q	25.5	Very low	27.5	Very low	181 Å²	181	150.9 Å²	150.9	85%	0.846	81%	0.807	S	S	*	*			trans	-82.8	159.1	174.1	-59	148.5	-80.7	0	0	110.3
199	L	24.4	Very low	27.3	Very low	177 Å²	177	150.9 Å²	150.9	93%	0.927	80%	0.803	S	S	*	*			trans	-165.3	177.4	136.6	-108	159.9	0	0	0	110.8
200	S	24.2	Very low	26.7	Very low	94 Å²	94	149.5 Å²	149.5	66%	0.657	80%	0.796	S	S	*	*			trans	-119.5	141.7	-153.1	53.8	0	0	0	0	115.3
201	H	23.1	Very low	26.5	Very low	174 Å²	174	148.9 Å²	148.9	81%	0.806	79%	0.792	S	S	*	*				45.7	104.6	128	-151.6	-64.9	0	0	0	119.1
202	T	22.7	Very low	26.3	Very low	136 Å²	136	152.5 Å²	152.5	83%	0.834	80%	0.797	S	S	*	*				-169.3	152.2	115.8	28.4	0	0	0	0	112.8
203	Q	20.6	Very low	26	Very low	174 Å²	174	156 Å²	156	81%	0.813	80%	0.803	S	S	*	*			trans	-96.1	179.2	167.7	-118	-177.6	-9.2	0	0	109.3
204	P	39.3	Very low	25.9	Very low	94 Å²	94	156.2 Å²	156.2	61%	0.61	80%	0.799	S	S	*	*			cis	-127.4	-155.6	-8.5	41.1	-22.6	0	0	0	111.2
205	E	25.1	Very low	25.9	Very low	159 Å²	159	156.5 Å²	156.5	74%	0.743	80%	0.804	S	S	*	*			cis	-141.8	-150.1	-0.5	-146.1	98.6	-112.9	0	0	106.8
206	E	26.2	Very low	25.9	Very low	159 Å²	159	153.6 Å²	153.6	74%	0.743	78%	0.784	S	S	*	*			cis	-147.2	-134.6	8.6	-149.5	-133.4	78.2	0	0	111.9
207	T	25.2	Very low	26	Very low	111 Å²	111	151.6 Å²	151.6	68%	0.681	79%	0.785	S	S	*	*			trans	-116.9	173	-170.7	73.1	0	0	0	0	113
208	V	24.3	Very low	26.1	Very low	111 Å²	111	147.2 Å²	147.2	67%	0.673	78%	0.779	S	S	*	*			cis	-158	154.3	3.8	90.3	0	0	0	0	112.4
209	T	23.3	Very low	26.5	Very low	123 Å²	123	143.6 Å²	143.6	76%	0.755	77%	0.772	S	S	*	*			trans	61.5	149	162.7	54.1	0	0	0	0	121
210	S	22.3	Very low	27	Very low	98 Å²	98	140.5 Å²	140.5	69%	0.685	76%	0.762	S	S	*	*			cis	-165.6	170.6	-13.3	49.2	0	0	0	0	112.1
211	I	26.4	Very low	27.7	Very low	163 Å²	163	142.3 Å²	142.3	84%	0.836	77%	0.771	S	S	*	*			trans	69.2	102.2	171.2	-47.6	179.7	0	0	0	114.9
212	Q	27.5	Very low	27.9	Very low	186 Å²	186	140.6 Å²	140.6	87%	0.869	77%	0.768	S	S	*	*			trans	-146.6	137.6	160.9	-159.3	169	11.4	0	0	109.1
213	E	27.1	Very low	28.7	Very low	192 Å²	192	137.3 Å²	137.3	90%	0.897	76%	0.761	S	S	*	*			trans	-80.7	138.8	173.5	-65.4	173.1	135.1	0	0	109
214	N	25.9	Very low	29.6	Very low	152 Å²	152	132.1 Å²	132.1	81%	0.813	74%	0.744	S	S	*	*			trans	-114.9	82.2	-158.8	-173.7	64.6	0	0	0	113.1	G216	N214-G216 VanDerWaalsContact C-N 3.27Å; N214-G216 PolarHBondContact O-N 2.98Å; N214-G216 VanDerWaalsContact O-N 3.08Å
215	E	30.7	Very low	29.6	Very low	205 Å²	205	131.3 Å²	131.3	96%	0.958	74%	0.741	S	S	*	*			trans	-76	81.5	160	-70.5	-161.3	124.8	0	0	109.5
216	G	26.4	Very low	30.6	Very low	44 Å²	44	126.9 Å²	126.9	45%	0.454	73%	0.727	S	S	.	*	P	Polyproline II helix	trans	-83	121.6	174.1	0	0	0	0	0	111.6	N214 L218	N214-G216 VanDerWaalsContact C-N 3.27Å; N214-G216 PolarHBondContact O-N 2.98Å; N214-G216 VanDerWaalsContact O-N 3.08Å; G216-L218 PolarHBondContact O-N 2.93Å
217	E	28.1	Very low	31.1	Very low	203 Å²	203	121.6 Å²	121.6	95%	0.949	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-57.3	120.7	164.3	-69.9	-178	107.1	0	0	109.6
218	L	30.5	Very low	31.7	Very low	155 Å²	155	125 Å²	125	81%	0.812	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-74.8	156.1	169.8	-105.3	71.2	0	0	0	110.6	G216	G216-L218 PolarHBondContact O-N 2.93Å
219	P	33	Very low	33.1	Very low	106 Å²	106	124.2 Å²	124.2	69%	0.688	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-56.6	164.3	170.4	-22.2	34.1	0	0	0	112.4
220	P	35	Very low	34.7	Very low	112 Å²	112	123.6 Å²	123.6	73%	0.727	70%	0.695	S	S	*	*	S	Bend	trans	-53.5	144.4	170.1	25.6	-35.8	0	0	0	110.2	D222	P220-D222 PolarHBondContact O-N 3.03Å; P220-D222 VanDerWaalsContact O-N 3.11Å
221	P	38.3	Very low	36.6	Very low	131 Å²	131	123.6 Å²	123.6	85%	0.851	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-61	118.4	-168.6	23.8	-34.2	0	0	0	111.3	G223	P221-G223 PolarHBondContact O-N 3.46Å
222	D	29.1	Very low	38.5	Very low	138 Å²	138	119.7 Å²	119.7	74%	0.738	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-54.3	133.4	173.3	-90.1	-47.6	0	0	0	110.3	P220 S224	P220-D222 PolarHBondContact O-N 3.03Å; P220-D222 VanDerWaalsContact O-N 3.11Å; D222-S224 PolarHBondContact O-N 3.18Å
223	G	38	Very low	40.3	Very low	67 Å²	67	115.8 Å²	115.8	69%	0.691	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	30.8	177	0	0	0	0	0	114.5	P221 S226	P221-G223 PolarHBondContact O-N 3.46Å; G223-S226 PolarHBondContact O-OG 2.99Å; G223-S226 VanDerWaalsContact O-OG 3.13Å
224	S	40.5	Very low	42.6	Very low	66 Å²	66	113 Å²	113	46%	0.462	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.2	-28.9	-172.3	61.7	0	0	0	0	113.6	D222 S226 A227	D222-S224 PolarHBondContact O-N 3.18Å; S224-S226 VanDerWaalsContact C-N 3.32Å; S224-S226 PolarHBondContact O-N 2.9Å; S224-A227 WeakPolarHBondContact O-CB 3.37Å; S224-A227 PolarHBondContact O-N 2.75Å
225	S	38.2	Very low	44.9	Very low	77 Å²	77	110.5 Å²	110.5	54%	0.538	62%	0.624	S	S	.	*	H	α-helix	trans	-57.4	-48.2	174.7	-166.9	0	0	0	0	110.7	A227 W228 D229	S225-A227 PolarHBondContact O-N 2.69Å; S225-W228 PolarHBondContact O-N 2.86Å; S225-W228 VanDerWaalsContact O-N 3.09Å; S225-D229 VanDerWaalsContact C-OD2 3.25Å; S225-D229 PolarHBondContact O-N 3.03Å; S225-D229 PolarHBondContact OG-OD2 3.46Å
226	S	46.8	Very low	47	Very low	65 Å²	65	106.1 Å²	106.1	46%	0.455	60%	0.6	S	S	.	*	H	α-helix	trans	-58.4	-23.9	-179.8	43.5	0	0	0	0	114.4	G223 S224 L230	G223-S226 PolarHBondContact O-OG 2.99Å; G223-S226 VanDerWaalsContact O-OG 3.13Å; S224-S226 VanDerWaalsContact C-N 3.32Å; S224-S226 PolarHBondContact O-N 2.9Å; S226-L230 WeakPolarHBondContact O-CB 3.49Å; S226-L230 WeakPolarHBondContact O-CD1 3.45Å; S226-L230 WeakPolarHBondContact O-CG 3.39Å; S226-L230 PolarHBondContact O-N 3.23Å
227	A	37.3	Very low	49.5	Very low	48 Å²	48	106.8 Å²	106.8	40%	0.397	60%	0.597	S	S	.	*	H	α-helix	trans	-71.5	-52.2	174.9	0	0	0	0	0	110.8	S224 S225 D229 L230 D231	S224-A227 WeakPolarHBondContact O-CB 3.37Å; S224-A227 PolarHBondContact O-N 2.75Å; S225-A227 PolarHBondContact O-N 2.69Å; A227-D229 VanDerWaalsContact C-N 3.31Å; A227-D229 PolarHBondContact O-N 3.05Å; A227-L230 PolarHBondContact O-N 3.01Å; A227-D231 WeakPolarHBondContact O-CB 3.49Å; A227-D231 PolarHBondContact O-N 3.13Å
228	W	37.6	Very low	52.1	Low	183 Å²	183	101.8 Å²	101.8	69%	0.693	57%	0.574	S	S	*	*	H	α-helix	trans	-63.7	-36.5	175.9	-64.2	101.8	0	0	0	112.3	S225 N232	S225-W228 PolarHBondContact O-N 2.86Å; S225-W228 VanDerWaalsContact O-N 3.09Å; W228-N232 VanDerWaalsContact O-CB 3.3Å; W228-N232 WeakPolarHBondContact O-CB 3.4Å; W228-N232 PolarHBondContact O-N 2.99Å; W228-N232 PolarHBondContact O-ND2 2.8Å
229	D	53.9	Low	54.7	Low	94 Å²	94	97.9 Å²	97.9	50%	0.503	55%	0.554	S	S	.	*	H	α-helix	trans	-68.2	-39.7	176.8	-66.2	-47.8	0	0	0	111.8	S225 A227 L233	S225-D229 VanDerWaalsContact C-OD2 3.25Å; S225-D229 PolarHBondContact O-N 3.03Å; S225-D229 PolarHBondContact OG-OD2 3.46Å; A227-D229 VanDerWaalsContact C-N 3.31Å; A227-D229 PolarHBondContact O-N 3.05Å; D229-L233 VanDerWaalsContact O-CB 3.25Å; D229-L233 WeakPolarHBondContact O-CB 3.39Å; D229-L233 PolarHBondContact O-N 3.11Å
230	L	55.6	Low	57.1	Low	110 Å²	110	93.9 Å²	93.9	58%	0.576	53%	0.527	S	S	*	.	H	α-helix	trans	-68	-46.2	174.1	-80.6	167.2	0	0	0	112.2	S226 A227 N232 L233 Q234	S226-L230 WeakPolarHBondContact O-CB 3.49Å; S226-L230 WeakPolarHBondContact O-CD1 3.45Å; S226-L230 WeakPolarHBondContact O-CG 3.39Å; S226-L230 PolarHBondContact O-N 3.23Å; A227-L230 PolarHBondContact O-N 3.01Å; L230-N232 VanDerWaalsContact C-N 3.33Å; L230-N232 PolarHBondContact O-N 3.42Å; L230-L233 PolarHBondContact O-N 3.41Å; L230-Q234 VanDerWaalsContact O-CB 3.25Å; L230-Q234 WeakPolarHBondContact O-CB 3.46Å; L230-Q234 PolarHBondContact O-N 2.88Å
231	D	62.7	Low	59.5	Low	99 Å²	99	93.3 Å²	93.3	53%	0.529	52%	0.517	S	S	.	.	H	α-helix	trans	-62.5	-40.6	178.2	-78.9	-25	0	0	0	111.4	A227 M235	A227-D231 WeakPolarHBondContact O-CB 3.49Å; A227-D231 PolarHBondContact O-N 3.13Å; D231-M235 VanDerWaalsContact O-CB 3.24Å; D231-M235 WeakPolarHBondContact O-CB 3.24Å; D231-M235 PolarHBondContact O-N 3.01Å
232	N	65.6	Low	61.8	Low	81 Å²	81	90.3 Å²	90.3	43%	0.433	49%	0.493	S	S	.	.	H	α-helix	trans	-66.1	-41.6	174.2	-82.7	-70.8	0	0	0	112.3	W228 L230 M235 Y236	W228-N232 VanDerWaalsContact O-CB 3.3Å; W228-N232 WeakPolarHBondContact O-CB 3.4Å; W228-N232 PolarHBondContact O-N 2.99Å; W228-N232 PolarHBondContact O-ND2 2.8Å; L230-N232 VanDerWaalsContact C-N 3.33Å; L230-N232 PolarHBondContact O-N 3.42Å; N232-M235 PolarHBondContact O-N 2.9Å; N232-M235 WeakPolarHBondContact OD1-CE 3.48Å; N232-Y236 WeakPolarHBondContact O-CB 3.49Å; N232-Y236 PolarHBondContact O-N 3.29Å
233	L	66.6	Low	64.6	Low	103 Å²	103	85.4 Å²	85.4	54%	0.539	47%	0.467	S	S	.	.	H	α-helix	trans	-67.7	-38.1	177.8	-173.7	66.2	0	0	0	112.1	D229 L230 Y236 S237	D229-L233 VanDerWaalsContact O-CB 3.25Å; D229-L233 WeakPolarHBondContact O-CB 3.39Å; D229-L233 PolarHBondContact O-N 3.11Å; L230-L233 PolarHBondContact O-N 3.41Å; L233-Y236 WeakPolarHBondContact O-CB 3.41Å; L233-Y236 PolarHBondContact O-N 2.85Å; L233-S237 PolarHBondContact O-N 2.79Å
234	Q	74.3	Confident	67	Low	135 Å²	135	87.2 Å²	87.2	63%	0.631	45%	0.453	S	S	*	.	H	α-helix	trans	-69.4	-39.8	175.3	-177.9	170.6	-32.7	0	0	111.7	L230 Y236 S237 Q238	L230-Q234 VanDerWaalsContact O-CB 3.25Å; L230-Q234 WeakPolarHBondContact O-CB 3.46Å; L230-Q234 PolarHBondContact O-N 2.88Å; Q234-Y236 VanDerWaalsContact C-N 3.33Å; Q234-S237 PolarHBondContact O-N 3.35Å; Q234-S237 PolarHBondContact O-OG 3.46Å; Q234-S237 VanDerWaalsContact O-OG 3.05Å; Q234-Q238 WeakPolarHBondContact O-CB 3.42Å; Q234-Q238 PolarHBondContact O-N 3.19Å
235	M	75.4	Confident	69.4	Low	99 Å²	99	89.7 Å²	89.7	49%	0.488	46%	0.457	S	S	.	.	H	α-helix	trans	-61.8	-41.1	169.1	178	176.7	57.5	0	0	111.2	D231 N232 Q238 N239	D231-M235 VanDerWaalsContact O-CB 3.24Å; D231-M235 WeakPolarHBondContact O-CB 3.24Å; D231-M235 PolarHBondContact O-N 3.01Å; N232-M235 PolarHBondContact O-N 2.9Å; N232-M235 WeakPolarHBondContact OD1-CE 3.48Å; M235-Q238 PolarHBondContact O-N 2.76Å; M235-N239 WeakPolarHBondContact O-CB 3.5Å; M235-N239 PolarHBondContact O-N 3.13Å; M235-N239 PolarHBondContact O-ND2 2.95Å; M235-N239 VanDerWaalsContact O-ND2 3.11Å
236	Y	74.4	Confident	71.8	Confident	112 Å²	112	90.8 Å²	90.8	44%	0.439	45%	0.454	S	S	.	.	H	α-helix	trans	-63.5	-45.6	176.7	-125.3	-96.7	0	0	0	112.1	N232 L233 Q234 N239 I240 M289	N232-Y236 WeakPolarHBondContact O-CB 3.49Å; N232-Y236 PolarHBondContact O-N 3.29Å; L233-Y236 WeakPolarHBondContact O-CB 3.41Å; L233-Y236 PolarHBondContact O-N 2.85Å; Q234-Y236 VanDerWaalsContact C-N 3.33Å; Y236-N239 PolarHBondContact O-N 3.04Å; Y236-I240 WeakPolarHBondContact O-CG1 3.48Å; Y236-I240 PolarHBondContact O-N 2.91Å; Y236-M289 HydrophobicContact CD1-CE 3.71Å; Y236-M289 HydrophobicContact CD1-SD 3.85Å; Y236-M289 HydrophobicContact CE1-CE 3.46Å; Y236-M289 VanDerWaalsContact CE1-CE 3.46Å; Y236-M289 HydrophobicContact CE1-SD 3.5Å; Y236-M289 WeakPolarHBondContact CE1-SD 3.3Å
237	S	79.1	Confident	73.9	Confident	58 Å²	58	88.5 Å²	88.5	41%	0.406	44%	0.437	S	S	.	.	H	α-helix	trans	-66.3	-38.9	178.4	68.7	0	0	0	0	112.3	L233 Q234 N239 I240 L241	L233-S237 PolarHBondContact O-N 2.79Å; Q234-S237 PolarHBondContact O-N 3.35Å; Q234-S237 PolarHBondContact O-OG 3.46Å; Q234-S237 VanDerWaalsContact O-OG 3.05Å; S237-N239 VanDerWaalsContact C-N 3.33Å; S237-N239 PolarHBondContact O-N 3.46Å; S237-I240 PolarHBondContact O-N 3.34Å; S237-L241 WeakPolarHBondContact O-CG 3.42Å; S237-L241 PolarHBondContact O-N 2.94Å; S237-L241 VanDerWaalsContact O-N 3.08Å
238	Q	83.1	Confident	76.4	Confident	99 Å²	99	89.2 Å²	89.2	46%	0.463	44%	0.439	S	S	.	.	H	α-helix	trans	-62.5	-39.5	172.1	-169.9	61.2	58.7	0	0	112	Q234 M235 L241 L242	Q234-Q238 WeakPolarHBondContact O-CB 3.42Å; Q234-Q238 PolarHBondContact O-N 3.19Å; M235-Q238 PolarHBondContact O-N 2.76Å; Q238-L241 PolarHBondContact O-N 3.33Å; Q238-L242 HydrophobicContact CG-CD1 4.27Å; Q238-L242 WeakPolarHBondContact O-CG 3.26Å; Q238-L242 PolarHBondContact O-N 2.98Å
239	N	83.8	Confident	78.9	Confident	73 Å²	73	83.2 Å²	83.2	39%	0.39	42%	0.421	S	S	.	.	H	α-helix	trans	-66.9	-36.5	175.2	-73.8	-30.1	0	0	0	112.7	M235 Y236 S237 L243	M235-N239 WeakPolarHBondContact O-CB 3.5Å; M235-N239 PolarHBondContact O-N 3.13Å; M235-N239 PolarHBondContact O-ND2 2.95Å; M235-N239 VanDerWaalsContact O-ND2 3.11Å; Y236-N239 PolarHBondContact O-N 3.04Å; S237-N239 VanDerWaalsContact C-N 3.33Å; S237-N239 PolarHBondContact O-N 3.46Å; N239-L243 WeakPolarHBondContact O-CB 3.42Å; N239-L243 WeakPolarHBondContact O-CG 3.48Å; N239-L243 PolarHBondContact O-N 3.43Å
240	I	83.1	Confident	80.4	Confident	22 Å²	22	79.6 Å²	79.6	11%	0.113	40%	0.402	C	S	.	.	H	α-helix	trans	-61.1	-45.1	172.3	-66.9	165.1	0	0	0	110.6	Y236 S237 L243 R244 M289	Y236-I240 WeakPolarHBondContact O-CG1 3.48Å; Y236-I240 PolarHBondContact O-N 2.91Å; S237-I240 PolarHBondContact O-N 3.34Å; I240-L243 PolarHBondContact O-N 3.28Å; I240-R244 PolarHBondContact O-N 3.42Å; I240-M289 HydrophobicContact CD1-CE 3.59Å; I240-M289 HydrophobicContact CD1-SD 4.19Å; I240-M289 HydrophobicContact CG1-CE 3.61Å; I240-M289 HydrophobicContact CG1-SD 3.51Å; I240-M289 VanDerWaalsContact CG1-SD 3.51Å
241	L	85.8	Confident	82	Confident	100 Å²	100	76.7 Å²	76.7	52%	0.524	39%	0.385	S	S	.	.	H	α-helix	trans	-62.5	-48.3	179.3	-69	170.3	0	0	0	111.2	S237 Q238 L243 R244 E245	S237-L241 WeakPolarHBondContact O-CG 3.42Å; S237-L241 PolarHBondContact O-N 2.94Å; S237-L241 VanDerWaalsContact O-N 3.08Å; Q238-L241 PolarHBondContact O-N 3.33Å; L241-L243 VanDerWaalsContact C-N 3.33Å; L241-L243 PolarHBondContact O-N 3.04Å; L241-R244 PolarHBondContact O-N 2.91Å; L241-E245 PolarHBondContact O-N 3.33Å
242	L	88	Confident	83.3	Confident	67 Å²	67	78.8 Å²	78.8	35%	0.351	39%	0.386	S	S	.	.	H	α-helix	trans	-62.5	-36.8	176.4	-68.9	168.6	0	0	0	112.5	Q238 E245 Q246	Q238-L242 HydrophobicContact CG-CD1 4.27Å; Q238-L242 WeakPolarHBondContact O-CG 3.26Å; Q238-L242 PolarHBondContact O-N 2.98Å; L242-E245 PolarHBondContact O-N 3.42Å; L242-Q246 WeakPolarHBondContact O-CB 3.19Å; L242-Q246 VanDerWaalsContact O-CG 3.23Å; L242-Q246 WeakPolarHBondContact O-CG 3.35Å; L242-Q246 PolarHBondContact O-N 2.91Å
243	L	87	Confident	84.2	Confident	35 Å²	35	79.7 Å²	79.7	18%	0.183	39%	0.388	C	S	.	.	H	α-helix	trans	-66	-39	174	-83.1	164.5	0	0	0	112.4	N239 I240 L241 V247 L282	N239-L243 WeakPolarHBondContact O-CB 3.42Å; N239-L243 WeakPolarHBondContact O-CG 3.48Å; N239-L243 PolarHBondContact O-N 3.43Å; I240-L243 PolarHBondContact O-N 3.28Å; L241-L243 VanDerWaalsContact C-N 3.33Å; L241-L243 PolarHBondContact O-N 3.04Å; L243-V247 VanDerWaalsContact O-CG2 3.3Å; L243-V247 WeakPolarHBondContact O-CG2 3.48Å; L243-V247 PolarHBondContact O-N 2.64Å; L243-L282 HydrophobicContact CD2-CD2 4.3Å
244	R	88.8	Confident	85.1	Confident	106 Å²	106	75.1 Å²	75.1	40%	0.4	36%	0.364	S	S	.	.	H	α-helix	trans	-68.4	-38	175.2	-78.2	-179	170.8	161.2	1.7	112.2	I240 L241 S248 M286 E290	I240-R244 PolarHBondContact O-N 3.42Å; L241-R244 PolarHBondContact O-N 2.91Å; R244-S248 WeakPolarHBondContact O-CB 3.32Å; R244-S248 PolarHBondContact O-N 2.94Å; R244-S248 PolarHBondContact O-OG 2.9Å; R244-M286 HydrophobicContact CG-CG 4.47Å; R244-M286 HydrophobicContact CG-SD 3.94Å; R244-E290 IonicContact CZ-OE1 2.77Å; R244-E290 IonicContact NE-OE1 2.71Å; R244-E290 IonicContact NH2-OE1 2.87Å; R244-E290 PolarHBondContact NH2-OE1 2.89Å
245	E	90.7	Very high	85.6	Confident	117 Å²	117	73.7 Å²	73.7	55%	0.547	36%	0.357	S	S	.	.	H	α-helix	trans	-63.9	-49.2	173.4	-172.3	168.1	-135.9	0	0	111	L241 L242 V247 S248 D249	L241-E245 PolarHBondContact O-N 3.33Å; L242-E245 PolarHBondContact O-N 3.42Å; E245-V247 PolarHBondContact O-N 3Å; E245-S248 CarbonylContact O-C 3.49Å; E245-S248 WeakPolarHBondContact O-CA 3.43Å; E245-S248 WeakPolarHBondContact O-CB 3.14Å; E245-S248 PolarHBondContact O-N 3.19Å; E245-D249 PolarHBondContact O-N 3.28Å
246	Q	89.1	Confident	86	Confident	100 Å²	100	73 Å²	73	47%	0.467	36%	0.362	S	S	.	.	H	α-helix	trans	-57.3	-46.1	174.8	-75.1	172.6	5.6	0	0	112.7	L242 S248 D249 T250	L242-Q246 WeakPolarHBondContact O-CB 3.19Å; L242-Q246 VanDerWaalsContact O-CG 3.23Å; L242-Q246 WeakPolarHBondContact O-CG 3.35Å; L242-Q246 PolarHBondContact O-N 2.91Å; Q246-S248 VanDerWaalsContact C-N 3.28Å; Q246-S248 PolarHBondContact O-N 2.95Å; Q246-D249 PolarHBondContact O-N 3.3Å; Q246-T250 WeakPolarHBondContact O-CB 3.34Å; Q246-T250 PolarHBondContact O-N 3.44Å; Q246-T250 PolarHBondContact O-OG1 2.87Å
247	V	90.6	Very high	86.2	Confident	18 Å²	18	70 Å²	70	11%	0.109	35%	0.353	C	S	.	.	H	α-helix	trans	-57.9	-42.4	173.8	168.2	0	0	0	0	111.1	L243 E245 Q251 L279 L282 R283	L243-V247 VanDerWaalsContact O-CG2 3.3Å; L243-V247 WeakPolarHBondContact O-CG2 3.48Å; L243-V247 PolarHBondContact O-N 2.64Å; E245-V247 PolarHBondContact O-N 3Å; V247-Q251 WeakPolarHBondContact O-CB 3.37Å; V247-Q251 PolarHBondContact O-N 3.43Å; V247-L279 HydrophobicContact CG1-CD1 4.33Å; V247-L282 HydrophobicContact CG2-CB 3.69Å; V247-R283 HydrophobicContact CG1-CG 4.15Å
248	S	90.2	Very high	85.9	Confident	62 Å²	62	72.4 Å²	72.4	43%	0.434	36%	0.358	S	S	.	.	H	α-helix	trans	-70.7	-34.9	-177.6	-57.3	0	0	0	0	113.3	R244 E245 Q246 R252	R244-S248 WeakPolarHBondContact O-CB 3.32Å; R244-S248 PolarHBondContact O-N 2.94Å; R244-S248 PolarHBondContact O-OG 2.9Å; E245-S248 CarbonylContact O-C 3.49Å; E245-S248 WeakPolarHBondContact O-CA 3.43Å; E245-S248 WeakPolarHBondContact O-CB 3.14Å; E245-S248 PolarHBondContact O-N 3.19Å; Q246-S248 VanDerWaalsContact C-N 3.28Å; Q246-S248 PolarHBondContact O-N 2.95Å; S248-R252 PolarHBondContact O-N 3.37Å; S248-R252 VanDerWaalsContact O-N 3.15Å
249	D	89.9	Confident	85.2	Confident	58 Å²	58	70.9 Å²	70.9	31%	0.31	37%	0.369	S	S	.	.	H	α-helix	trans	-79	-40.3	177	-78.5	-9.3	0	0	0	111.9	E245 Q246 Q251 R252 Q253	E245-D249 PolarHBondContact O-N 3.28Å; Q246-D249 PolarHBondContact O-N 3.3Å; D249-Q251 VanDerWaalsContact C-N 3.31Å; D249-Q251 PolarHBondContact O-N 2.95Å; D249-R252 PolarHBondContact O-N 3.35Å; D249-R252 IonicContact OD1-CZ 2.74Å; D249-R252 IonicContact OD1-NH1 3.2Å; D249-R252 PolarHBondContact OD1-NH1 2.98Å; D249-R252 IonicContact OD1-NH2 3.43Å; D249-R252 PolarHBondContact OD1-NH2 3.39Å; D249-Q253 VanDerWaalsContact O-CG 3.31Å; D249-Q253 WeakPolarHBondContact O-CG 3.42Å; D249-Q253 PolarHBondContact O-N 2.87Å
250	T	85.5	Confident	84.2	Confident	17 Å²	17	72.2 Å²	72.2	10%	0.104	37%	0.373	C	S	.	.	H	α-helix	trans	-63.5	-38.8	172.2	-51.1	0	0	0	0	111	Q246 Q253 V254 L275 L279	Q246-T250 WeakPolarHBondContact O-CB 3.34Å; Q246-T250 PolarHBondContact O-N 3.44Å; Q246-T250 PolarHBondContact O-OG1 2.87Å; T250-Q253 PolarHBondContact O-N 3.5Å; T250-V254 WeakPolarHBondContact O-CG2 3.49Å; T250-V254 PolarHBondContact O-N 3.44Å; T250-L275 HydrophobicContact CG2-CD2 4.49Å; T250-L279 HydrophobicContact CG2-CB 3.98Å
251	Q	89.4	Confident	82.9	Confident	49 Å²	49	76.7 Å²	76.7	23%	0.229	40%	0.403	C	S	.	.	H	α-helix	trans	-55.3	-52	170.9	-179.8	67.4	36.8	0	0	111.3	V247 D249 Q253 V254 E255 L279	V247-Q251 WeakPolarHBondContact O-CB 3.37Å; V247-Q251 PolarHBondContact O-N 3.43Å; D249-Q251 VanDerWaalsContact C-N 3.31Å; D249-Q251 PolarHBondContact O-N 2.95Å; Q251-Q253 VanDerWaalsContact C-N 3.28Å; Q251-Q253 PolarHBondContact O-N 2.93Å; Q251-V254 PolarHBondContact O-N 3.43Å; Q251-E255 WeakPolarHBondContact CG-OE1 3.46Å; Q251-E255 PolarHBondContact NE2-OE1 3.37Å; Q251-E255 WeakPolarHBondContact O-CG 3.45Å; Q251-E255 PolarHBondContact O-N 3.46Å; Q251-L279 HydrophobicContact CB-CD1 4.27Å
252	R	89.4	Confident	81.4	Confident	143 Å²	143	84 Å²	84	54%	0.54	42%	0.424	S	S	.	.	H	α-helix	trans	-63.3	-32.5	-179.7	-159.9	-173.9	-51.6	118.2	19.4	112.6	S248 D249 S256	S248-R252 PolarHBondContact O-N 3.37Å; S248-R252 VanDerWaalsContact O-N 3.15Å; D249-R252 PolarHBondContact O-N 3.35Å; D249-R252 IonicContact OD1-CZ 2.74Å; D249-R252 IonicContact OD1-NH1 3.2Å; D249-R252 PolarHBondContact OD1-NH1 2.98Å; D249-R252 IonicContact OD1-NH2 3.43Å; D249-R252 PolarHBondContact OD1-NH2 3.39Å; R252-S256 WeakPolarHBondContact O-CB 3.35Å; R252-S256 PolarHBondContact O-N 3.19Å
253	Q	84.9	Confident	79.8	Confident	101 Å²	101	89.3 Å²	89.3	47%	0.472	45%	0.447	S	S	.	.	H	α-helix	trans	-69.1	-42.6	174.9	-72.6	171.7	22.2	0	0	112.2	D249 T250 Q251 S256 L257	D249-Q253 VanDerWaalsContact O-CG 3.31Å; D249-Q253 WeakPolarHBondContact O-CG 3.42Å; D249-Q253 PolarHBondContact O-N 2.87Å; T250-Q253 PolarHBondContact O-N 3.5Å; Q251-Q253 VanDerWaalsContact C-N 3.28Å; Q251-Q253 PolarHBondContact O-N 2.93Å; Q253-S256 PolarHBondContact O-N 3.26Å; Q253-L257 WeakPolarHBondContact O-CG 3.45Å; Q253-L257 PolarHBondContact O-N 2.93Å; Q253-L257 VanDerWaalsContact O-N 3.12Å
254	V	84.9	Confident	78.2	Confident	7 Å²	7	93 Å²	93	4%	0.042	48%	0.482	C	S	.	.	H	α-helix	trans	-61.6	-50.6	174	171.9	0	0	0	0	110.4	T250 Q251 S256 L257 E258 L275 Q276 L279	T250-V254 WeakPolarHBondContact O-CG2 3.49Å; T250-V254 PolarHBondContact O-N 3.44Å; Q251-V254 PolarHBondContact O-N 3.43Å; V254-S256 VanDerWaalsContact C-N 3.32Å; V254-S256 PolarHBondContact O-N 3.49Å; V254-L257 PolarHBondContact O-N 2.94Å; V254-L257 VanDerWaalsContact O-N 3.15Å; V254-E258 HydrophobicContact CG1-CG 4.33Å; V254-E258 VanDerWaalsContact CG1-OE1 3.23Å; V254-E258 WeakPolarHBondContact CG1-OE1 3.43Å; V254-E258 WeakPolarHBondContact O-CG 3.41Å; V254-E258 PolarHBondContact O-N 3.4Å; V254-L275 HydrophobicContact CG2-CB 3.7Å; V254-Q276 HydrophobicContact CG1-CG 4.05Å; V254-L279 HydrophobicContact CG2-CD2 4.22Å
255	E	84.8	Confident	76.9	Confident	104 Å²	104	91.2 Å²	91.2	49%	0.486	48%	0.481	S	S	.	.	H	α-helix	trans	-57.9	-41.5	178.4	-71.1	169.1	177.3	0	0	112.8	Q251 E258 G259	Q251-E255 WeakPolarHBondContact CG-OE1 3.46Å; Q251-E255 PolarHBondContact NE2-OE1 3.37Å; Q251-E255 WeakPolarHBondContact O-CG 3.45Å; Q251-E255 PolarHBondContact O-N 3.46Å; E255-E258 PolarHBondContact O-N 3.01Å; E255-G259 PolarHBondContact O-N 2.92Å
256	S	84.5	Confident	75.8	Confident	85 Å²	85	90.6 Å²	90.6	59%	0.594	49%	0.487	S	S	*	.	H	α-helix	trans	-65.2	-37.7	177.7	-171.8	0	0	0	0	112.8	R252 Q253 V254	R252-S256 WeakPolarHBondContact O-CB 3.35Å; R252-S256 PolarHBondContact O-N 3.19Å; Q253-S256 PolarHBondContact O-N 3.26Å; V254-S256 VanDerWaalsContact C-N 3.32Å; V254-S256 PolarHBondContact O-N 3.49Å
257	L	77.4	Confident	74.8	Confident	49 Å²	49	91.7 Å²	91.7	26%	0.257	50%	0.495	S	S	.	.	H	α-helix	trans	-78.3	-28.4	178.5	-70	169.8	0	0	0	113.1	Q253 V254 V272 L275	Q253-L257 WeakPolarHBondContact O-CG 3.45Å; Q253-L257 PolarHBondContact O-N 2.93Å; Q253-L257 VanDerWaalsContact O-N 3.12Å; V254-L257 PolarHBondContact O-N 2.94Å; V254-L257 VanDerWaalsContact O-N 3.15Å; L257-V272 HydrophobicContact CB-CG2 3.82Å; L257-V272 HydrophobicContact CD1-CG2 4.46Å; L257-L275 HydrophobicContact CD1-CD1 3.45Å; L257-L275 VanDerWaalsContact CD1-CD1 3.45Å
258	E	73.9	Confident	73.9	Confident	108 Å²	108	95.5 Å²	95.5	51%	0.505	51%	0.508	S	S	.	.	H	α-helix	trans	-79.5	-27	176.3	-72.3	179.1	-176	0	0	113.4	V254 E255 V272 Q276	V254-E258 HydrophobicContact CG1-CG 4.33Å; V254-E258 VanDerWaalsContact CG1-OE1 3.23Å; V254-E258 WeakPolarHBondContact CG1-OE1 3.43Å; V254-E258 WeakPolarHBondContact O-CG 3.41Å; V254-E258 PolarHBondContact O-N 3.4Å; E255-E258 PolarHBondContact O-N 3.01Å; E258-V272 HydrophobicContact CG-CG1 4.07Å; E258-Q276 PolarHBondContact OE1-NE2 3.02Å
259	G	67.7	Low	73.1	Confident	67 Å²	67	94.2 Å²	94.2	69%	0.691	50%	0.504	S	S	*	.	S	Bend	trans	-78	-10.6	-178.2	0	0	0	0	0	116.1	E255	E255-G259 PolarHBondContact O-N 2.92Å
260	E	62.3	Low	72.6	Confident	102 Å²	102	96.9 Å²	96.9	48%	0.477	52%	0.515	S	S	.	.	S	Bend	trans	-79.9	147.3	-175.9	-73.5	-130.4	103.7	0	0	114	R262 R268	E260-R262 PolarHBondContact O-N 2.98Å; E260-R268 IonicContact OE2-CZ 3.23Å; E260-R268 VanDerWaalsContact OE2-CZ 3.23Å; E260-R268 IonicContact OE2-NH1 2.81Å; E260-R268 PolarHBondContact OE2-NH1 3.43Å; E260-R268 IonicContact OE2-NH2 2.7Å; E260-R268 PolarHBondContact OE2-NH2 2.89Å
261	P	56.8	Low	72.4	Confident	115 Å²	115	101.2 Å²	101.2	75%	0.747	53%	0.534	S	S	*	.			trans	-66.2	132.7	-175.5	26.2	-34.4	0	0	0	112.7	Q263	P261-Q263 PolarHBondContact O-N 3.05Å
262	R	54.4	Low	72.1	Confident	253 Å²	253	99.9 Å²	99.9	96%	0.955	53%	0.529	S	S	*	.			trans	-62.1	95.8	-172.1	-66.2	179.5	178.2	173.8	-1.3	114.1	E260	E260-R262 PolarHBondContact O-N 2.98Å
263	Q	53.2	Low	71.8	Confident	180 Å²	180	99.9 Å²	99.9	84%	0.841	53%	0.529	S	S	*	.			trans	-94.2	140.7	143.2	-70.7	-172.4	-6.4	0	0	109	P261 D265	P261-Q263 PolarHBondContact O-N 3.05Å; Q263-D265 VanDerWaalsContact C-N 3.3Å; Q263-D265 PolarHBondContact O-N 3.32Å
264	A	53.6	Low	71.9	Confident	111 Å²	111	100.6 Å²	100.6	92%	0.917	53%	0.532	S	S	*	.			trans	-82.8	70.7	-172.1	0	0	0	0	0	111.9	P266	A264-P266 WeakPolarHBondContact O-CD 3.26Å
265	D	62.5	Low	71.9	Confident	69 Å²	69	101.3 Å²	101.3	37%	0.369	54%	0.536	S	S	.	.			trans	-87.6	114.9	170.2	177.1	11.8	0	0	0	110.6	Q263 L267 R268 G269	Q263-D265 VanDerWaalsContact C-N 3.3Å; Q263-D265 PolarHBondContact O-N 3.32Å; D265-L267 PolarHBondContact O-N 2.96Å; D265-L267 WeakPolarHBondContact OD1-CB 3.47Å; D265-L267 PolarHBondContact OD1-N 3.35Å; D265-R268 HydrophobicContact CB-CB 4.33Å; D265-R268 HydrophobicContact CB-CG 4.49Å; D265-R268 PolarHBondContact OD2-N 3.01Å; D265-G269 PolarHBondContact O-N 2.89Å
266	P	66.9	Low	72	Confident	105 Å²	105	99.8 Å²	99.8	68%	0.682	53%	0.528	S	S	*	.	H	α-helix	trans	-60.8	-30.3	176.5	-22.8	34.9	0	0	0	113.8	A264 G269 E270	A264-P266 WeakPolarHBondContact O-CD 3.26Å; P266-G269 PolarHBondContact O-N 3.2Å; P266-E270 PolarHBondContact O-N 3.11Å
267	L	68.9	Low	72.3	Confident	123 Å²	123	97.4 Å²	97.4	64%	0.644	52%	0.518	S	S	*	.	H	α-helix	trans	-72.1	-44.1	-175.3	-64	167.1	0	0	0	111.3	D265 G269 E270 Q271	D265-L267 PolarHBondContact O-N 2.96Å; D265-L267 WeakPolarHBondContact OD1-CB 3.47Å; D265-L267 PolarHBondContact OD1-N 3.35Å; L267-G269 VanDerWaalsContact C-N 3.27Å; L267-G269 PolarHBondContact O-N 3.41Å; L267-E270 WeakPolarHBondContact O-CB 3.47Å; L267-E270 PolarHBondContact O-N 3.12Å; L267-E270 VanDerWaalsContact O-N 3.09Å; L267-Q271 PolarHBondContact O-N 3.42Å
268	R	70.6	Confident	72.8	Confident	98 Å²	98	99.2 Å²	99.2	37%	0.37	53%	0.525	S	S	.	.	H	α-helix	trans	-54.7	-43.2	169.9	-85.9	-171.6	177.2	-133.4	9.3	112.2	E260 D265 E270 Q271 V272	E260-R268 IonicContact OE2-CZ 3.23Å; E260-R268 VanDerWaalsContact OE2-CZ 3.23Å; E260-R268 IonicContact OE2-NH1 2.81Å; E260-R268 PolarHBondContact OE2-NH1 3.43Å; E260-R268 IonicContact OE2-NH2 2.7Å; E260-R268 PolarHBondContact OE2-NH2 2.89Å; D265-R268 HydrophobicContact CB-CB 4.33Å; D265-R268 HydrophobicContact CB-CG 4.49Å; D265-R268 PolarHBondContact OD2-N 3.01Å; R268-E270 PolarHBondContact O-N 2.97Å; R268-Q271 PolarHBondContact O-N 3.23Å; R268-V272 WeakPolarHBondContact O-CG2 3.24Å; R268-V272 PolarHBondContact O-N 3.15Å
269	G	74.2	Confident	73.6	Confident	34 Å²	34	94.5 Å²	94.5	35%	0.351	50%	0.503	S	S	.	.	H	α-helix	trans	-63.9	-24.8	179	0	0	0	0	0	113.9	D265 P266 L267 R273	D265-G269 PolarHBondContact O-N 2.89Å; P266-G269 PolarHBondContact O-N 3.2Å; L267-G269 VanDerWaalsContact C-N 3.27Å; L267-G269 PolarHBondContact O-N 3.41Å; G269-R273 WeakPolarHBondContact O-CG 3.39Å; G269-R273 VanDerWaalsContact O-CZ 3.3Å; G269-R273 PolarHBondContact O-NH1 3.5Å
270	E	79	Confident	74.7	Confident	115 Å²	115	97.5 Å²	97.5	54%	0.537	50%	0.499	S	S	.	.	H	α-helix	trans	-84	-43.5	173.9	-169.4	136.2	-101.2	0	0	112.1	P266 L267 R268 V272 R273 E274	P266-E270 PolarHBondContact O-N 3.11Å; L267-E270 WeakPolarHBondContact O-CB 3.47Å; L267-E270 PolarHBondContact O-N 3.12Å; L267-E270 VanDerWaalsContact O-N 3.09Å; R268-E270 PolarHBondContact O-N 2.97Å; E270-V272 VanDerWaalsContact C-N 3.31Å; E270-V272 PolarHBondContact O-N 3.27Å; E270-R273 PolarHBondContact O-N 3.11Å; E270-R273 VanDerWaalsContact O-N 3.14Å; E270-R273 IonicContact OE1-NH2 2.91Å; E270-R273 PolarHBondContact OE1-NH2 2.94Å; E270-E274 PolarHBondContact O-N 3.4Å
271	Q	81.4	Confident	76.1	Confident	107 Å²	107	95 Å²	95	50%	0.5	50%	0.495	S	S	.	.	H	α-helix	trans	-59.3	-39	176.1	-171.6	176.7	11.8	0	0	112.6	L267 R268 E274 L275	L267-Q271 PolarHBondContact O-N 3.42Å; R268-Q271 PolarHBondContact O-N 3.23Å; Q271-E274 PolarHBondContact O-N 3.18Å; Q271-L275 HydrophobicContact CG-CD1 4.25Å; Q271-L275 WeakPolarHBondContact O-CG 3.2Å; Q271-L275 PolarHBondContact O-N 2.92Å
272	V	82.6	Confident	77.7	Confident	22 Å²	22	90.7 Å²	90.7	13%	0.133	47%	0.466	C	S	.	.	H	α-helix	trans	-65.2	-42	175.1	169.9	0	0	0	0	111.5	L257 E258 R268 E270 E274 L275 Q276	L257-V272 HydrophobicContact CB-CG2 3.82Å; L257-V272 HydrophobicContact CD1-CG2 4.46Å; E258-V272 HydrophobicContact CG-CG1 4.07Å; R268-V272 WeakPolarHBondContact O-CG2 3.24Å; R268-V272 PolarHBondContact O-N 3.15Å; E270-V272 VanDerWaalsContact C-N 3.31Å; E270-V272 PolarHBondContact O-N 3.27Å; V272-E274 PolarHBondContact O-N 2.62Å; V272-L275 PolarHBondContact O-N 3.43Å; V272-Q276 HydrophobicContact CG1-CG 4.3Å; V272-Q276 WeakPolarHBondContact O-CB 3.24Å; V272-Q276 WeakPolarHBondContact O-CG 3.22Å; V272-Q276 PolarHBondContact O-N 3.29Å
273	R	83.3	Confident	79.4	Confident	143 Å²	143	83.7 Å²	83.7	54%	0.54	44%	0.44	S	S	.	.	H	α-helix	trans	-63.1	-41.5	176.6	-71.6	-173.3	-58.2	-95.8	7.2	112.3	G269 E270 Q276 G277	G269-R273 WeakPolarHBondContact O-CG 3.39Å; G269-R273 VanDerWaalsContact O-CZ 3.3Å; G269-R273 PolarHBondContact O-NH1 3.5Å; E270-R273 PolarHBondContact O-N 3.11Å; E270-R273 VanDerWaalsContact O-N 3.14Å; E270-R273 IonicContact OE1-NH2 2.91Å; E270-R273 PolarHBondContact OE1-NH2 2.94Å; R273-Q276 PolarHBondContact O-N 3.33Å; R273-G277 PolarHBondContact O-N 3.44Å
274	E	87	Confident	81.2	Confident	116 Å²	116	77.4 Å²	77.4	54%	0.542	42%	0.418	S	S	.	.	H	α-helix	trans	-63.3	-47.2	177	178.9	57.2	-151.5	0	0	111.1	E270 Q271 V272 Q276 G277 Q278	E270-E274 PolarHBondContact O-N 3.4Å; Q271-E274 PolarHBondContact O-N 3.18Å; V272-E274 PolarHBondContact O-N 2.62Å; E274-Q276 PolarHBondContact O-N 3.06Å; E274-G277 PolarHBondContact O-N 2.99Å; E274-Q278 WeakPolarHBondContact O-CG 3.5Å; E274-Q278 PolarHBondContact O-N 3.39Å; E274-Q278 PolarHBondContact OE1-NE2 3.4Å
275	L	85.6	Confident	83	Confident	21 Å²	21	77.9 Å²	77.9	11%	0.11	40%	0.4	C	S	.	.	H	α-helix	trans	-65.2	-36.3	177.2	-71.9	169.1	0	0	0	112.8	T250 V254 L257 Q271 V272 Q278 L279	T250-L275 HydrophobicContact CG2-CD2 4.49Å; V254-L275 HydrophobicContact CG2-CB 3.7Å; L257-L275 HydrophobicContact CD1-CD1 3.45Å; L257-L275 VanDerWaalsContact CD1-CD1 3.45Å; Q271-L275 HydrophobicContact CG-CD1 4.25Å; Q271-L275 WeakPolarHBondContact O-CG 3.2Å; Q271-L275 PolarHBondContact O-N 2.92Å; V272-L275 PolarHBondContact O-N 3.43Å; L275-Q278 PolarHBondContact O-N 2.97Å; L275-L279 WeakPolarHBondContact O-CB 3.17Å; L275-L279 PolarHBondContact O-N 3.27Å
276	Q	87.1	Confident	84.1	Confident	72 Å²	72	76.7 Å²	76.7	34%	0.336	39%	0.392	S	S	.	.	H	α-helix	trans	-61.5	-45	171.3	-74.8	169.6	-10.6	0	0	111.3	V254 E258 V272 R273 E274 L279 E280	V254-Q276 HydrophobicContact CG1-CG 4.05Å; E258-Q276 PolarHBondContact OE1-NE2 3.02Å; V272-Q276 HydrophobicContact CG1-CG 4.3Å; V272-Q276 WeakPolarHBondContact O-CB 3.24Å; V272-Q276 WeakPolarHBondContact O-CG 3.22Å; V272-Q276 PolarHBondContact O-N 3.29Å; R273-Q276 PolarHBondContact O-N 3.33Å; E274-Q276 PolarHBondContact O-N 3.06Å; Q276-L279 WeakPolarHBondContact O-CB 3.09Å; Q276-L279 PolarHBondContact O-N 3.09Å; Q276-E280 WeakPolarHBondContact O-CG 3.18Å; Q276-E280 PolarHBondContact O-N 3.46Å
277	G	89.3	Confident	85.1	Confident	36 Å²	36	77 Å²	77	37%	0.371	39%	0.385	S	S	.	.	H	α-helix	trans	-64.1	-39.7	175.9	0	0	0	0	0	113.5	R273 E274 E280 A281	R273-G277 PolarHBondContact O-N 3.44Å; E274-G277 PolarHBondContact O-N 2.99Å; G277-E280 PolarHBondContact O-N 3.2Å; G277-A281 WeakPolarHBondContact O-CB 3.39Å; G277-A281 PolarHBondContact O-N 3.48Å
278	Q	89.4	Confident	86.1	Confident	87 Å²	87	80.4 Å²	80.4	41%	0.407	39%	0.389	S	S	.	.	H	α-helix	trans	-65.4	-42.4	173.9	-69.5	179.4	17.5	0	0	111.8	E274 L275 A281 L282	E274-Q278 WeakPolarHBondContact O-CG 3.5Å; E274-Q278 PolarHBondContact O-N 3.39Å; E274-Q278 PolarHBondContact OE1-NE2 3.4Å; L275-Q278 PolarHBondContact O-N 2.97Å; Q278-A281 PolarHBondContact O-N 3.1Å; Q278-L282 WeakPolarHBondContact O-CB 3.41Å; Q278-L282 WeakPolarHBondContact O-CG 3.47Å; Q278-L282 PolarHBondContact O-N 2.93Å
279	L	90.3	Very high	86.8	Confident	8 Å²	8	77.1 Å²	77.1	4%	0.042	38%	0.378	C	S	.	.	H	α-helix	trans	-61	-43.6	174.8	174.7	63.6	0	0	0	111.9	V247 T250 Q251 V254 L275 Q276 L282 R283	V247-L279 HydrophobicContact CG1-CD1 4.33Å; T250-L279 HydrophobicContact CG2-CB 3.98Å; Q251-L279 HydrophobicContact CB-CD1 4.27Å; V254-L279 HydrophobicContact CG2-CD2 4.22Å; L275-L279 WeakPolarHBondContact O-CB 3.17Å; L275-L279 PolarHBondContact O-N 3.27Å; Q276-L279 WeakPolarHBondContact O-CB 3.09Å; Q276-L279 PolarHBondContact O-N 3.09Å; L279-L282 PolarHBondContact O-N 2.92Å; L279-R283 HydrophobicContact CD1-CG 4.35Å; L279-R283 WeakPolarHBondContact O-CB 3.29Å; L279-R283 WeakPolarHBondContact O-CD 3.35Å; L279-R283 WeakPolarHBondContact O-CG 3.24Å; L279-R283 PolarHBondContact O-N 3.1Å
280	E	91.3	Very high	87.4	Confident	131 Å²	131	77.2 Å²	77.2	61%	0.612	37%	0.37	S	S	*	.	H	α-helix	trans	-62	-43.9	173	-74.9	-176	176.8	0	0	112	Q276 G277 L282 R283 A284	Q276-E280 WeakPolarHBondContact O-CG 3.18Å; Q276-E280 PolarHBondContact O-N 3.46Å; G277-E280 PolarHBondContact O-N 3.2Å; E280-L282 PolarHBondContact O-N 2.98Å; E280-R283 PolarHBondContact O-N 3.31Å; E280-A284 VanDerWaalsContact O-CB 3.3Å; E280-A284 WeakPolarHBondContact O-CB 3.35Å; E280-A284 PolarHBondContact O-N 3.03Å
281	A	90.9	Very high	87.9	Confident	48 Å²	48	75.2 Å²	75.2	40%	0.397	37%	0.365	S	S	.	.	H	α-helix	trans	-64.3	-37.6	176.6	0	0	0	0	0	112.8	G277 Q278 K285	G277-A281 WeakPolarHBondContact O-CB 3.39Å; G277-A281 PolarHBondContact O-N 3.48Å; Q278-A281 PolarHBondContact O-N 3.1Å; A281-K285 VanDerWaalsContact O-CG 3.31Å; A281-K285 WeakPolarHBondContact O-CG 3.38Å; A281-K285 PolarHBondContact O-N 2.92Å
282	L	89.8	Confident	88.1	Confident	25 Å²	25	74.5 Å²	74.5	13%	0.131	36%	0.364	C	S	.	.	H	α-helix	trans	-69.1	-45.5	174.9	-72.3	169.8	0	0	0	111.7	L243 V247 Q278 L279 E280 A284 K285 M286	L243-L282 HydrophobicContact CD2-CD2 4.3Å; V247-L282 HydrophobicContact CG2-CB 3.69Å; Q278-L282 WeakPolarHBondContact O-CB 3.41Å; Q278-L282 WeakPolarHBondContact O-CG 3.47Å; Q278-L282 PolarHBondContact O-N 2.93Å; L279-L282 PolarHBondContact O-N 2.92Å; E280-L282 PolarHBondContact O-N 2.98Å; L282-A284 VanDerWaalsContact C-N 3.31Å; L282-A284 PolarHBondContact O-N 2.86Å; L282-K285 WeakPolarHBondContact O-CB 3.13Å; L282-K285 PolarHBondContact O-N 3.03Å; L282-M286 PolarHBondContact O-N 3.12Å
283	R	90.8	Very high	88.3	Confident	107 Å²	107	77.6 Å²	77.6	40%	0.404	38%	0.377	S	S	.	.	H	α-helix	trans	-58.2	-41.9	172.9	-72.6	165.2	172.1	-175	-3.6	111.7	V247 L279 E280 M286 H287	V247-R283 HydrophobicContact CG1-CG 4.15Å; L279-R283 HydrophobicContact CD1-CG 4.35Å; L279-R283 WeakPolarHBondContact O-CB 3.29Å; L279-R283 WeakPolarHBondContact O-CD 3.35Å; L279-R283 WeakPolarHBondContact O-CG 3.24Å; L279-R283 PolarHBondContact O-N 3.1Å; E280-R283 PolarHBondContact O-N 3.31Å; R283-M286 PolarHBondContact O-N 3.48Å; R283-H287 WeakPolarHBondContact O-CB 3.37Å; R283-H287 PolarHBondContact O-N 3.37Å
284	A	91.6	Very high	88.6	Confident	47 Å²	47	77 Å²	77	39%	0.388	38%	0.379	S	S	.	.	H	α-helix	trans	-66.2	-36.8	176.8	0	0	0	0	0	112.9	E280 L282 R288	E280-A284 VanDerWaalsContact O-CB 3.3Å; E280-A284 WeakPolarHBondContact O-CB 3.35Å; E280-A284 PolarHBondContact O-N 3.03Å; L282-A284 VanDerWaalsContact C-N 3.31Å; L282-A284 PolarHBondContact O-N 2.86Å; A284-R288 VanDerWaalsContact O-CG 3.31Å; A284-R288 WeakPolarHBondContact O-CG 3.24Å; A284-R288 PolarHBondContact O-N 3.47Å
285	K	89.6	Confident	88.7	Confident	121 Å²	121	74.2 Å²	74.2	53%	0.526	37%	0.372	S	S	.	.	H	α-helix	trans	-63.8	-48.9	171	-73.3	167.5	-177.5	175.9	0	111.1	A281 L282 H287 R288 M289	A281-K285 VanDerWaalsContact O-CG 3.31Å; A281-K285 WeakPolarHBondContact O-CG 3.38Å; A281-K285 PolarHBondContact O-N 2.92Å; L282-K285 WeakPolarHBondContact O-CB 3.13Å; L282-K285 PolarHBondContact O-N 3.03Å; K285-H287 PolarHBondContact O-N 3.32Å; K285-R288 PolarHBondContact O-N 3.43Å; K285-M289 PolarHBondContact O-N 3.1Å
286	M	86.9	Confident	88.9	Confident	44 Å²	44	79.4 Å²	79.4	22%	0.217	39%	0.394	C	S	.	.	H	α-helix	trans	-57.5	-45.7	178.1	-170.3	-168.2	81.8	0	0	111.8	R244 L282 R283 R288 M289 E290	R244-M286 HydrophobicContact CG-CG 4.47Å; R244-M286 HydrophobicContact CG-SD 3.94Å; L282-M286 PolarHBondContact O-N 3.12Å; R283-M286 PolarHBondContact O-N 3.48Å; M286-R288 PolarHBondContact O-N 3.45Å; M286-M289 WeakPolarHBondContact O-CA 3.48Å; M286-M289 VanDerWaalsContact O-CB 3.23Å; M286-M289 WeakPolarHBondContact O-CB 3.45Å; M286-M289 PolarHBondContact O-N 2.64Å; M286-M289 VanDerWaalsContact O-N 3.14Å; M286-E290 WeakPolarHBondContact O-CG 3.41Å; M286-E290 PolarHBondContact O-N 3.02Å
287	H	88.1	Confident	88.8	Confident	113 Å²	113	79.2 Å²	79.2	52%	0.523	40%	0.4	S	S	.	.	H	α-helix	trans	-66.6	-34.9	-179.4	-175.9	56.7	0	0	0	113.6	R283 K285 T291	R283-H287 WeakPolarHBondContact O-CB 3.37Å; R283-H287 PolarHBondContact O-N 3.37Å; K285-H287 PolarHBondContact O-N 3.32Å; H287-T291 WeakPolarHBondContact O-CB 3.38Å; H287-T291 PolarHBondContact O-N 3.29Å; H287-T291 PolarHBondContact O-OG1 3.23Å
288	R	89.2	Confident	89	Confident	193 Å²	193	80.8 Å²	80.8	73%	0.728	40%	0.398	S	S	*	.	H	α-helix	trans	-64.6	-42.6	170.8	-70.5	172.1	-173.3	-169.2	3	111.1	A284 K285 M286 T291 L292	A284-R288 VanDerWaalsContact O-CG 3.31Å; A284-R288 WeakPolarHBondContact O-CG 3.24Å; A284-R288 PolarHBondContact O-N 3.47Å; K285-R288 PolarHBondContact O-N 3.43Å; M286-R288 PolarHBondContact O-N 3.45Å; R288-T291 PolarHBondContact O-N 3.46Å; R288-L292 PolarHBondContact O-N 2.94Å
289	M	85.4	Confident	89	Confident	29 Å²	29	80.9 Å²	80.9	14%	0.143	40%	0.404	C	S	.	.	H	α-helix	trans	-58.2	-52.6	175.5	-102.4	-99.4	40.3	0	0	112.3	Y236 I240 K285 M286 T291 L292 E293	Y236-M289 HydrophobicContact CD1-CE 3.71Å; Y236-M289 HydrophobicContact CD1-SD 3.85Å; Y236-M289 HydrophobicContact CE1-CE 3.46Å; Y236-M289 VanDerWaalsContact CE1-CE 3.46Å; Y236-M289 HydrophobicContact CE1-SD 3.5Å; Y236-M289 WeakPolarHBondContact CE1-SD 3.3Å; I240-M289 HydrophobicContact CD1-CE 3.59Å; I240-M289 HydrophobicContact CD1-SD 4.19Å; I240-M289 HydrophobicContact CG1-CE 3.61Å; I240-M289 HydrophobicContact CG1-SD 3.51Å; I240-M289 VanDerWaalsContact CG1-SD 3.51Å; K285-M289 PolarHBondContact O-N 3.1Å; M286-M289 WeakPolarHBondContact O-CA 3.48Å; M286-M289 VanDerWaalsContact O-CB 3.23Å; M286-M289 WeakPolarHBondContact O-CB 3.45Å; M286-M289 PolarHBondContact O-N 2.64Å; M286-M289 VanDerWaalsContact O-N 3.14Å; M289-T291 VanDerWaalsContact C-N 3.28Å; M289-T291 PolarHBondContact O-N 2.71Å; M289-L292 WeakPolarHBondContact O-CB 3.48Å; M289-L292 PolarHBondContact O-N 3.49Å; M289-L292 VanDerWaalsContact O-N 3.16Å; M289-E293 PolarHBondContact O-N 3.49Å
290	E	86.4	Confident	89	Confident	37 Å²	37	85.6 Å²	85.6	17%	0.173	43%	0.425	C	S	.	.	H	α-helix	trans	-65.6	-29.4	178.8	-67.8	-179.9	162.2	0	0	113.1	R244 M286 K294	R244-E290 IonicContact CZ-OE1 2.77Å; R244-E290 IonicContact NE-OE1 2.71Å; R244-E290 IonicContact NH2-OE1 2.87Å; R244-E290 PolarHBondContact NH2-OE1 2.89Å; M286-E290 WeakPolarHBondContact O-CG 3.41Å; M286-E290 PolarHBondContact O-N 3.02Å; E290-K294 VanDerWaalsContact O-CD 3.29Å; E290-K294 WeakPolarHBondContact O-CD 3.47Å; E290-K294 VanDerWaalsContact O-CG 3.23Å; E290-K294 WeakPolarHBondContact O-CG 3.41Å; E290-K294 PolarHBondContact O-N 2.98Å
291	T	89.4	Confident	89.1	Confident	72 Å²	72	85.7 Å²	85.7	44%	0.442	42%	0.419	S	S	.	.	H	α-helix	trans	-69.7	-41.5	173	-59.6	0	0	0	0	111.2	H287 R288 M289 S295	H287-T291 WeakPolarHBondContact O-CB 3.38Å; H287-T291 PolarHBondContact O-N 3.29Å; H287-T291 PolarHBondContact O-OG1 3.23Å; R288-T291 PolarHBondContact O-N 3.46Å; M289-T291 VanDerWaalsContact C-N 3.28Å; M289-T291 PolarHBondContact O-N 2.71Å; T291-S295 PolarHBondContact O-N 3.41Å; T291-S295 VanDerWaalsContact O-N 3.09Å
292	L	86.9	Confident	89.3	Confident	92 Å²	92	87.6 Å²	87.6	48%	0.482	42%	0.42	S	S	.	.	H	α-helix	trans	-65.6	-46.3	176.3	-173.9	64.8	0	0	0	111.5	R288 M289 K294 S295 F296	R288-L292 PolarHBondContact O-N 2.94Å; M289-L292 WeakPolarHBondContact O-CB 3.48Å; M289-L292 PolarHBondContact O-N 3.49Å; M289-L292 VanDerWaalsContact O-N 3.16Å; L292-K294 VanDerWaalsContact C-N 3.32Å; L292-K294 PolarHBondContact O-N 3.05Å; L292-S295 PolarHBondContact O-N 2.65Å; L292-S295 VanDerWaalsContact O-N 3.08Å; L292-S295 PolarHBondContact O-OG 3.44Å; L292-F296 PolarHBondContact O-N 2.6Å
293	E	85.4	Confident	89.5	Confident	87 Å²	87	92 Å²	92	41%	0.407	44%	0.443	S	S	.	.	H	α-helix	trans	-55.7	-43.7	176.4	-177.6	-179.2	-157.1	0	0	112.4	M289 F296 S297	M289-E293 PolarHBondContact O-N 3.49Å; E293-F296 PolarHBondContact O-N 3.22Å; E293-S297 WeakPolarHBondContact O-CB 3.18Å; E293-S297 PolarHBondContact O-N 3.21Å; E293-S297 PolarHBondContact O-OG 3.15Å
294	K	89.3	Confident	89.6	Confident	132 Å²	132	92 Å²	92	57%	0.574	45%	0.448	S	S	*	.	H	α-helix	trans	-62.7	-44.8	173.9	-73.2	163.8	-170.6	162.9	0	111.9	E290 L292 S297 E298	E290-K294 VanDerWaalsContact O-CD 3.29Å; E290-K294 WeakPolarHBondContact O-CD 3.47Å; E290-K294 VanDerWaalsContact O-CG 3.23Å; E290-K294 WeakPolarHBondContact O-CG 3.41Å; E290-K294 PolarHBondContact O-N 2.98Å; L292-K294 VanDerWaalsContact C-N 3.32Å; L292-K294 PolarHBondContact O-N 3.05Å; K294-S297 PolarHBondContact O-N 3.49Å; K294-E298 WeakPolarHBondContact O-CB 3.21Å; K294-E298 PolarHBondContact O-N 2.97Å
295	S	90.1	Very high	89.7	Confident	57 Å²	57	94.1 Å²	94.1	40%	0.399	45%	0.449	S	S	.	.	H	α-helix	trans	-63.3	-42.2	178.5	71.4	0	0	0	0	112.4	T291 L292 E298 T299	T291-S295 PolarHBondContact O-N 3.41Å; T291-S295 VanDerWaalsContact O-N 3.09Å; L292-S295 PolarHBondContact O-N 2.65Å; L292-S295 VanDerWaalsContact O-N 3.08Å; L292-S295 PolarHBondContact O-OG 3.44Å; S295-E298 PolarHBondContact O-N 2.68Å; S295-T299 PolarHBondContact O-N 3.12Å; S295-T299 PolarHBondContact O-OG1 2.92Å; S295-T299 VanDerWaalsContact O-OG1 3.09Å
296	F	88.7	Confident	90	Very high	130 Å²	130	93.4 Å²	93.4	57%	0.57	45%	0.448	S	S	*	.	H	α-helix	trans	-66	-41.9	176.9	-175.5	-98.8	0	0	0	112.3	L292 E293 E298 T299 K300	L292-F296 PolarHBondContact O-N 2.6Å; E293-F296 PolarHBondContact O-N 3.22Å; F296-E298 VanDerWaalsContact C-N 3.32Å; F296-E298 PolarHBondContact O-N 3.4Å; F296-T299 PolarHBondContact O-N 2.87Å; F296-K300 WeakPolarHBondContact O-CB 3.38Å; F296-K300 PolarHBondContact O-N 2.82Å
297	S	85.9	Confident	90.3	Very high	67 Å²	67	98.7 Å²	98.7	47%	0.469	47%	0.47	S	S	.	.	H	α-helix	trans	-61.1	-40.7	175.1	-58.3	0	0	0	0	112	E293 K294 R301	E293-S297 WeakPolarHBondContact O-CB 3.18Å; E293-S297 PolarHBondContact O-N 3.21Å; E293-S297 PolarHBondContact O-OG 3.15Å; K294-S297 PolarHBondContact O-N 3.49Å; S297-R301 WeakPolarHBondContact O-CB 3.3Å; S297-R301 PolarHBondContact O-N 2.82Å
298	E	92.7	Very high	90.6	Very high	70 Å²	70	97.1 Å²	97.1	33%	0.327	47%	0.468	S	S	.	.	H	α-helix	trans	-69.4	-44.1	177.4	-179.5	56.7	-160.2	0	0	112	K294 S295 F296 K300 R301 Q302	K294-E298 WeakPolarHBondContact O-CB 3.21Å; K294-E298 PolarHBondContact O-N 2.97Å; S295-E298 PolarHBondContact O-N 2.68Å; F296-E298 VanDerWaalsContact C-N 3.32Å; F296-E298 PolarHBondContact O-N 3.4Å; E298-K300 VanDerWaalsContact C-N 3.34Å; E298-K300 PolarHBondContact O-N 3.02Å; E298-R301 WeakPolarHBondContact O-CB 3.34Å; E298-R301 PolarHBondContact O-N 1.93Å; E298-R301 IonicContact OE1-CZ 2.7Å; E298-R301 IonicContact OE1-NE 3.26Å; E298-R301 IonicContact OE1-NH2 2.88Å; E298-R301 PolarHBondContact OE1-NH2 3.26Å; E298-R301 IonicContact OE2-CZ 3.42Å; E298-R301 VanDerWaalsContact OE2-CZ 3.3Å; E298-R301 IonicContact OE2-NE 2.99Å; E298-R301 PolarHBondContact OE2-NE 2.83Å; E298-R301 IonicContact OE2-NH2 3.3Å; E298-R301 PolarHBondContact OE2-NH2 2.84Å; E298-Q302 WeakPolarHBondContact O-CG 3.44Å; E298-Q302 PolarHBondContact O-N 2.86Å; E298-Q302 PolarHBondContact OE1-NE2 2.78Å
299	T	90.9	Very high	90.9	Very high	88 Å²	88	92.6 Å²	92.6	54%	0.54	46%	0.455	S	S	.	.	H	α-helix	trans	-62.3	-40.5	173.7	-57.8	0	0	0	0	111.9	S295 F296 Q302 L303	S295-T299 PolarHBondContact O-N 3.12Å; S295-T299 PolarHBondContact O-OG1 2.92Å; S295-T299 VanDerWaalsContact O-OG1 3.09Å; F296-T299 PolarHBondContact O-N 2.87Å; T299-Q302 PolarHBondContact O-N 2.9Å; T299-L303 WeakPolarHBondContact O-CB 3.47Å; T299-L303 PolarHBondContact O-N 3.4Å
300	K	90	Very high	91.4	Very high	108 Å²	108	97.6 Å²	97.6	47%	0.47	48%	0.479	S	S	.	.	H	α-helix	trans	-59.9	-48	174.5	178.2	-179.6	170.1	-178.6	0	111.1	F296 E298 Q302 L303 E304	F296-K300 WeakPolarHBondContact O-CB 3.38Å; F296-K300 PolarHBondContact O-N 2.82Å; E298-K300 VanDerWaalsContact C-N 3.34Å; E298-K300 PolarHBondContact O-N 3.02Å; K300-Q302 VanDerWaalsContact C-N 3.33Å; K300-Q302 PolarHBondContact O-N 2.73Å; K300-L303 PolarHBondContact O-N 3.47Å; K300-E304 VanDerWaalsContact CE-CD 3.42Å; K300-E304 WeakPolarHBondContact CE-OE1 3.31Å; K300-E304 HydrophobicContact CG-CG 4.45Å; K300-E304 IonicContact NZ-OE1 2.77Å; K300-E304 WeakPolarHBondContact O-CG 3.47Å; K300-E304 PolarHBondContact O-N 3.25Å
301	R	92.7	Very high	91.8	Very high	133 Å²	133	100.8 Å²	100.8	50%	0.502	49%	0.493	S	S	.	.	H	α-helix	trans	-56.7	-45.7	177.7	-175	175	74.9	92.7	-2.9	111.7	S297 E298 E304 E305	S297-R301 WeakPolarHBondContact O-CB 3.3Å; S297-R301 PolarHBondContact O-N 2.82Å; E298-R301 WeakPolarHBondContact O-CB 3.34Å; E298-R301 PolarHBondContact O-N 1.93Å; E298-R301 IonicContact OE1-CZ 2.7Å; E298-R301 IonicContact OE1-NE 3.26Å; E298-R301 IonicContact OE1-NH2 2.88Å; E298-R301 PolarHBondContact OE1-NH2 3.26Å; E298-R301 IonicContact OE2-CZ 3.42Å; E298-R301 VanDerWaalsContact OE2-CZ 3.3Å; E298-R301 IonicContact OE2-NE 2.99Å; E298-R301 PolarHBondContact OE2-NE 2.83Å; E298-R301 IonicContact OE2-NH2 3.3Å; E298-R301 PolarHBondContact OE2-NH2 2.84Å; R301-E304 PolarHBondContact O-N 2.82Å; R301-E305 WeakPolarHBondContact O-CB 3.29Å; R301-E305 PolarHBondContact O-N 3.27Å
302	Q	94.6	Very high	92.1	Very high	87 Å²	87	104 Å²	104	41%	0.407	50%	0.503	S	S	.	.	H	α-helix	trans	-65	-38	177.7	-68.3	171.7	13.8	0	0	112.6	E298 T299 K300 Q306	E298-Q302 WeakPolarHBondContact O-CG 3.44Å; E298-Q302 PolarHBondContact O-N 2.86Å; E298-Q302 PolarHBondContact OE1-NE2 2.78Å; T299-Q302 PolarHBondContact O-N 2.9Å; K300-Q302 VanDerWaalsContact C-N 3.33Å; K300-Q302 PolarHBondContact O-N 2.73Å; Q302-Q306 WeakPolarHBondContact O-CB 3.19Å; Q302-Q306 VanDerWaalsContact O-CG 3.28Å; Q302-Q306 WeakPolarHBondContact O-CG 3.39Å; Q302-Q306 PolarHBondContact O-N 2.9Å
303	L	94.5	Very high	92.6	Very high	118 Å²	118	105.1 Å²	105.1	62%	0.618	51%	0.506	S	S	*	.	H	α-helix	trans	-69.2	-40.1	176.4	-177.2	64.1	0	0	0	112.3	T299 K300 K307	T299-L303 WeakPolarHBondContact O-CB 3.47Å; T299-L303 PolarHBondContact O-N 3.4Å; K300-L303 PolarHBondContact O-N 3.47Å; L303-K307 WeakPolarHBondContact O-CB 3.44Å; L303-K307 PolarHBondContact O-N 3.24Å
304	E	92.7	Very high	93.2	Very high	107 Å²	107	104.8 Å²	104.8	50%	0.5	51%	0.507	S	S	.	.	H	α-helix	trans	-64.3	-44	174.4	-73	176.2	159.2	0	0	110.9	K300 R301 K307 T308	K300-E304 VanDerWaalsContact CE-CD 3.42Å; K300-E304 WeakPolarHBondContact CE-OE1 3.31Å; K300-E304 HydrophobicContact CG-CG 4.45Å; K300-E304 IonicContact NZ-OE1 2.77Å; K300-E304 WeakPolarHBondContact O-CG 3.47Å; K300-E304 PolarHBondContact O-N 3.25Å; R301-E304 PolarHBondContact O-N 2.82Å; E304-K307 PolarHBondContact O-N 2.94Å; E304-T308 PolarHBondContact O-N 2.96Å; E304-T308 PolarHBondContact O-OG1 3.12Å
305	E	95.2	Very high	93.5	Very high	91 Å²	91	103.4 Å²	103.4	43%	0.425	50%	0.504	S	S	.	.	H	α-helix	trans	-65.4	-42.9	177.2	-178.2	170.5	-174.2	0	0	112.9	R301 K307 T308 Q309	R301-E305 WeakPolarHBondContact O-CB 3.29Å; R301-E305 PolarHBondContact O-N 3.27Å; E305-K307 VanDerWaalsContact C-N 3.31Å; E305-K307 PolarHBondContact O-N 3.08Å; E305-T308 WeakPolarHBondContact CA-OG1 2.9Å; E305-T308 PolarHBondContact O-N 3.34Å; E305-T308 PolarHBondContact O-OG1 3.24Å; E305-Q309 WeakPolarHBondContact O-CB 3.34Å; E305-Q309 VanDerWaalsContact O-CG 3.28Å; E305-Q309 WeakPolarHBondContact O-CG 3.37Å; E305-Q309 PolarHBondContact O-N 3.4Å; E305-Q309 PolarHBondContact OE1-NE2 2.96Å
306	Q	94.3	Very high	93.9	Very high	106 Å²	106	107.5 Å²	107.5	50%	0.495	51%	0.514	S	S	.	.	H	α-helix	trans	-61.3	-39.9	173	-76.9	176.7	10.7	0	0	111.7	Q302 Q309 Q310	Q302-Q306 WeakPolarHBondContact O-CB 3.19Å; Q302-Q306 VanDerWaalsContact O-CG 3.28Å; Q302-Q306 WeakPolarHBondContact O-CG 3.39Å; Q302-Q306 PolarHBondContact O-N 2.9Å; Q306-Q309 PolarHBondContact O-N 2.83Å; Q306-Q310 WeakPolarHBondContact O-CB 3.07Å; Q306-Q310 VanDerWaalsContact O-CG 3.3Å; Q306-Q310 WeakPolarHBondContact O-CG 3.14Å; Q306-Q310 PolarHBondContact O-N 3.12Å
307	K	94.1	Very high	94.3	Very high	156 Å²	156	106.4 Å²	106.4	68%	0.678	51%	0.509	S	S	*	.	H	α-helix	trans	-66.1	-39.7	177.9	-173.6	178.3	-179.9	-179.6	0	112	L303 E304 E305 Q311	L303-K307 WeakPolarHBondContact O-CB 3.44Å; L303-K307 PolarHBondContact O-N 3.24Å; E304-K307 PolarHBondContact O-N 2.94Å; E305-K307 VanDerWaalsContact C-N 3.31Å; E305-K307 PolarHBondContact O-N 3.08Å; K307-Q311 WeakPolarHBondContact O-CB 3.24Å; K307-Q311 PolarHBondContact O-N 2.89Å; K307-Q311 VanDerWaalsContact O-N 3.13Å
308	T	94.3	Very high	94.9	Very high	79 Å²	79	107.9 Å²	107.9	49%	0.485	51%	0.509	S	S	.	.	H	α-helix	trans	-68.3	-42.6	174.4	49.9	0	0	0	0	111.8	E304 E305 Q310 Q311 E312	E304-T308 PolarHBondContact O-N 2.96Å; E304-T308 PolarHBondContact O-OG1 3.12Å; E305-T308 WeakPolarHBondContact CA-OG1 2.9Å; E305-T308 PolarHBondContact O-N 3.34Å; E305-T308 PolarHBondContact O-OG1 3.24Å; T308-Q310 PolarHBondContact O-N 3.23Å; T308-Q311 PolarHBondContact O-N 2.71Å; T308-E312 WeakPolarHBondContact O-CG 3.24Å; T308-E312 PolarHBondContact O-N 3.04Å
309	Q	95.9	Very high	95.1	Very high	98 Å²	98	109.7 Å²	109.7	46%	0.458	52%	0.52	S	S	.	.	H	α-helix	trans	-61.1	-43.6	176.9	-72.1	172.7	8.8	0	0	112.2	E305 Q306 Q311 E312 E313	E305-Q309 WeakPolarHBondContact O-CB 3.34Å; E305-Q309 VanDerWaalsContact O-CG 3.28Å; E305-Q309 WeakPolarHBondContact O-CG 3.37Å; E305-Q309 PolarHBondContact O-N 3.4Å; E305-Q309 PolarHBondContact OE1-NE2 2.96Å; Q306-Q309 PolarHBondContact O-N 2.83Å; Q309-Q311 VanDerWaalsContact C-N 3.34Å; Q309-Q311 PolarHBondContact O-N 3.35Å; Q309-E312 PolarHBondContact O-N 3.19Å; Q309-E313 PolarHBondContact O-N 3.39Å
310	Q	95.1	Very high	95.4	Very high	135 Å²	135	111.5 Å²	111.5	63%	0.631	52%	0.522	S	S	*	.	H	α-helix	trans	-62.1	-40.1	174.8	-74.1	175.1	8.8	0	0	112.4	Q306 T308 L314	Q306-Q310 WeakPolarHBondContact O-CB 3.07Å; Q306-Q310 VanDerWaalsContact O-CG 3.3Å; Q306-Q310 WeakPolarHBondContact O-CG 3.14Å; Q306-Q310 PolarHBondContact O-N 3.12Å; T308-Q310 PolarHBondContact O-N 3.23Å; Q310-L314 WeakPolarHBondContact O-CB 3.47Å; Q310-L314 PolarHBondContact O-N 3.04Å
311	Q	95.1	Very high	95.7	Very high	104 Å²	104	112.4 Å²	112.4	49%	0.486	53%	0.528	S	S	.	.	H	α-helix	trans	-67	-42.1	176.3	-172.4	64.4	38.1	0	0	111.7	K307 T308 Q309 L314 M315	K307-Q311 WeakPolarHBondContact O-CB 3.24Å; K307-Q311 PolarHBondContact O-N 2.89Å; K307-Q311 VanDerWaalsContact O-N 3.13Å; T308-Q311 PolarHBondContact O-N 2.71Å; Q309-Q311 VanDerWaalsContact C-N 3.34Å; Q309-Q311 PolarHBondContact O-N 3.35Å; Q311-L314 PolarHBondContact O-N 2.96Å; Q311-M315 WeakPolarHBondContact O-CB 3.36Å; Q311-M315 VanDerWaalsContact O-CG 3.24Å; Q311-M315 WeakPolarHBondContact O-CG 3.36Å; Q311-M315 PolarHBondContact O-N 2.56Å
312	E	96.3	Very high	95.9	Very high	138 Å²	138	108.8 Å²	108.8	65%	0.645	53%	0.527	S	S	*	.	H	α-helix	trans	-64.7	-42.7	176.4	-74.7	-179.5	-176.8	0	0	112.1	T308 Q309 L314 M315 K316	T308-E312 WeakPolarHBondContact O-CG 3.24Å; T308-E312 PolarHBondContact O-N 3.04Å; Q309-E312 PolarHBondContact O-N 3.19Å; E312-L314 VanDerWaalsContact C-N 3.34Å; E312-L314 PolarHBondContact O-N 2.88Å; E312-M315 PolarHBondContact O-N 2.88Å; E312-K316 VanDerWaalsContact O-CB 3.26Å; E312-K316 WeakPolarHBondContact O-CB 3.48Å; E312-K316 PolarHBondContact O-N 2.91Å
313	E	97	Very high	96.1	Very high	116 Å²	116	109 Å²	109	54%	0.542	53%	0.53	S	S	.	.	H	α-helix	trans	-61.1	-40.8	173.3	-82.9	-155.9	-171.8	0	0	112.9	Q309 K316 K317	Q309-E313 PolarHBondContact O-N 3.39Å; E313-K316 PolarHBondContact O-N 2.96Å; E313-K317 WeakPolarHBondContact O-CG 3.36Å; E313-K317 PolarHBondContact O-N 2.9Å; E313-K317 IonicContact OE2-NZ 3.64Å; E313-K317 PolarHBondContact OE2-NZ 2.92Å
314	L	97.6	Very high	96.2	Very high	80 Å²	80	109.4 Å²	109.4	42%	0.419	53%	0.529	S	S	.	.	H	α-helix	trans	-64.8	-48.6	177.6	178.7	61.9	0	0	0	111	Q310 Q311 E312 K316 K317 Q318	Q310-L314 WeakPolarHBondContact O-CB 3.47Å; Q310-L314 PolarHBondContact O-N 3.04Å; Q311-L314 PolarHBondContact O-N 2.96Å; E312-L314 VanDerWaalsContact C-N 3.34Å; E312-L314 PolarHBondContact O-N 2.88Å; L314-K316 VanDerWaalsContact C-N 3.28Å; L314-K316 PolarHBondContact O-N 2.87Å; L314-K317 PolarHBondContact O-N 2.92Å; L314-Q318 WeakPolarHBondContact O-CG 3.44Å; L314-Q318 PolarHBondContact O-N 2.98Å
315	M	96.6	Very high	96.4	Very high	104 Å²	104	109.3 Å²	109.3	51%	0.512	53%	0.528	S	S	.	.	H	α-helix	trans	-61	-37.8	176.4	-68.8	-63	-58.9	0	0	111.8	Q311 E312 L319	Q311-M315 WeakPolarHBondContact O-CB 3.36Å; Q311-M315 VanDerWaalsContact O-CG 3.24Å; Q311-M315 WeakPolarHBondContact O-CG 3.36Å; Q311-M315 PolarHBondContact O-N 2.56Å; E312-M315 PolarHBondContact O-N 2.88Å; M315-L319 WeakPolarHBondContact O-CB 3.25Å; M315-L319 PolarHBondContact O-N 3.26Å
316	K	97.4	Very high	96.5	Very high	142 Å²	142	110.5 Å²	110.5	62%	0.617	53%	0.534	S	S	*	.	H	α-helix	trans	-65.4	-44.8	176.1	-176.4	-179	175.1	-173.9	0	112.1	E312 E313 L314 L319 E320	E312-K316 VanDerWaalsContact O-CB 3.26Å; E312-K316 WeakPolarHBondContact O-CB 3.48Å; E312-K316 PolarHBondContact O-N 2.91Å; E313-K316 PolarHBondContact O-N 2.96Å; L314-K316 VanDerWaalsContact C-N 3.28Å; L314-K316 PolarHBondContact O-N 2.87Å; K316-L319 PolarHBondContact O-N 2.77Å; K316-E320 WeakPolarHBondContact O-CB 3.34Å; K316-E320 PolarHBondContact O-N 3Å
317	K	97.6	Very high	96.7	Very high	107 Å²	107	111.7 Å²	111.7	47%	0.465	54%	0.538	S	S	.	.	H	α-helix	trans	-60.9	-46.5	175.7	-73.6	162.3	-172.9	151.6	0	111.1	E313 L314 L319 E320 E321	E313-K317 WeakPolarHBondContact O-CG 3.36Å; E313-K317 PolarHBondContact O-N 2.9Å; E313-K317 IonicContact OE2-NZ 3.64Å; E313-K317 PolarHBondContact OE2-NZ 2.92Å; L314-K317 PolarHBondContact O-N 2.92Å; K317-L319 VanDerWaalsContact C-N 3.32Å; K317-L319 PolarHBondContact O-N 2.86Å; K317-E320 PolarHBondContact O-N 3.17Å; K317-E321 WeakPolarHBondContact O-CB 3.03Å; K317-E321 WeakPolarHBondContact O-CG 3.44Å; K317-E321 PolarHBondContact O-N 3.36Å
318	Q	97.7	Very high	96.8	Very high	99 Å²	99	108.8 Å²	108.8	46%	0.463	53%	0.525	S	S	.	.	H	α-helix	trans	-59.9	-39.2	175.8	-71.6	176.6	-10	0	0	112.9	L314 A322	L314-Q318 WeakPolarHBondContact O-CG 3.44Å; L314-Q318 PolarHBondContact O-N 2.98Å; Q318-A322 VanDerWaalsContact O-CB 3.3Å; Q318-A322 WeakPolarHBondContact O-CB 3.32Å; Q318-A322 PolarHBondContact O-N 3.06Å
319	L	97.1	Very high	97	Very high	107 Å²	107	108.4 Å²	108.4	56%	0.56	52%	0.523	S	S	*	.	H	α-helix	trans	-67.6	-41.2	175.5	179.9	61.6	0	0	0	112.1	M315 K316 K317 A322 L323	M315-L319 WeakPolarHBondContact O-CB 3.25Å; M315-L319 PolarHBondContact O-N 3.26Å; K316-L319 PolarHBondContact O-N 2.77Å; K317-L319 VanDerWaalsContact C-N 3.32Å; K317-L319 PolarHBondContact O-N 2.86Å; L319-A322 PolarHBondContact O-N 3.45Å; L319-L323 HydrophobicContact CD1-CD1 4.25Å; L319-L323 HydrophobicContact CD1-CG 4.32Å; L319-L323 HydrophobicContact CG-CD1 4.07Å; L319-L323 WeakPolarHBondContact O-CB 3.06Å; L319-L323 VanDerWaalsContact O-CG 3.26Å; L319-L323 WeakPolarHBondContact O-CG 3.38Å; L319-L323 PolarHBondContact O-N 2.92Å
320	E	97.2	Very high	97.1	Very high	127 Å²	127	108.4 Å²	108.4	59%	0.593	52%	0.524	S	S	*	.	H	α-helix	trans	-68.2	-40.9	179.2	-169.8	157.3	-158	0	0	111.9	K316 K317 L323 Q324	K316-E320 WeakPolarHBondContact O-CB 3.34Å; K316-E320 PolarHBondContact O-N 3Å; K317-E320 PolarHBondContact O-N 3.17Å; E320-L323 PolarHBondContact O-N 2.86Å; E320-Q324 WeakPolarHBondContact O-CB 3.3Å; E320-Q324 PolarHBondContact O-N 3.27Å
321	E	97.5	Very high	97.2	Very high	126 Å²	126	105.9 Å²	105.9	59%	0.589	52%	0.515	S	S	*	.	H	α-helix	trans	-60	-46.5	170.4	-72.8	170.9	-171.7	0	0	111.8	K317 L323 Q324 E325	K317-E321 WeakPolarHBondContact O-CB 3.03Å; K317-E321 WeakPolarHBondContact O-CG 3.44Å; K317-E321 PolarHBondContact O-N 3.36Å; E321-L323 PolarHBondContact O-N 3.23Å; E321-Q324 PolarHBondContact O-N 2.92Å; E321-E325 PolarHBondContact O-N 3.11Å
322	A	97.4	Very high	97.3	Very high	57 Å²	57	107.3 Å²	107.3	47%	0.471	52%	0.522	S	S	.	.	H	α-helix	trans	-64.2	-40	178.5	0	0	0	0	0	112.9	Q318 L319 E325 Q326	Q318-A322 VanDerWaalsContact O-CB 3.3Å; Q318-A322 WeakPolarHBondContact O-CB 3.32Å; Q318-A322 PolarHBondContact O-N 3.06Å; L319-A322 PolarHBondContact O-N 3.45Å; A322-E325 PolarHBondContact O-N 2.92Å; A322-Q326 WeakPolarHBondContact O-CB 3.24Å; A322-Q326 PolarHBondContact O-N 2.66Å
323	L	97.6	Very high	97.3	Very high	93 Å²	93	106 Å²	106	49%	0.487	52%	0.519	S	S	.	.	H	α-helix	trans	-66.7	-38.1	174.3	-73.6	169.2	0	0	0	111.8	L319 E320 E321 K327	L319-L323 HydrophobicContact CD1-CD1 4.25Å; L319-L323 HydrophobicContact CD1-CG 4.32Å; L319-L323 HydrophobicContact CG-CD1 4.07Å; L319-L323 WeakPolarHBondContact O-CB 3.06Å; L319-L323 VanDerWaalsContact O-CG 3.26Å; L319-L323 WeakPolarHBondContact O-CG 3.38Å; L319-L323 PolarHBondContact O-N 2.92Å; E320-L323 PolarHBondContact O-N 2.86Å; E321-L323 PolarHBondContact O-N 3.23Å; L323-K327 WeakPolarHBondContact O-CB 3.44Å; L323-K327 PolarHBondContact O-N 2.63Å
324	Q	97.3	Very high	97.4	Very high	126 Å²	126	102.1 Å²	102.1	59%	0.589	51%	0.506	S	S	*	.	H	α-helix	trans	-65.6	-40.8	175.1	-169.9	177.5	8.5	0	0	111.5	E320 E321 K327 K328	E320-Q324 WeakPolarHBondContact O-CB 3.3Å; E320-Q324 PolarHBondContact O-N 3.27Å; E321-Q324 PolarHBondContact O-N 2.92Å; Q324-K327 PolarHBondContact O-N 3.49Å; Q324-K328 WeakPolarHBondContact O-CG 3.22Å; Q324-K328 PolarHBondContact O-N 3.31Å
325	E	97.1	Very high	97.3	Very high	104 Å²	104	104.5 Å²	104.5	49%	0.486	52%	0.519	S	S	.	.	H	α-helix	trans	-66.5	-45.4	176.1	-159.9	65.2	-165	0	0	111.7	E321 A322 K327 K328 V329	E321-E325 PolarHBondContact O-N 3.11Å; A322-E325 PolarHBondContact O-N 2.92Å; E325-K327 PolarHBondContact O-N 3.48Å; E325-K328 WeakPolarHBondContact O-CB 3.44Å; E325-K328 PolarHBondContact O-N 3.28Å; E325-K328 VanDerWaalsContact O-N 3.15Å; E325-K328 WeakPolarHBondContact OE2-CD 3.36Å; E325-K328 WeakPolarHBondContact OE2-CE 3.17Å; E325-K328 IonicContact OE2-NZ 3.84Å; E325-K328 PolarHBondContact OE2-NZ 2.87Å; E325-V329 PolarHBondContact O-N 2.98Å
326	Q	96.6	Very high	97.3	Very high	116 Å²	116	102.4 Å²	102.4	54%	0.542	52%	0.515	S	S	.	.	H	α-helix	trans	-56.4	-39.7	174.5	-172.2	-177.2	19.7	0	0	111.5	A322 V329 I330	A322-Q326 WeakPolarHBondContact O-CB 3.24Å; A322-Q326 PolarHBondContact O-N 2.66Å; Q326-V329 PolarHBondContact O-N 3.45Å; Q326-I330 HydrophobicContact CG-CD1 4.19Å; Q326-I330 WeakPolarHBondContact O-CG1 3.47Å; Q326-I330 PolarHBondContact O-N 2.87Å; Q326-I330 VanDerWaalsContact O-N 3.12Å
327	K	97.9	Very high	97.3	Very high	131 Å²	131	102.8 Å²	102.8	57%	0.57	51%	0.512	S	S	*	.	H	α-helix	trans	-63.8	-44.5	177	-173.1	-178.4	174.2	-174.7	0	112.5	L323 Q324 E325 V329 I330 D331	L323-K327 WeakPolarHBondContact O-CB 3.44Å; L323-K327 PolarHBondContact O-N 2.63Å; Q324-K327 PolarHBondContact O-N 3.49Å; E325-K327 PolarHBondContact O-N 3.48Å; K327-V329 VanDerWaalsContact C-N 3.28Å; K327-V329 PolarHBondContact O-N 3.49Å; K327-I330 WeakPolarHBondContact O-CB 3.46Å; K327-I330 PolarHBondContact O-N 2.92Å; K327-I330 VanDerWaalsContact O-N 3.11Å; K327-D331 PolarHBondContact O-N 3.38Å
328	K	97.9	Very high	97.3	Very high	96 Å²	96	103.2 Å²	103.2	42%	0.417	51%	0.514	S	S	.	.	H	α-helix	trans	-54.8	-46.7	176.3	-64.5	170.1	-165.4	167.9	0	111.1	Q324 E325 I330 D331 E332	Q324-K328 WeakPolarHBondContact O-CG 3.22Å; Q324-K328 PolarHBondContact O-N 3.31Å; E325-K328 WeakPolarHBondContact O-CB 3.44Å; E325-K328 PolarHBondContact O-N 3.28Å; E325-K328 VanDerWaalsContact O-N 3.15Å; E325-K328 WeakPolarHBondContact OE2-CD 3.36Å; E325-K328 WeakPolarHBondContact OE2-CE 3.17Å; E325-K328 IonicContact OE2-NZ 3.84Å; E325-K328 PolarHBondContact OE2-NZ 2.87Å; K328-I330 VanDerWaalsContact C-N 3.32Å; K328-I330 PolarHBondContact O-N 3.47Å; K328-D331 PolarHBondContact O-N 3.06Å; K328-E332 WeakPolarHBondContact O-CG 3.46Å; K328-E332 PolarHBondContact O-N 2.85Å
329	V	97.5	Very high	97.3	Very high	71 Å²	71	99.8 Å²	99.8	43%	0.43	51%	0.506	S	S	.	.	H	α-helix	trans	-62.2	-38.5	179	177.1	0	0	0	0	111.6	E325 Q326 K327 L333	E325-V329 PolarHBondContact O-N 2.98Å; Q326-V329 PolarHBondContact O-N 3.45Å; K327-V329 VanDerWaalsContact C-N 3.28Å; K327-V329 PolarHBondContact O-N 3.49Å; V329-L333 HydrophobicContact CG1-CD1 3.96Å; V329-L333 HydrophobicContact CG1-CG 4.44Å; V329-L333 WeakPolarHBondContact O-CB 3.48Å; V329-L333 WeakPolarHBondContact O-CG 3.23Å; V329-L333 PolarHBondContact O-N 2.93Å
330	I	97.4	Very high	97.3	Very high	97 Å²	97	100.8 Å²	100.8	50%	0.497	51%	0.506	S	S	.	.	H	α-helix	trans	-65	-43.9	174.9	-68.9	165.2	0	0	0	111.3	Q326 K327 K328 L333 A334	Q326-I330 HydrophobicContact CG-CD1 4.19Å; Q326-I330 WeakPolarHBondContact O-CG1 3.47Å; Q326-I330 PolarHBondContact O-N 2.87Å; Q326-I330 VanDerWaalsContact O-N 3.12Å; K327-I330 WeakPolarHBondContact O-CB 3.46Å; K327-I330 PolarHBondContact O-N 2.92Å; K327-I330 VanDerWaalsContact O-N 3.11Å; K328-I330 VanDerWaalsContact C-N 3.32Å; K328-I330 PolarHBondContact O-N 3.47Å; I330-L333 PolarHBondContact O-N 2.86Å; I330-A334 WeakPolarHBondContact O-CB 3.42Å; I330-A334 PolarHBondContact O-N 2.94Å
331	D	97.3	Very high	97.3	Very high	83 Å²	83	99.5 Å²	99.5	44%	0.444	50%	0.5	S	S	.	.	H	α-helix	trans	-66.5	-40.8	179.5	-69.5	-29.4	0	0	0	111.3	K327 K328 A334 L335	K327-D331 PolarHBondContact O-N 3.38Å; K328-D331 PolarHBondContact O-N 3.06Å; D331-A334 PolarHBondContact O-N 2.56Å; D331-L335 WeakPolarHBondContact O-CG 3.46Å; D331-L335 PolarHBondContact O-N 3.16Å
332	E	97.4	Very high	97.3	Very high	134 Å²	134	98.6 Å²	98.6	63%	0.626	50%	0.496	S	S	*	.	H	α-helix	trans	-62.8	-44.3	172.5	-74.6	-176.2	-179.5	0	0	112.7	K328 A334 L335 S336	K328-E332 WeakPolarHBondContact O-CG 3.46Å; K328-E332 PolarHBondContact O-N 2.85Å; E332-A334 VanDerWaalsContact C-N 3.3Å; E332-A334 PolarHBondContact O-N 3.45Å; E332-L335 PolarHBondContact O-N 2.96Å; E332-S336 VanDerWaalsContact O-CB 3.32Å; E332-S336 WeakPolarHBondContact O-CB 3.49Å; E332-S336 PolarHBondContact O-N 2.77Å
333	L	97.3	Very high	97.3	Very high	110 Å²	110	100.8 Å²	100.8	58%	0.576	50%	0.498	S	S	*	.	H	α-helix	trans	-64.2	-34.4	175.9	-73.8	170.6	0	0	0	112	V329 I330 R337	V329-L333 HydrophobicContact CG1-CD1 3.96Å; V329-L333 HydrophobicContact CG1-CG 4.44Å; V329-L333 WeakPolarHBondContact O-CB 3.48Å; V329-L333 WeakPolarHBondContact O-CG 3.23Å; V329-L333 PolarHBondContact O-N 2.93Å; I330-L333 PolarHBondContact O-N 2.86Å; L333-R337 WeakPolarHBondContact O-CB 3.44Å; L333-R337 PolarHBondContact O-N 3.39Å
334	A	97.4	Very high	97.2	Very high	34 Å²	34	101 Å²	101	28%	0.281	50%	0.499	S	S	.	.	H	α-helix	trans	-67.8	-42.6	175.2	0	0	0	0	0	112.2	I330 D331 E332 R337 K338	I330-A334 WeakPolarHBondContact O-CB 3.42Å; I330-A334 PolarHBondContact O-N 2.94Å; D331-A334 PolarHBondContact O-N 2.56Å; E332-A334 VanDerWaalsContact C-N 3.3Å; E332-A334 PolarHBondContact O-N 3.45Å; A334-R337 PolarHBondContact O-N 2.97Å; A334-K338 PolarHBondContact O-N 3.38Å; A334-K338 VanDerWaalsContact O-N 3.11Å
335	L	97	Very high	97.2	Very high	130 Å²	130	101 Å²	101	68%	0.681	50%	0.502	S	S	*	.	H	α-helix	trans	-63.3	-45.2	173.6	-70.5	170.8	0	0	0	111.6	D331 E332 K338 G339	D331-L335 WeakPolarHBondContact O-CG 3.46Å; D331-L335 PolarHBondContact O-N 3.16Å; E332-L335 PolarHBondContact O-N 2.96Å; L335-K338 PolarHBondContact O-N 3.32Å; L335-G339 PolarHBondContact O-N 2.82Å
336	S	96.8	Very high	97.2	Very high	61 Å²	61	98.9 Å²	98.9	43%	0.427	50%	0.503	S	S	.	.	H	α-helix	trans	-59.4	-46.5	176.8	-173.1	0	0	0	0	111.6	E332 K338 G339 F340	E332-S336 VanDerWaalsContact O-CB 3.32Å; E332-S336 WeakPolarHBondContact O-CB 3.49Å; E332-S336 PolarHBondContact O-N 2.77Å; S336-K338 PolarHBondContact O-N 3.33Å; S336-G339 PolarHBondContact O-N 2.89Å; S336-F340 WeakPolarHBondContact O-CD2 3.37Å; S336-F340 PolarHBondContact O-N 2.88Å; S336-F340 VanDerWaalsContact O-N 3.09Å; S336-F340 WeakPolarHBondContact OG-CE2 3.44Å
337	R	97.3	Very high	97.2	Very high	150 Å²	150	98.7 Å²	98.7	57%	0.566	50%	0.5	S	S	*	.	H	α-helix	trans	-57.9	-46.3	175.5	-169.1	-175.4	65.8	-121.5	-3.1	112.1	L333 A334 G339 F340 E341	L333-R337 WeakPolarHBondContact O-CB 3.44Å; L333-R337 PolarHBondContact O-N 3.39Å; A334-R337 PolarHBondContact O-N 2.97Å; R337-G339 VanDerWaalsContact C-N 3.31Å; R337-G339 PolarHBondContact O-N 3.38Å; R337-F340 PolarHBondContact O-N 2.84Å; R337-F340 VanDerWaalsContact O-N 3.12Å; R337-E341 WeakPolarHBondContact CD-OE1 3.42Å; R337-E341 WeakPolarHBondContact CG-OE1 3.36Å; R337-E341 IonicContact NE-OE1 4Å; R337-E341 PolarHBondContact NE-OE1 3.05Å; R337-E341 WeakPolarHBondContact O-CG 3.3Å; R337-E341 PolarHBondContact O-N 2.93Å
338	K	97.5	Very high	97.1	Very high	115 Å²	115	96.9 Å²	96.9	50%	0.5	50%	0.496	S	S	.	.	H	α-helix	trans	-59.9	-40.5	177	-173.9	175.2	-177.2	-82.6	0	112.1	A334 L335 S336 F340 E341 E342	A334-K338 PolarHBondContact O-N 3.38Å; A334-K338 VanDerWaalsContact O-N 3.11Å; L335-K338 PolarHBondContact O-N 3.32Å; S336-K338 PolarHBondContact O-N 3.33Å; K338-F340 VanDerWaalsContact C-N 3.34Å; K338-F340 PolarHBondContact O-N 2.68Å; K338-E341 PolarHBondContact O-N 3.42Å; K338-E342 WeakPolarHBondContact CE-OE1 3.47Å; K338-E342 IonicContact NZ-OE1 3.59Å; K338-E342 PolarHBondContact NZ-OE1 2.88Å; K338-E342 WeakPolarHBondContact O-CG 3.32Å; K338-E342 PolarHBondContact O-N 3.25Å
339	G	96.5	Very high	97	Very high	28 Å²	28	99.9 Å²	99.9	29%	0.289	51%	0.509	S	S	.	.	H	α-helix	trans	-60.2	-41.1	173.8	0	0	0	0	0	113	L335 S336 R337 I343	L335-G339 PolarHBondContact O-N 2.82Å; S336-G339 PolarHBondContact O-N 2.89Å; R337-G339 VanDerWaalsContact C-N 3.31Å; R337-G339 PolarHBondContact O-N 3.38Å; G339-I343 WeakPolarHBondContact O-CD1 3.38Å; G339-I343 VanDerWaalsContact O-CG1 3.26Å; G339-I343 WeakPolarHBondContact O-CG1 3.3Å; G339-I343 PolarHBondContact O-N 3.47Å; G339-I343 VanDerWaalsContact O-N 3.1Å
340	F	96.8	Very high	96.9	Very high	127 Å²	127	101.4 Å²	101.4	56%	0.557	51%	0.512	S	S	*	.	H	α-helix	trans	-67.7	-40.1	174	-67.9	-60.3	0	0	0	112.9	S336 R337 K338 E342 I343 I344	S336-F340 WeakPolarHBondContact O-CD2 3.37Å; S336-F340 PolarHBondContact O-N 2.88Å; S336-F340 VanDerWaalsContact O-N 3.09Å; S336-F340 WeakPolarHBondContact OG-CE2 3.44Å; R337-F340 PolarHBondContact O-N 2.84Å; R337-F340 VanDerWaalsContact O-N 3.12Å; K338-F340 VanDerWaalsContact C-N 3.34Å; K338-F340 PolarHBondContact O-N 2.68Å; F340-E342 VanDerWaalsContact C-N 3.35Å; F340-E342 PolarHBondContact O-N 3Å; F340-I343 PolarHBondContact O-N 2.88Å; F340-I344 WeakPolarHBondContact O-CB 3.42Å; F340-I344 WeakPolarHBondContact O-CD1 3.26Å; F340-I344 VanDerWaalsContact O-CG1 3.24Å; F340-I344 WeakPolarHBondContact O-CG1 3.49Å; F340-I344 PolarHBondContact O-N 2.92Å
341	E	97.1	Very high	96.7	Very high	101 Å²	101	101.3 Å²	101.3	47%	0.472	51%	0.512	S	S	.	.	H	α-helix	trans	-58.7	-44.3	175	-70.7	165.1	-166.2	0	0	111.4	R337 K338 I344 L345	R337-E341 WeakPolarHBondContact CD-OE1 3.42Å; R337-E341 WeakPolarHBondContact CG-OE1 3.36Å; R337-E341 IonicContact NE-OE1 4Å; R337-E341 PolarHBondContact NE-OE1 3.05Å; R337-E341 WeakPolarHBondContact O-CG 3.3Å; R337-E341 PolarHBondContact O-N 2.93Å; K338-E341 PolarHBondContact O-N 3.42Å; E341-I344 PolarHBondContact O-N 2.73Å; E341-L345 WeakPolarHBondContact O-CB 3.46Å; E341-L345 PolarHBondContact O-N 3.37Å
342	E	97.6	Very high	96.6	Very high	107 Å²	107	101.6 Å²	101.6	50%	0.5	51%	0.51	S	S	.	.	H	α-helix	trans	-64.5	-41.3	176.2	-72.4	174	-166.9	0	0	112.7	K338 F340 L345 A346	K338-E342 WeakPolarHBondContact CE-OE1 3.47Å; K338-E342 IonicContact NZ-OE1 3.59Å; K338-E342 PolarHBondContact NZ-OE1 2.88Å; K338-E342 WeakPolarHBondContact O-CG 3.32Å; K338-E342 PolarHBondContact O-N 3.25Å; F340-E342 VanDerWaalsContact C-N 3.35Å; F340-E342 PolarHBondContact O-N 3Å; E342-L345 PolarHBondContact O-N 3.4Å; E342-A346 WeakPolarHBondContact O-CB 3.44Å; E342-A346 PolarHBondContact O-N 3.32Å
343	I	97.6	Very high	96.5	Very high	103 Å²	103	98.5 Å²	98.5	53%	0.528	50%	0.501	S	S	.	.	H	α-helix	trans	-64.6	-42	175.5	-69.7	164.6	0	0	0	111.4	G339 F340 A346 K347	G339-I343 WeakPolarHBondContact O-CD1 3.38Å; G339-I343 VanDerWaalsContact O-CG1 3.26Å; G339-I343 WeakPolarHBondContact O-CG1 3.3Å; G339-I343 PolarHBondContact O-N 3.47Å; G339-I343 VanDerWaalsContact O-N 3.1Å; F340-I343 PolarHBondContact O-N 2.88Å; I343-A346 PolarHBondContact O-N 2.85Å; I343-K347 PolarHBondContact O-N 3.14Å
344	I	97	Very high	96.3	Very high	97 Å²	97	96.4 Å²	96.4	50%	0.497	49%	0.493	S	S	.	.	H	α-helix	trans	-64.3	-44.6	177.6	-71	163.9	0	0	0	110.3	F340 E341 A346 K347 N348	F340-I344 WeakPolarHBondContact O-CB 3.42Å; F340-I344 WeakPolarHBondContact O-CD1 3.26Å; F340-I344 VanDerWaalsContact O-CG1 3.24Å; F340-I344 WeakPolarHBondContact O-CG1 3.49Å; F340-I344 PolarHBondContact O-N 2.92Å; E341-I344 PolarHBondContact O-N 2.73Å; I344-A346 PolarHBondContact O-N 3.35Å; I344-K347 PolarHBondContact O-N 3.3Å; I344-N348 WeakPolarHBondContact O-CB 3.49Å; I344-N348 VanDerWaalsContact O-CG 3.24Å; I344-N348 PolarHBondContact O-N 2.98Å; I344-N348 PolarHBondContact O-ND2 2.87Å
345	L	97.3	Very high	96.2	Very high	126 Å²	126	99.6 Å²	99.6	66%	0.66	50%	0.5	S	S	*	.	H	α-helix	trans	-60	-45.2	176.8	-178.1	62.7	0	0	0	111.8	E341 E342 N348 K349	E341-L345 WeakPolarHBondContact O-CB 3.46Å; E341-L345 PolarHBondContact O-N 3.37Å; E342-L345 PolarHBondContact O-N 3.4Å; L345-N348 PolarHBondContact O-N 3.45Å; L345-K349 PolarHBondContact O-N 3.24Å; L345-K349 VanDerWaalsContact O-N 3.1Å
346	A	96.3	Very high	96.1	Very high	60 Å²	60	98.1 Å²	98.1	50%	0.496	49%	0.49	S	S	.	.	H	α-helix	trans	-61.2	-44.4	176.3	0	0	0	0	0	112.1	E342 I343 I344 K349 E350	E342-A346 WeakPolarHBondContact O-CB 3.44Å; E342-A346 PolarHBondContact O-N 3.32Å; I343-A346 PolarHBondContact O-N 2.85Å; I344-A346 PolarHBondContact O-N 3.35Å; A346-K349 PolarHBondContact O-N 2.81Å; A346-E350 PolarHBondContact O-N 3.5Å
347	K	96.4	Very high	96	Very high	112 Å²	112	100.8 Å²	100.8	49%	0.487	50%	0.496	S	S	.	.	H	α-helix	trans	-71.4	-31.2	179.5	-76.1	-66.9	174.8	-157.5	0	114.1	I343 I344 E350 L351	I343-K347 PolarHBondContact O-N 3.14Å; I344-K347 PolarHBondContact O-N 3.3Å; K347-E350 IonicContact NZ-OE1 3.21Å; K347-E350 PolarHBondContact NZ-OE1 2.99Å; K347-E350 IonicContact NZ-OE2 2.74Å; K347-E350 PolarHBondContact NZ-OE2 2.7Å; K347-L351 WeakPolarHBondContact O-CB 3.34Å; K347-L351 PolarHBondContact O-N 2.86Å
348	N	95	Very high	95.8	Very high	92 Å²	92	99.4 Å²	99.4	49%	0.492	49%	0.493	S	S	.	.	H	α-helix	trans	-66.9	-39.5	171.5	-70.8	-15.9	0	0	0	111.4	I344 L345 L351 E352	I344-N348 WeakPolarHBondContact O-CB 3.49Å; I344-N348 VanDerWaalsContact O-CG 3.24Å; I344-N348 PolarHBondContact O-N 2.98Å; I344-N348 PolarHBondContact O-ND2 2.87Å; L345-N348 PolarHBondContact O-N 3.45Å; N348-L351 PolarHBondContact O-N 3.09Å; N348-E352 PolarHBondContact O-N 2.95Å; N348-E352 VanDerWaalsContact O-N 3.08Å
349	K	96.5	Very high	95.7	Very high	159 Å²	159	100 Å²	100	69%	0.691	50%	0.498	S	S	*	.	H	α-helix	trans	-65.1	-42.5	175	-174	175.6	-179.7	178.6	0	112.4	L345 A346 L351 V353	L345-K349 PolarHBondContact O-N 3.24Å; L345-K349 VanDerWaalsContact O-N 3.1Å; A346-K349 PolarHBondContact O-N 2.81Å; K349-L351 VanDerWaalsContact C-N 3.34Å; K349-V353 WeakPolarHBondContact O-CG2 3.27Å; K349-V353 PolarHBondContact O-N 3.47Å
350	E	95.3	Very high	95.6	Very high	103 Å²	103	104 Å²	104	48%	0.481	51%	0.508	S	S	.	.	H	α-helix	trans	-59.4	-43.8	173.2	-175.6	179.7	129.5	0	0	111.5	A346 K347 V353 T354	A346-E350 PolarHBondContact O-N 3.5Å; K347-E350 IonicContact NZ-OE1 3.21Å; K347-E350 PolarHBondContact NZ-OE1 2.99Å; K347-E350 IonicContact NZ-OE2 2.74Å; K347-E350 PolarHBondContact NZ-OE2 2.7Å; E350-V353 PolarHBondContact O-N 3.03Å; E350-T354 WeakPolarHBondContact O-CG2 3.36Å; E350-T354 PolarHBondContact O-N 2.88Å; E350-T354 VanDerWaalsContact O-N 3.12Å
351	L	94.1	Very high	95.4	Very high	95 Å²	95	100.7 Å²	100.7	50%	0.497	50%	0.503	S	S	.	.	H	α-helix	trans	-62.2	-46.3	179	-178.3	61.9	0	0	0	112.5	K347 N348 K349 V353 T354 K355	K347-L351 WeakPolarHBondContact O-CB 3.34Å; K347-L351 PolarHBondContact O-N 2.86Å; N348-L351 PolarHBondContact O-N 3.09Å; K349-L351 VanDerWaalsContact C-N 3.34Å; L351-V353 PolarHBondContact O-N 3.02Å; L351-T354 PolarHBondContact O-N 3.02Å; L351-T354 PolarHBondContact O-OG1 3.11Å; L351-K355 WeakPolarHBondContact O-CB 3.35Å; L351-K355 PolarHBondContact O-N 2.98Å
352	E	94.9	Very high	95.2	Very high	89 Å²	89	103.6 Å²	103.6	42%	0.416	51%	0.51	S	S	.	.	H	α-helix	trans	-64.1	-37.4	179	-73.8	-64.9	134.5	0	0	112.5	N348 K355 E356	N348-E352 PolarHBondContact O-N 2.95Å; N348-E352 VanDerWaalsContact O-N 3.08Å; E352-K355 WeakPolarHBondContact O-CB 3.35Å; E352-K355 PolarHBondContact O-N 3.38Å; E352-K355 WeakPolarHBondContact OE1-CD 3.37Å; E352-K355 IonicContact OE1-NZ 2.75Å; E352-K355 PolarHBondContact OE1-NZ 2.96Å; E352-K355 IonicContact OE2-NZ 3.1Å; E352-K355 PolarHBondContact OE2-NZ 2.83Å; E352-E356 PolarHBondContact O-N 2.99Å
353	V	95.4	Very high	95	Very high	69 Å²	69	101.2 Å²	101.2	42%	0.418	51%	0.509	S	S	.	.	H	α-helix	trans	-61.2	-48.5	172.3	174.4	0	0	0	0	111.2	K349 E350 L351 K355 E356 E357	K349-V353 WeakPolarHBondContact O-CG2 3.27Å; K349-V353 PolarHBondContact O-N 3.47Å; E350-V353 PolarHBondContact O-N 3.03Å; L351-V353 PolarHBondContact O-N 3.02Å; V353-K355 PolarHBondContact O-N 3.38Å; V353-E356 PolarHBondContact O-N 3.17Å; V353-E357 HydrophobicContact CG1-CG 4.43Å; V353-E357 WeakPolarHBondContact O-CG 3.34Å; V353-E357 PolarHBondContact O-N 2.99Å
354	T	93.5	Very high	94.7	Very high	67 Å²	67	102.3 Å²	102.3	41%	0.411	51%	0.511	S	S	.	.	H	α-helix	trans	-64.9	-25.6	178.2	63.3	0	0	0	0	113.4	E350 L351 K358	E350-T354 WeakPolarHBondContact O-CG2 3.36Å; E350-T354 PolarHBondContact O-N 2.88Å; E350-T354 VanDerWaalsContact O-N 3.12Å; L351-T354 PolarHBondContact O-N 3.02Å; L351-T354 PolarHBondContact O-OG1 3.11Å; T354-K358 VanDerWaalsContact O-CB 3.25Å; T354-K358 WeakPolarHBondContact O-CB 3.46Å; T354-K358 PolarHBondContact O-N 3.11Å; T354-K358 VanDerWaalsContact O-N 3.11Å
355	K	95.1	Very high	94.4	Very high	100 Å²	100	104.9 Å²	104.9	44%	0.435	52%	0.519	S	S	.	.	H	α-helix	trans	-73.2	-47.7	174.5	171.4	-176.5	154.5	-145.5	0	110.7	L351 E352 V353 E357 K358 E359	L351-K355 WeakPolarHBondContact O-CB 3.35Å; L351-K355 PolarHBondContact O-N 2.98Å; E352-K355 WeakPolarHBondContact O-CB 3.35Å; E352-K355 PolarHBondContact O-N 3.38Å; E352-K355 WeakPolarHBondContact OE1-CD 3.37Å; E352-K355 IonicContact OE1-NZ 2.75Å; E352-K355 PolarHBondContact OE1-NZ 2.96Å; E352-K355 IonicContact OE2-NZ 3.1Å; E352-K355 PolarHBondContact OE2-NZ 2.83Å; V353-K355 PolarHBondContact O-N 3.38Å; K355-E357 PolarHBondContact O-N 3.11Å; K355-K358 PolarHBondContact O-N 2.89Å; K355-E359 WeakPolarHBondContact O-CB 3.47Å; K355-E359 PolarHBondContact O-N 3.27Å
356	E	94.1	Very high	94	Very high	99 Å²	99	103.6 Å²	103.6	46%	0.463	51%	0.51	S	S	.	.	H	α-helix	trans	-57.6	-46.1	172.6	-80.2	-170	-136.6	0	0	112.5	E352 V353 K358 E359 K360	E352-E356 PolarHBondContact O-N 2.99Å; V353-E356 PolarHBondContact O-N 3.17Å; E356-K358 VanDerWaalsContact C-N 3.34Å; E356-K358 PolarHBondContact O-N 2.77Å; E356-E359 PolarHBondContact O-N 3.06Å; E356-K360 WeakPolarHBondContact O-CB 3.45Å; E356-K360 WeakPolarHBondContact O-CD 3.49Å; E356-K360 VanDerWaalsContact O-CG 3.24Å; E356-K360 WeakPolarHBondContact O-CG 3.42Å; E356-K360 PolarHBondContact O-N 3.23Å; E356-K360 IonicContact OE2-NZ 3.61Å; E356-K360 PolarHBondContact OE2-NZ 2.76Å
357	E	94.5	Very high	93.8	Very high	118 Å²	118	107.3 Å²	107.3	55%	0.551	52%	0.517	S	S	*	.	H	α-helix	trans	-60.2	-44.8	177.8	-73.3	175.5	160.1	0	0	111.4	V353 K355 E359 K360 A361	V353-E357 HydrophobicContact CG1-CG 4.43Å; V353-E357 WeakPolarHBondContact O-CG 3.34Å; V353-E357 PolarHBondContact O-N 2.99Å; K355-E357 PolarHBondContact O-N 3.11Å; E357-E359 VanDerWaalsContact C-N 3.35Å; E357-K360 PolarHBondContact O-N 3.49Å; E357-A361 WeakPolarHBondContact O-CB 3.31Å; E357-A361 PolarHBondContact O-N 2.86Å
358	K	93.5	Very high	93.4	Very high	120 Å²	120	106 Å²	106	52%	0.522	52%	0.518	S	S	.	.	H	α-helix	trans	-66.5	-35.7	176.9	-170.5	-163.1	175.7	-155.1	0	112.3	H172 T354 K355 E356 R362	H172-K358 PolarHBondContact CD2-NZ 2.87Å; H172-K358 PolarHBondContact NE2-NZ 3Å; T354-K358 VanDerWaalsContact O-CB 3.25Å; T354-K358 WeakPolarHBondContact O-CB 3.46Å; T354-K358 PolarHBondContact O-N 3.11Å; T354-K358 VanDerWaalsContact O-N 3.11Å; K355-K358 PolarHBondContact O-N 2.89Å; E356-K358 VanDerWaalsContact C-N 3.34Å; E356-K358 PolarHBondContact O-N 2.77Å; K358-R362 WeakPolarHBondContact O-CB 3.4Å; K358-R362 PolarHBondContact O-N 3.42Å
359	E	95	Very high	93.1	Very high	128 Å²	128	103.9 Å²	103.9	60%	0.598	51%	0.508	S	S	*	.	H	α-helix	trans	-68.1	-45.2	177	-169.4	170.6	156.3	0	0	111.1	K355 E356 E357 A361 R362 A363	K355-E359 WeakPolarHBondContact O-CB 3.47Å; K355-E359 PolarHBondContact O-N 3.27Å; E356-E359 PolarHBondContact O-N 3.06Å; E357-E359 VanDerWaalsContact C-N 3.35Å; E359-A361 PolarHBondContact O-N 3.4Å; E359-R362 WeakPolarHBondContact O-CB 3.5Å; E359-R362 PolarHBondContact O-N 3.06Å; E359-R362 VanDerWaalsContact O-N 3.14Å; E359-A363 PolarHBondContact O-N 3.2Å
360	K	94.5	Very high	92.7	Very high	113 Å²	113	100.6 Å²	100.6	49%	0.491	50%	0.502	S	S	.	.	H	α-helix	trans	-59.8	-43.8	172.7	-67.8	159.3	-165.8	167.3	0	111.4	E356 E357 R362 A363 Q364	E356-K360 WeakPolarHBondContact O-CB 3.45Å; E356-K360 WeakPolarHBondContact O-CD 3.49Å; E356-K360 VanDerWaalsContact O-CG 3.24Å; E356-K360 WeakPolarHBondContact O-CG 3.42Å; E356-K360 PolarHBondContact O-N 3.23Å; E356-K360 IonicContact OE2-NZ 3.61Å; E356-K360 PolarHBondContact OE2-NZ 2.76Å; E357-K360 PolarHBondContact O-N 3.49Å; K360-R362 VanDerWaalsContact C-N 3.34Å; K360-R362 PolarHBondContact O-N 3.14Å; K360-A363 PolarHBondContact O-N 3Å; K360-Q364 WeakPolarHBondContact O-CG 3.33Å; K360-Q364 PolarHBondContact O-N 3.23Å
361	A	93.4	Very high	92.4	Very high	56 Å²	56	101.8 Å²	101.8	46%	0.463	51%	0.507	S	S	.	.	H	α-helix	trans	-66.9	-31.1	175.3	0	0	0	0	0	113.4	E357 E359 K365	E357-A361 WeakPolarHBondContact O-CB 3.31Å; E357-A361 PolarHBondContact O-N 2.86Å; E359-A361 PolarHBondContact O-N 3.4Å; A361-K365 PolarHBondContact O-N 3.06Å
362	R	91.8	Very high	92.1	Very high	162 Å²	162	99 Å²	99	61%	0.611	49%	0.494	S	S	*	.	H	α-helix	trans	-66.8	-51.3	170.2	179.6	-172.8	165.2	-179	-5.7	110.3	K358 E359 K360 Q364 K365 E366	K358-R362 WeakPolarHBondContact O-CB 3.4Å; K358-R362 PolarHBondContact O-N 3.42Å; E359-R362 WeakPolarHBondContact O-CB 3.5Å; E359-R362 PolarHBondContact O-N 3.06Å; E359-R362 VanDerWaalsContact O-N 3.14Å; K360-R362 VanDerWaalsContact C-N 3.34Å; K360-R362 PolarHBondContact O-N 3.14Å; R362-Q364 VanDerWaalsContact C-N 3.34Å; R362-Q364 PolarHBondContact O-N 2.9Å; R362-K365 WeakPolarHBondContact O-CB 3.46Å; R362-K365 PolarHBondContact O-N 3.37Å; R362-E366 IonicContact CZ-OE2 2.76Å; R362-E366 VanDerWaalsContact CZ-OE2 3.26Å; R362-E366 IonicContact NE-OE2 3.18Å; R362-E366 PolarHBondContact NE-OE2 2.74Å; R362-E366 IonicContact NH2-OE1 3.69Å; R362-E366 PolarHBondContact NH2-OE1 2.71Å; R362-E366 IonicContact NH2-OE2 2.71Å; R362-E366 PolarHBondContact NH2-OE2 3.24Å; R362-E366 WeakPolarHBondContact O-CB 3.44Å; R362-E366 PolarHBondContact O-N 3.21Å
363	A	93.9	Very high	91.7	Very high	57 Å²	57	96.1 Å²	96.1	47%	0.471	48%	0.483	S	S	.	.	H	α-helix	trans	-56.9	-46.5	-178.3	0	0	0	0	0	111.7	E359 K360 K365 E366 E367	E359-A363 PolarHBondContact O-N 3.2Å; K360-A363 PolarHBondContact O-N 3Å; A363-K365 VanDerWaalsContact C-N 3.32Å; A363-K365 PolarHBondContact O-N 3.35Å; A363-E366 PolarHBondContact O-N 3.11Å; A363-E366 VanDerWaalsContact O-N 3.11Å; A363-E367 WeakPolarHBondContact O-CB 3.45Å; A363-E367 PolarHBondContact O-N 2.97Å
364	Q	92.1	Very high	91.3	Very high	126 Å²	126	98.2 Å²	98.2	59%	0.589	49%	0.488	S	S	*	.	H	α-helix	trans	-59.7	-38.5	174.5	-72.7	173.9	-11.1	0	0	113	K360 R362 V368	K360-Q364 WeakPolarHBondContact O-CG 3.33Å; K360-Q364 PolarHBondContact O-N 3.23Å; R362-Q364 VanDerWaalsContact C-N 3.34Å; R362-Q364 PolarHBondContact O-N 2.9Å; Q364-V368 VanDerWaalsContact O-CG2 3.31Å; Q364-V368 WeakPolarHBondContact O-CG2 3.1Å; Q364-V368 PolarHBondContact O-N 3.23Å; Q364-V368 VanDerWaalsContact O-N 3.11Å
365	K	89.4	Confident	91.1	Very high	152 Å²	152	97.8 Å²	97.8	66%	0.661	49%	0.485	S	S	*	.	H	α-helix	trans	-67.8	-39.5	174.6	-173.1	-176.2	175.7	-171.7	0	111.7	A361 R362 A363 V368 V369	A361-K365 PolarHBondContact O-N 3.06Å; R362-K365 WeakPolarHBondContact O-CB 3.46Å; R362-K365 PolarHBondContact O-N 3.37Å; A363-K365 VanDerWaalsContact C-N 3.32Å; A363-K365 PolarHBondContact O-N 3.35Å; K365-V368 PolarHBondContact O-N 2.95Å; K365-V369 WeakPolarHBondContact O-CG2 3.36Å; K365-V369 PolarHBondContact O-N 3.42Å
366	E	89.9	Confident	90.6	Very high	99 Å²	99	93 Å²	93	46%	0.463	47%	0.465	S	S	.	.	H	α-helix	trans	-68.3	-39.7	-179.4	-148.5	156.2	132.3	0	0	111.3	R362 A363 V369 T370	R362-E366 IonicContact CZ-OE2 2.76Å; R362-E366 VanDerWaalsContact CZ-OE2 3.26Å; R362-E366 IonicContact NE-OE2 3.18Å; R362-E366 PolarHBondContact NE-OE2 2.74Å; R362-E366 IonicContact NH2-OE1 3.69Å; R362-E366 PolarHBondContact NH2-OE1 2.71Å; R362-E366 IonicContact NH2-OE2 2.71Å; R362-E366 PolarHBondContact NH2-OE2 3.24Å; R362-E366 WeakPolarHBondContact O-CB 3.44Å; R362-E366 PolarHBondContact O-N 3.21Å; A363-E366 PolarHBondContact O-N 3.11Å; A363-E366 VanDerWaalsContact O-N 3.11Å; E366-V369 PolarHBondContact O-N 3.1Å; E366-T370 PolarHBondContact O-N 3.42Å; E366-T370 PolarHBondContact O-OG1 3.08Å
367	E	91.3	Very high	90.1	Very high	137 Å²	137	93 Å²	93	64%	0.64	47%	0.465	S	S	*	.	H	α-helix	trans	-59.7	-50.1	171	-177.9	178.3	-165.2	0	0	111.9	A363 V369 T370 Q371	A363-E367 WeakPolarHBondContact O-CB 3.45Å; A363-E367 PolarHBondContact O-N 2.97Å; E367-V369 VanDerWaalsContact C-N 3.34Å; E367-V369 PolarHBondContact O-N 3.45Å; E367-T370 PolarHBondContact O-N 2.89Å; E367-Q371 PolarHBondContact O-N 3.13Å
368	V	88.7	Confident	89.6	Confident	86 Å²	86	92.7 Å²	92.7	52%	0.521	47%	0.466	S	S	.	.	H	α-helix	trans	-63.4	-37.7	177.5	169.9	0	0	0	0	112.1	Q364 K365 V372	Q364-V368 VanDerWaalsContact O-CG2 3.31Å; Q364-V368 WeakPolarHBondContact O-CG2 3.1Å; Q364-V368 PolarHBondContact O-N 3.23Å; Q364-V368 VanDerWaalsContact O-N 3.11Å; K365-V368 PolarHBondContact O-N 2.95Å; V368-V372 WeakPolarHBondContact O-CG2 3.44Å; V368-V372 PolarHBondContact O-N 3.28Å; V368-V372 VanDerWaalsContact O-N 3.08Å
369	V	87.6	Confident	89.4	Confident	46 Å²	46	93.8 Å²	93.8	28%	0.279	47%	0.473	S	S	.	.	H	α-helix	trans	-65.3	-44.9	174.9	168.4	0	0	0	0	110.8	K365 E366 E367 Q371 V372 T373	K365-V369 WeakPolarHBondContact O-CG2 3.36Å; K365-V369 PolarHBondContact O-N 3.42Å; E366-V369 PolarHBondContact O-N 3.1Å; E367-V369 VanDerWaalsContact C-N 3.34Å; E367-V369 PolarHBondContact O-N 3.45Å; V369-Q371 PolarHBondContact O-N 2.96Å; V369-V372 PolarHBondContact O-N 3Å; V369-T373 PolarHBondContact O-N 3.24Å; V369-T373 PolarHBondContact O-OG1 2.96Å; V369-T373 VanDerWaalsContact O-OG1 3.13Å
370	T	88.4	Confident	89.2	Confident	91 Å²	91	88.3 Å²	88.3	56%	0.558	45%	0.448	S	S	*	.	H	α-helix	trans	-58.2	-46.5	176.7	-57	0	0	0	0	111.6	E366 E367 V372 T373 E374	E366-T370 PolarHBondContact O-N 3.42Å; E366-T370 PolarHBondContact O-OG1 3.08Å; E367-T370 PolarHBondContact O-N 2.89Å; T370-V372 VanDerWaalsContact C-N 3.35Å; T370-V372 PolarHBondContact O-N 3.41Å; T370-T373 WeakPolarHBondContact O-CB 3.44Å; T370-T373 PolarHBondContact O-N 3.43Å; T370-E374 PolarHBondContact O-N 3.24Å
371	Q	88.4	Confident	89.1	Confident	127 Å²	127	86.6 Å²	86.6	59%	0.593	44%	0.442	S	S	*	.	H	α-helix	trans	-63.8	-36.3	178	-177.9	172	76.7	0	0	112.9	E367 V369 V375	E367-Q371 PolarHBondContact O-N 3.13Å; V369-Q371 PolarHBondContact O-N 2.96Å; Q371-V375 WeakPolarHBondContact O-CG2 3.21Å; Q371-V375 PolarHBondContact O-N 3.4Å
372	V	87.9	Confident	89.1	Confident	37 Å²	37	83.9 Å²	83.9	22%	0.224	42%	0.42	C	S	.	.	H	α-helix	trans	-69.5	-38.4	175.1	171.5	0	0	0	0	111.4	V368 V369 T370 L376 M439 L443	V368-V372 WeakPolarHBondContact O-CG2 3.44Å; V368-V372 PolarHBondContact O-N 3.28Å; V368-V372 VanDerWaalsContact O-N 3.08Å; V369-V372 PolarHBondContact O-N 3Å; T370-V372 VanDerWaalsContact C-N 3.35Å; T370-V372 PolarHBondContact O-N 3.41Å; V372-L376 HydrophobicContact CG1-CD1 4.02Å; V372-L376 WeakPolarHBondContact O-CD1 3.33Å; V372-L376 WeakPolarHBondContact O-CG 3.49Å; V372-L376 PolarHBondContact O-N 2.75Å; V372-L376 VanDerWaalsContact O-N 3.17Å; V372-M439 HydrophobicContact CG1-CB 4.01Å; V372-M439 HydrophobicContact CG1-CG 4.28Å; V372-L443 HydrophobicContact CG1-CD2 4.16Å
373	T	87.5	Confident	89.1	Confident	28 Å²	28	81.6 Å²	81.6	17%	0.172	42%	0.419	C	S	.	.	H	α-helix	trans	-61.9	-46.2	173.4	-60	0	0	0	0	111.6	V369 T370 V375 L376 E377 M447	V369-T373 PolarHBondContact O-N 3.24Å; V369-T373 PolarHBondContact O-OG1 2.96Å; V369-T373 VanDerWaalsContact O-OG1 3.13Å; T370-T373 WeakPolarHBondContact O-CB 3.44Å; T370-T373 PolarHBondContact O-N 3.43Å; T373-V375 PolarHBondContact O-N 3.13Å; T373-L376 WeakPolarHBondContact O-CB 3.48Å; T373-L376 PolarHBondContact O-N 3.08Å; T373-L376 VanDerWaalsContact O-N 3.11Å; T373-E377 HydrophobicContact CG2-CG 4.26Å; T373-E377 WeakPolarHBondContact O-CG 3.41Å; T373-E377 PolarHBondContact O-N 2.79Å; T373-M447 HydrophobicContact CG2-CE 4.17Å
374	E	87.4	Confident	89.1	Confident	113 Å²	113	81.9 Å²	81.9	53%	0.528	41%	0.411	S	S	.	.	H	α-helix	trans	-57.7	-45.4	178.7	-177.3	-179.8	-163.4	0	0	112.4	T370 L376 E377 N378	T370-E374 PolarHBondContact O-N 3.24Å; E374-L376 VanDerWaalsContact C-N 3.32Å; E374-L376 PolarHBondContact O-N 3.49Å; E374-E377 PolarHBondContact O-N 3.28Å; E374-N378 WeakPolarHBondContact CG-ND2 3.25Å; E374-N378 WeakPolarHBondContact O-CB 3.24Å; E374-N378 PolarHBondContact O-N 3.03Å; E374-N378 PolarHBondContact O-ND2 3.2Å
375	V	87.7	Confident	89.1	Confident	59 Å²	59	77.7 Å²	77.7	36%	0.358	40%	0.395	S	S	.	.	H	α-helix	trans	-63	-38.7	176.5	170.8	0	0	0	0	111.7	Q371 T373 E379 M439	Q371-V375 WeakPolarHBondContact O-CG2 3.21Å; Q371-V375 PolarHBondContact O-N 3.4Å; T373-V375 PolarHBondContact O-N 3.13Å; V375-E379 WeakPolarHBondContact O-CB 2.79Å; V375-E379 PolarHBondContact O-N 3Å; V375-M439 HydrophobicContact CG1-CE 4.37Å
376	L	85.8	Confident	89.1	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-69	-40.8	178.7	-77.9	164.6	0	0	0	112.5	V372 T373 E374 L380 L388 I436 M439 L443	V372-L376 HydrophobicContact CG1-CD1 4.02Å; V372-L376 WeakPolarHBondContact O-CD1 3.33Å; V372-L376 WeakPolarHBondContact O-CG 3.49Å; V372-L376 PolarHBondContact O-N 2.75Å; V372-L376 VanDerWaalsContact O-N 3.17Å; T373-L376 WeakPolarHBondContact O-CB 3.48Å; T373-L376 PolarHBondContact O-N 3.08Å; T373-L376 VanDerWaalsContact O-N 3.11Å; E374-L376 VanDerWaalsContact C-N 3.32Å; E374-L376 PolarHBondContact O-N 3.49Å; L376-L380 HydrophobicContact CD2-CB 4.33Å; L376-L380 HydrophobicContact CD2-CD1 3.75Å; L376-L380 PolarHBondContact O-N 3.21Å; L376-L388 HydrophobicContact CB-CD2 3.85Å; L376-L388 HydrophobicContact CD2-CD1 4.15Å; L376-L388 HydrophobicContact CD2-CD2 4.06Å; L376-L388 WeakPolarHBondContact O-CD2 3.18Å; L376-I436 HydrophobicContact CD2-CG2 4.35Å; L376-M439 HydrophobicContact CD1-CB 4Å; L376-M439 HydrophobicContact CD2-CB 4.03Å; L376-M439 HydrophobicContact CD2-SD 4.05Å; L376-M439 HydrophobicContact CG-CB 4.26Å; L376-M439 HydrophobicContact CG-SD 4.23Å; L376-L443 HydrophobicContact CD1-CD1 3.51Å; L376-L443 HydrophobicContact CD1-CD2 3.83Å; L376-L443 HydrophobicContact CD1-CG 4.08Å
377	E	83.8	Confident	89.2	Confident	99 Å²	99	71 Å²	71	46%	0.463	38%	0.375	S	S	.	.	H	α-helix	trans	-73	-39.2	-178.6	-70.9	-178.9	168.6	0	0	112.6	T373 E374 Q381	T373-E377 HydrophobicContact CG2-CG 4.26Å; T373-E377 WeakPolarHBondContact O-CG 3.41Å; T373-E377 PolarHBondContact O-N 2.79Å; E374-E377 PolarHBondContact O-N 3.28Å; E377-Q381 VanDerWaalsContact O-CD 3.31Å; E377-Q381 WeakPolarHBondContact O-CG 3.37Å; E377-Q381 PolarHBondContact O-NE2 3.01Å
378	N	84.4	Confident	89.3	Confident	110 Å²	110	65.2 Å²	65.2	59%	0.588	35%	0.349	S	S	*	.	H	α-helix	trans	-81.9	-45.4	-178.8	-68.9	-40.3	0	0	0	113.6	E374	E374-N378 WeakPolarHBondContact CG-ND2 3.25Å; E374-N378 WeakPolarHBondContact O-CB 3.24Å; E374-N378 PolarHBondContact O-N 3.03Å; E374-N378 PolarHBondContact O-ND2 3.2Å
379	E	87.8	Confident	89.5	Confident	143 Å²	143	61.7 Å²	61.7	67%	0.668	33%	0.326	S	S	*	.	H	α-helix	trans	-103.8	-20.2	-166.4	-57.5	-63.6	142.9	0	0	114.2	V375	V375-E379 WeakPolarHBondContact O-CB 2.79Å; V375-E379 PolarHBondContact O-N 3Å
380	L	90.9	Very high	89.9	Confident	14 Å²	14	60 Å²	60	7%	0.073	32%	0.315	C	S	.	.	S	Bend	trans	-119.3	13.1	-166.4	-62.3	172.5	0	0	0	114.5	L376 L388 F389 L432 I436 M439	L376-L380 HydrophobicContact CD2-CB 4.33Å; L376-L380 HydrophobicContact CD2-CD1 3.75Å; L376-L380 PolarHBondContact O-N 3.21Å; L380-L388 HydrophobicContact CB-CD2 4.43Å; L380-L388 WeakPolarHBondContact O-CA 3.38Å; L380-F389 WeakPolarHBondContact O-CD2 3.34Å; L380-F389 PolarHBondContact O-N 3.4Å; L380-L432 HydrophobicContact CD2-CD2 3.75Å; L380-I436 HydrophobicContact CB-CD1 4.33Å; L380-I436 HydrophobicContact CB-CG1 4.15Å; L380-I436 HydrophobicContact CD1-CG1 3.96Å; L380-I436 HydrophobicContact CD2-CD1 4.47Å; L380-I436 HydrophobicContact CD2-CG1 4.31Å; L380-I436 HydrophobicContact CG-CG1 4.37Å; L380-M439 HydrophobicContact CD1-SD 3.92Å
381	Q	92.5	Very high	90.1	Very high	76 Å²	76	58.6 Å²	58.6	36%	0.355	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	144.7	173.6	-70.1	-166.8	14.6	0	0	114.1	E377 L388 F389	E377-Q381 VanDerWaalsContact O-CD 3.31Å; E377-Q381 WeakPolarHBondContact O-CG 3.37Å; E377-Q381 PolarHBondContact O-NE2 3.01Å; Q381-L388 HydrophobicContact CG-CD2 4.21Å; Q381-F389 WeakPolarHBondContact O-CZ 3.4Å
382	C	93.6	Very high	90.5	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	107.7	174.9	175	0	0	0	0	111.7	I384 C385 S386 E387 F389 C402	C382-I384 PolarHBondContact O-N 3.11Å; C382-C385 PolarHBondContact O-N 2.76Å; C382-S386 PolarHBondContact O-N 3.25Å; C382-E387 WeakPolarHBondContact CB-O 3.46Å; C382-E387 PolarHBondContact N-O 3.36Å; C382-F389 HydrophobicContact CB-CD1 3.62Å; C382-F389 HydrophobicContact CB-CE1 3.66Å; C382-C402 WeakPolarHBondContact CB-SG 3.47Å; C382-C402 PolarHBondContact SG-N 2.93Å; C382-C402 VanDerWaalsContact SG-SG 3.63Å
383	I	92.2	Very high	90.9	Very high	114 Å²	114	51.1 Å²	51.1	59%	0.585	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-22.1	-178.2	-163	170.1	0	0	0	116.1	F401 I418	I383-F401 HydrophobicContact CG2-CD1 4.19Å; I383-F401 HydrophobicContact CG2-CE1 3.69Å; I383-I418 HydrophobicContact CD1-CG1 4.25Å; I383-I418 HydrophobicContact CG2-CD1 4Å; I383-I418 HydrophobicContact CG2-CG1 4.07Å
384	I	93.4	Very high	91.3	Very high	62 Å²	62	52.3 Å²	52.3	32%	0.318	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-25.5	177.3	-55.8	169.9	0	0	0	112.2	C382 F401 C405 I406 P417	C382-I384 PolarHBondContact O-N 3.11Å; I384-F401 HydrophobicContact CD1-CB 4.29Å; I384-F401 HydrophobicContact CD1-CD1 3.47Å; I384-F401 VanDerWaalsContact CD1-CD1 3.47Å; I384-F401 HydrophobicContact CD1-CE1 4.13Å; I384-F401 HydrophobicContact CD1-CG 4.1Å; I384-F401 HydrophobicContact CG1-CD1 3.82Å; I384-F401 HydrophobicContact CG1-CE1 4.22Å; I384-C405 HydrophobicContact CB-CB 3.89Å; I384-C405 HydrophobicContact CD1-CB 3.85Å; I384-C405 HydrophobicContact CG1-CB 4.48Å; I384-C405 HydrophobicContact CG2-CB 3.82Å; I384-I406 HydrophobicContact CD1-CD1 4.41Å; I384-P417 HydrophobicContact CD1-CG 4.02Å; I384-P417 HydrophobicContact CG1-CG 4.26Å
385	C	91.9	Very high	91.8	Very high	38 Å²	38	47.3 Å²	47.3	26%	0.257	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-137.3	1.3	-174.6	64	0	0	0	0	115.4	C382 E387 C405 R458	C382-C385 PolarHBondContact O-N 2.76Å; C385-E387 WeakPolarHBondContact O-CG 3.43Å; C385-E387 PolarHBondContact O-N 2.77Å; C385-C405 VanDerWaalsContact SG-SG 3.6Å; C385-R458 PolarHBondContact SG-NH2 3.16Å; C385-R458 VanDerWaalsContact SG-NH2 3.41Å
386	S	91.1	Very high	92.2	Very high	78 Å²	78	46.6 Å²	46.6	55%	0.545	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	40.1	179.5	-51.4	0	0	0	0	113.9	C382	C382-S386 PolarHBondContact O-N 3.25Å
387	E	91.6	Very high	92.7	Very high	32 Å²	32	47.3 Å²	47.3	15%	0.15	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	151	-177.8	-73.8	-71.9	170.2	0	0	109.4	C382 C385 R450 L454	C382-E387 WeakPolarHBondContact CB-O 3.46Å; C382-E387 PolarHBondContact N-O 3.36Å; C385-E387 WeakPolarHBondContact O-CG 3.43Å; C385-E387 PolarHBondContact O-N 2.77Å; E387-R450 IonicContact OE1-CZ 2.71Å; E387-R450 IonicContact OE1-NE 2.92Å; E387-R450 PolarHBondContact OE1-NE 3.02Å; E387-R450 IonicContact OE1-NH2 2.66Å; E387-R450 PolarHBondContact OE1-NH2 3.21Å; E387-R450 IonicContact OE2-NE 2.63Å; E387-L454 HydrophobicContact CB-CD1 4.42Å; E387-L454 HydrophobicContact CG-CD1 3.7Å; E387-L454 WeakPolarHBondContact OE2-CD1 3.35Å
388	L	92.6	Very high	93.2	Very high	17 Å²	17	46.3 Å²	46.3	9%	0.089	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	138.7	177	-59.9	177.6	0	0	0	111.3	L376 L380 Q381 I390 I436 V440 R451	L376-L388 HydrophobicContact CB-CD2 3.85Å; L376-L388 HydrophobicContact CD2-CD1 4.15Å; L376-L388 HydrophobicContact CD2-CD2 4.06Å; L376-L388 WeakPolarHBondContact O-CD2 3.18Å; L380-L388 HydrophobicContact CB-CD2 4.43Å; L380-L388 WeakPolarHBondContact O-CA 3.38Å; Q381-L388 HydrophobicContact CG-CD2 4.21Å; L388-I390 PolarHBondContact O-N 3.01Å; L388-I390 VanDerWaalsContact O-N 3.15Å; L388-I436 HydrophobicContact CB-CG2 4.19Å; L388-I436 HydrophobicContact CD1-CG2 4.32Å; L388-V440 HydrophobicContact CD1-CG2 3.96Å; L388-R451 PolarHBondContact O-NH1 3.44Å
389	F	94.1	Very high	93.7	Very high	12 Å²	12	43.8 Å²	43.8	5%	0.053	24%	0.239	C	C	.	.			trans	-51.8	124.3	-174.1	-62.9	-69.9	0	0	0	112.5	L380 Q381 C382 A392 S400 I436 R451	L380-F389 WeakPolarHBondContact O-CD2 3.34Å; L380-F389 PolarHBondContact O-N 3.4Å; Q381-F389 WeakPolarHBondContact O-CZ 3.4Å; C382-F389 HydrophobicContact CB-CD1 3.62Å; C382-F389 HydrophobicContact CB-CE1 3.66Å; F389-A392 HydrophobicContact CB-CB 3.92Å; F389-A392 HydrophobicContact CG-CB 4.36Å; F389-S400 WeakPolarHBondContact CE1-O 3.46Å; F389-I436 HydrophobicContact CB-CD1 3.65Å; F389-I436 HydrophobicContact CD2-CD1 4.11Å; F389-I436 HydrophobicContact CG-CD1 4.39Å; F389-R451 PolarHBondContact O-NH1 3.17Å; F389-R451 PolarHBondContact O-NH2 3.26Å; F389-R451 VanDerWaalsContact O-NH2 3.15Å
390	I	94.1	Very high	94.1	Very high	9 Å²	9	38.5 Å²	38.5	5%	0.046	22%	0.218	C	C	.	.	S	Bend	trans	-108.3	111.8	172.1	-68.2	171.2	0	0	0	106.6	L388 C402 S403 L454 V455	L388-I390 PolarHBondContact O-N 3.01Å; L388-I390 VanDerWaalsContact O-N 3.15Å; I390-C402 PolarHBondContact N-SG 3.4Å; I390-C402 WeakPolarHBondContact O-CA 3.42Å; I390-C402 WeakPolarHBondContact O-CB 3.33Å; I390-S403 PolarHBondContact O-N 2.74Å; I390-L454 HydrophobicContact CD1-CB 3.71Å; I390-V455 HydrophobicContact CB-CG2 4.47Å; I390-V455 HydrophobicContact CD1-CG2 3.71Å; I390-V455 HydrophobicContact CG1-CG2 3.74Å; I390-V455 HydrophobicContact CG2-CG2 3.95Å
391	E	94.1	Very high	94.3	Very high	63 Å²	63	37.8 Å²	37.8	29%	0.294	22%	0.215	S	C	.	.	S	Bend	trans	56.2	71.1	-173.5	-51.2	-171.4	123.2	0	0	110.3	V393 S403 R428 D433	E391-V393 PolarHBondContact O-N 3.17Å; E391-S403 VanDerWaalsContact O-CB 3.25Å; E391-S403 WeakPolarHBondContact O-CB 3.3Å; E391-S403 PolarHBondContact O-N 3.15Å; E391-R428 VanDerWaalsContact CD-CZ 3.48Å; E391-R428 IonicContact OE1-CZ 2.68Å; E391-R428 IonicContact OE1-NH1 3.59Å; E391-R428 PolarHBondContact OE1-NH1 3.11Å; E391-R428 IonicContact OE1-NH2 3.86Å; E391-R428 IonicContact OE2-CZ 2.65Å; E391-R428 IonicContact OE2-NH1 2.67Å; E391-R428 PolarHBondContact OE2-NH1 3.44Å; E391-R428 IonicContact OE2-NH2 3.46Å; E391-R428 PolarHBondContact OE2-NH2 3.04Å; E391-D433 VanDerWaalsContact CA-OD1 3.22Å; E391-D433 WeakPolarHBondContact CA-OD1 3.37Å; E391-D433 PolarHBondContact N-OD1 2.8Å
392	A	96.3	Very high	94.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	130.7	-173	0	0	0	0	0	111.8	F389 R428 C429 L432 D433	F389-A392 HydrophobicContact CB-CB 3.92Å; F389-A392 HydrophobicContact CG-CB 4.36Å; A392-R428 CarbonylContact O-C 3.5Å; A392-R428 VanDerWaalsContact O-CA 3.29Å; A392-R428 WeakPolarHBondContact O-CA 3.3Å; A392-C429 HydrophobicContact CB-CB 4.32Å; A392-C429 PolarHBondContact O-N 3.41Å; A392-L432 HydrophobicContact CB-CB 3.78Å; A392-L432 HydrophobicContact CB-CD1 4.08Å; A392-D433 PolarHBondContact N-OD1 3.05Å; A392-D433 PolarHBondContact N-OD2 3.11Å
393	V	96.3	Very high	94.6	Very high	6 Å²	6	35.5 Å²	35.5	4%	0.036	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	124.2	178.2	170.5	0	0	0	0	109.4	E391 L395 S400 F401 I406 Q426 T427 R428	E391-V393 PolarHBondContact O-N 3.17Å; V393-L395 HydrophobicContact CG1-CD2 4.25Å; V393-S400 CarbonylContact O-C 3.59Å; V393-S400 WeakPolarHBondContact O-CA 3.29Å; V393-F401 PolarHBondContact N-O 2.91Å; V393-F401 PolarHBondContact O-N 3Å; V393-I406 HydrophobicContact CB-CG2 4.41Å; V393-I406 HydrophobicContact CG1-CG2 4.27Å; V393-Q426 HydrophobicContact CG1-CB 3.74Å; V393-Q426 HydrophobicContact CG1-CG 4.48Å; V393-T427 WeakPolarHBondContact CA-O 3.25Å; V393-R428 HydrophobicContact CG2-CG 3.92Å
394	I	96.9	Very high	94.8	Very high	54 Å²	54	34.3 Å²	34.3	28%	0.277	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	136.6	174.1	-61.4	175	0	0	0	108.6	Q426 T427 C429 L432	I394-Q426 WeakPolarHBondContact O-CA 3.43Å; I394-T427 PolarHBondContact N-O 3Å; I394-T427 PolarHBondContact O-N 2.87Å; I394-C429 HydrophobicContact CD1-CB 3.64Å; I394-C429 HydrophobicContact CG1-CB 3.93Å; I394-L432 HydrophobicContact CD1-CD1 4.47Å
395	L	96.6	Very high	94.9	Very high	7 Å²	7	31.7 Å²	31.7	4%	0.037	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	169.2	177.7	-57.4	-174.6	0	0	0	112.6	V393 C397 A398 H399 F401 I406 C416 I423 S425 Q426	V393-L395 HydrophobicContact CG1-CD2 4.25Å; L395-C397 PolarHBondContact O-N 3.49Å; L395-A398 WeakPolarHBondContact O-CA 3.49Å; L395-A398 PolarHBondContact O-N 2.75Å; L395-H399 PolarHBondContact N-O 2.96Å; L395-F401 HydrophobicContact CD1-CD2 3.86Å; L395-F401 HydrophobicContact CD1-CE2 3.57Å; L395-F401 HydrophobicContact CG-CD2 4.07Å; L395-F401 HydrophobicContact CG-CE2 4.11Å; L395-I406 HydrophobicContact CD1-CD1 4.13Å; L395-I406 HydrophobicContact CD1-CG1 4.33Å; L395-I406 HydrophobicContact CD2-CG1 4.21Å; L395-C416 HydrophobicContact CD1-CB 4.23Å; L395-I423 HydrophobicContact CD1-CD1 3.87Å; L395-I423 HydrophobicContact CD1-CG1 4.05Å; L395-I423 HydrophobicContact CD2-CG2 3.96Å; L395-S425 WeakPolarHBondContact CA-O 3.33Å; L395-Q426 HydrophobicContact CD2-CB 3.76Å
396	N	96	Very high	95	Very high	45 Å²	45	30 Å²	30	24%	0.241	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-17.8	170.9	56	-76.3	0	0	0	114.7	A422 I423 Q424 S425	N396-A422 PolarHBondContact ND2-O 3.49Å; N396-I423 WeakPolarHBondContact OD1-CA 3.47Å; N396-Q424 HydrophobicContact CB-CB 4.41Å; N396-Q424 PolarHBondContact OD1-N 2.99Å; N396-S425 PolarHBondContact N-O 3.35Å; N396-S425 VanDerWaalsContact N-O 3.11Å; N396-S425 PolarHBondContact OD1-N 3.5Å; N396-S425 PolarHBondContact OD1-O 2.82Å
397	C	95.8	Very high	95.1	Very high	15 Å²	15	30.4 Å²	30.4	10%	0.101	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	18	173.7	63.4	0	0	0	0	113.8	L395 H399 Q421	L395-C397 PolarHBondContact O-N 3.49Å; C397-H399 PolarHBondContact O-CE1 3.03Å; C397-H399 PolarHBondContact O-N 3.21Å; C397-H399 PolarHBondContact O-ND1 2.96Å; C397-Q421 HydrophobicContact CB-CB 4.12Å; C397-Q421 HydrophobicContact CB-CG 4.42Å
398	A	94.7	Very high	95.2	Very high	77 Å²	77	32.1 Å²	32.1	64%	0.636	17%	0.171	S	C	*	.	S	Bend	trans	61.1	-1.8	-178	0	0	0	0	0	117.4	L395	L395-A398 WeakPolarHBondContact O-CA 3.49Å; L395-A398 PolarHBondContact O-N 2.75Å
399	H	95.8	Very high	95.3	Very high	57 Å²	57	35.6 Å²	35.6	26%	0.264	18%	0.183	S	C	.	.			trans	-76.4	141.4	177.7	-66.7	84.7	0	0	0	112.3	L395 C397 F401 I418 C419	L395-H399 PolarHBondContact N-O 2.96Å; C397-H399 PolarHBondContact O-CE1 3.03Å; C397-H399 PolarHBondContact O-N 3.21Å; C397-H399 PolarHBondContact O-ND1 2.96Å; H399-F401 HydrophobicContact CB-CE2 3.67Å; H399-F401 HydrophobicContact CB-CZ 3.97Å; H399-I418 HydrophobicContact CB-CD1 4.27Å; H399-I418 WeakPolarHBondContact NE2-CG2 3.19Å; H399-C419 VanDerWaalsContact CE1-SG 3.58Å
400	S	95.6	Very high	95.3	Very high	32 Å²	32	38.5 Å²	38.5	22%	0.224	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	139.8	-174.1	-61.7	0	0	0	0	113.1	F389 V393	F389-S400 WeakPolarHBondContact CE1-O 3.46Å; V393-S400 CarbonylContact O-C 3.59Å; V393-S400 WeakPolarHBondContact O-CA 3.29Å
401	F	96.4	Very high	95.2	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	162.4	178.6	-56.2	-81.5	0	0	0	111.3	I383 I384 V393 L395 H399 I406 P417 I418	I383-F401 HydrophobicContact CG2-CD1 4.19Å; I383-F401 HydrophobicContact CG2-CE1 3.69Å; I384-F401 HydrophobicContact CD1-CB 4.29Å; I384-F401 HydrophobicContact CD1-CD1 3.47Å; I384-F401 VanDerWaalsContact CD1-CD1 3.47Å; I384-F401 HydrophobicContact CD1-CE1 4.13Å; I384-F401 HydrophobicContact CD1-CG 4.1Å; I384-F401 HydrophobicContact CG1-CD1 3.82Å; I384-F401 HydrophobicContact CG1-CE1 4.22Å; V393-F401 PolarHBondContact N-O 2.91Å; V393-F401 PolarHBondContact O-N 3Å; L395-F401 HydrophobicContact CD1-CD2 3.86Å; L395-F401 HydrophobicContact CD1-CE2 3.57Å; L395-F401 HydrophobicContact CG-CD2 4.07Å; L395-F401 HydrophobicContact CG-CE2 4.11Å; H399-F401 HydrophobicContact CB-CE2 3.67Å; H399-F401 HydrophobicContact CB-CZ 3.97Å; F401-I406 HydrophobicContact CB-CB 3.86Å; F401-I406 HydrophobicContact CB-CG1 4.45Å; F401-I406 HydrophobicContact CB-CG2 4.4Å; F401-I406 HydrophobicContact CD2-CD1 4.04Å; F401-I406 HydrophobicContact CD2-CG1 4.29Å; F401-I406 HydrophobicContact CE2-CD1 4.42Å; F401-I406 HydrophobicContact CG-CB 4.34Å; F401-I406 HydrophobicContact CG-CD1 4.18Å; F401-I406 HydrophobicContact CG-CG1 4.45Å; F401-P417 HydrophobicContact CD1-CG 4.42Å; F401-P417 HydrophobicContact CE1-CB 3.99Å; F401-P417 HydrophobicContact CE1-CG 3.77Å; F401-P417 HydrophobicContact CZ-CB 4.24Å; F401-P417 HydrophobicContact CZ-CG 3.97Å; F401-I418 HydrophobicContact CE1-CD1 3.97Å; F401-I418 HydrophobicContact CE1-CG1 4.18Å; F401-I418 HydrophobicContact CZ-CD1 3.78Å; F401-I418 HydrophobicContact CZ-CG1 3.99Å
402	C	96.4	Very high	95.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	139.1	165.9	-61	0	0	0	0	110.3	C382 I390 Y404 C405 I406 R458	C382-C402 WeakPolarHBondContact CB-SG 3.47Å; C382-C402 PolarHBondContact SG-N 2.93Å; C382-C402 VanDerWaalsContact SG-SG 3.63Å; I390-C402 PolarHBondContact N-SG 3.4Å; I390-C402 WeakPolarHBondContact O-CA 3.42Å; I390-C402 WeakPolarHBondContact O-CB 3.33Å; C402-Y404 PolarHBondContact O-N 3.42Å; C402-Y404 VanDerWaalsContact O-N 3.15Å; C402-C405 HydrophobicContact CB-CB 4.02Å; C402-C405 PolarHBondContact O-N 2.91Å; C402-I406 PolarHBondContact O-N 3.45Å; C402-R458 PolarHBondContact SG-NH1 3.17Å; C402-R458 VanDerWaalsContact SG-NH1 3.38Å
403	S	95.4	Very high	94.9	Very high	28 Å²	28	54.6 Å²	54.6	20%	0.196	27%	0.268	C	S	.	.	H	α-helix	trans	-53.6	-37.8	179.6	-172	0	0	0	0	113.4	I390 E391 K407 R428	I390-S403 PolarHBondContact O-N 2.74Å; E391-S403 VanDerWaalsContact O-CB 3.25Å; E391-S403 WeakPolarHBondContact O-CB 3.3Å; E391-S403 PolarHBondContact O-N 3.15Å; S403-K407 WeakPolarHBondContact O-CB 3.08Å; S403-K407 PolarHBondContact O-N 2.99Å; S403-R428 VanDerWaalsContact CB-NH2 3.31Å; S403-R428 PolarHBondContact OG-NH2 2.91Å
404	Y	94.9	Very high	94.7	Very high	88 Å²	88	58.1 Å²	58.1	35%	0.345	29%	0.286	S	S	.	.	H	α-helix	trans	-68.5	-49.9	175.9	175.6	-98.5	0	0	0	112	C402 I406 K407 Q408 R458	C402-Y404 PolarHBondContact O-N 3.42Å; C402-Y404 VanDerWaalsContact O-N 3.15Å; Y404-I406 PolarHBondContact O-N 2.92Å; Y404-K407 PolarHBondContact O-N 2.8Å; Y404-Q408 HydrophobicContact CD1-CG 4.48Å; Y404-Q408 HydrophobicContact CD2-CG 4.49Å; Y404-Q408 HydrophobicContact CE1-CG 4.05Å; Y404-Q408 HydrophobicContact CE2-CG 4.06Å; Y404-Q408 WeakPolarHBondContact O-CG 3.15Å; Y404-Q408 PolarHBondContact O-N 3.21Å; Y404-R458 HydrophobicContact CD1-CG 4.18Å; Y404-R458 HydrophobicContact CG-CG 4.16Å
405	C	95.6	Very high	94.7	Very high	8 Å²	8	59.8 Å²	59.8	5%	0.054	29%	0.293	C	S	.	.	H	α-helix	trans	-64.6	-41.1	-173.8	-61.8	0	0	0	0	112.2	I384 C385 C402 Q408 W409	I384-C405 HydrophobicContact CB-CB 3.89Å; I384-C405 HydrophobicContact CD1-CB 3.85Å; I384-C405 HydrophobicContact CG1-CB 4.48Å; I384-C405 HydrophobicContact CG2-CB 3.82Å; C385-C405 VanDerWaalsContact SG-SG 3.6Å; C402-C405 HydrophobicContact CB-CB 4.02Å; C402-C405 PolarHBondContact O-N 2.91Å; C405-Q408 PolarHBondContact O-N 3.08Å; C405-W409 PolarHBondContact O-N 3.43Å
406	I	95.5	Very high	94.7	Very high	2 Å²	2	59.5 Å²	59.5	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-71.6	-35.8	177.4	-163.8	58.4	0	0	0	112	I384 V393 L395 F401 C402 Y404 Q408 W409 R410 P417 I423	I384-I406 HydrophobicContact CD1-CD1 4.41Å; V393-I406 HydrophobicContact CB-CG2 4.41Å; V393-I406 HydrophobicContact CG1-CG2 4.27Å; L395-I406 HydrophobicContact CD1-CD1 4.13Å; L395-I406 HydrophobicContact CD1-CG1 4.33Å; L395-I406 HydrophobicContact CD2-CG1 4.21Å; F401-I406 HydrophobicContact CB-CB 3.86Å; F401-I406 HydrophobicContact CB-CG1 4.45Å; F401-I406 HydrophobicContact CB-CG2 4.4Å; F401-I406 HydrophobicContact CD2-CD1 4.04Å; F401-I406 HydrophobicContact CD2-CG1 4.29Å; F401-I406 HydrophobicContact CE2-CD1 4.42Å; F401-I406 HydrophobicContact CG-CB 4.34Å; F401-I406 HydrophobicContact CG-CD1 4.18Å; F401-I406 HydrophobicContact CG-CG1 4.45Å; C402-I406 PolarHBondContact O-N 3.45Å; Y404-I406 PolarHBondContact O-N 2.92Å; I406-Q408 PolarHBondContact O-N 2.74Å; I406-W409 HydrophobicContact CD1-CB 4.34Å; I406-W409 PolarHBondContact O-N 3.36Å; I406-R410 WeakPolarHBondContact O-CG 3.48Å; I406-R410 PolarHBondContact O-N 3.42Å; I406-P417 HydrophobicContact CD1-CG 4.13Å; I406-I423 HydrophobicContact CD1-CD1 4.05Å; I406-I423 HydrophobicContact CG1-CD1 4.49Å
407	K	93.5	Very high	94.6	Very high	86 Å²	86	59.2 Å²	59.2	37%	0.374	29%	0.292	S	S	.	.	H	α-helix	trans	-57.4	-47.8	171.8	-175.8	-176.4	174.4	-173.3	0	111.2	S403 Y404 W409 R410 N411 E465	S403-K407 WeakPolarHBondContact O-CB 3.08Å; S403-K407 PolarHBondContact O-N 2.99Å; Y404-K407 PolarHBondContact O-N 2.8Å; K407-W409 VanDerWaalsContact C-N 3.31Å; K407-W409 PolarHBondContact O-N 2.8Å; K407-R410 PolarHBondContact O-N 3.25Å; K407-N411 PolarHBondContact O-N 2.8Å; K407-N411 PolarHBondContact O-OD1 3.07Å; K407-E465 WeakPolarHBondContact CE-OE1 3.35Å; K407-E465 IonicContact NZ-OE1 2.68Å; K407-E465 PolarHBondContact NZ-OE1 2.88Å; K407-E465 IonicContact NZ-OE2 2.64Å; K407-E465 PolarHBondContact NZ-OE2 3.33Å
408	Q	93.3	Very high	94.5	Very high	69 Å²	69	62.2 Å²	62.2	32%	0.322	31%	0.306	S	S	.	.	H	α-helix	trans	-68.2	-27.1	178.4	-65.6	-60.8	-9	0	0	113.8	Y404 C405 I406 N411	Y404-Q408 HydrophobicContact CD1-CG 4.48Å; Y404-Q408 HydrophobicContact CD2-CG 4.49Å; Y404-Q408 HydrophobicContact CE1-CG 4.05Å; Y404-Q408 HydrophobicContact CE2-CG 4.06Å; Y404-Q408 WeakPolarHBondContact O-CG 3.15Å; Y404-Q408 PolarHBondContact O-N 3.21Å; C405-Q408 PolarHBondContact O-N 3.08Å; I406-Q408 PolarHBondContact O-N 2.74Å; Q408-N411 PolarHBondContact OE1-ND2 3.33Å
409	W	94.8	Very high	94.6	Very high	90 Å²	90	61.1 Å²	61.1	34%	0.341	29%	0.294	S	S	.	.	H	α-helix	trans	-72.1	-43.9	172.1	-179.5	-93.3	0	0	0	112.4	C405 I406 K407 N411 K412 K413 E415 P417	C405-W409 PolarHBondContact O-N 3.43Å; I406-W409 HydrophobicContact CD1-CB 4.34Å; I406-W409 PolarHBondContact O-N 3.36Å; K407-W409 VanDerWaalsContact C-N 3.31Å; K407-W409 PolarHBondContact O-N 2.8Å; W409-N411 PolarHBondContact O-N 3.41Å; W409-K412 WeakPolarHBondContact O-CA 3.4Å; W409-K412 WeakPolarHBondContact O-CB 3.29Å; W409-K412 PolarHBondContact O-N 3.48Å; W409-K413 HydrophobicContact CZ2-CD 4.5Å; W409-K413 PolarHBondContact NE1-O 3.24Å; W409-K413 PolarHBondContact O-N 2.84Å; W409-E415 PolarHBondContact NE1-O 2.85Å; W409-P417 HydrophobicContact CD2-CG 3.94Å; W409-P417 HydrophobicContact CG-CG 3.92Å; W409-P417 HydrophobicContact CZ2-CB 4.42Å; W409-P417 HydrophobicContact CZ2-CG 4.44Å
410	R	93.7	Very high	94.5	Very high	73 Å²	73	67.6 Å²	67.6	28%	0.275	32%	0.316	S	S	.	.	H	α-helix	trans	-58.9	-32.1	178.6	-70.5	-173.6	75.6	171.1	8.7	112.9	I406 K407 K412 K413 D414 I423	I406-R410 WeakPolarHBondContact O-CG 3.48Å; I406-R410 PolarHBondContact O-N 3.42Å; K407-R410 PolarHBondContact O-N 3.25Å; R410-K412 PolarHBondContact O-N 3.15Å; R410-K412 VanDerWaalsContact O-N 3.08Å; R410-K413 WeakPolarHBondContact CA-O 3.22Å; R410-D414 IonicContact CZ-OD1 3.14Å; R410-D414 IonicContact CZ-OD2 3.88Å; R410-D414 IonicContact NE-OD1 2.64Å; R410-D414 PolarHBondContact NE-OD1 2.9Å; R410-D414 IonicContact NE-OD2 3.98Å; R410-D414 VanDerWaalsContact NH2-CG 3.29Å; R410-D414 IonicContact NH2-OD1 2.86Å; R410-D414 PolarHBondContact NH2-OD1 2.79Å; R410-D414 IonicContact NH2-OD2 2.9Å; R410-D414 PolarHBondContact NH2-OD2 2.88Å; R410-I423 HydrophobicContact CG-CD1 3.89Å; R410-I423 PolarHBondContact NH2-O 3.27Å
411	N	91.3	Very high	94.6	Very high	109 Å²	109	70.7 Å²	70.7	58%	0.583	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-13.6	171.2	-65.9	-14.9	0	0	0	114.2	K407 Q408 W409	K407-N411 PolarHBondContact O-N 2.8Å; K407-N411 PolarHBondContact O-OD1 3.07Å; Q408-N411 PolarHBondContact OE1-ND2 3.33Å; W409-N411 PolarHBondContact O-N 3.41Å
412	K	91.6	Very high	94.6	Very high	176 Å²	176	73.4 Å²	73.4	77%	0.765	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.1	-41.6	179	-59.1	-179	-177.3	-180	0	112.8	W409 R410	W409-K412 WeakPolarHBondContact O-CA 3.4Å; W409-K412 WeakPolarHBondContact O-CB 3.29Å; W409-K412 PolarHBondContact O-N 3.48Å; R410-K412 PolarHBondContact O-N 3.15Å; R410-K412 VanDerWaalsContact O-N 3.08Å
413	K	92.2	Very high	94.5	Very high	125 Å²	125	73.8 Å²	73.8	54%	0.543	35%	0.351	S	S	.	.			trans	-150.7	128.5	178.8	-65.8	-170.2	177.3	-171.5	0	110.6	W409 R410 E415	W409-K413 HydrophobicContact CZ2-CD 4.5Å; W409-K413 PolarHBondContact NE1-O 3.24Å; W409-K413 PolarHBondContact O-N 2.84Å; R410-K413 WeakPolarHBondContact CA-O 3.22Å; K413-E415 PolarHBondContact O-N 3.42Å; K413-E415 VanDerWaalsContact O-N 3.08Å
414	D	93.9	Very high	94.5	Very high	79 Å²	79	80.2 Å²	80.2	42%	0.422	38%	0.378	S	S	.	.	S	Bend	trans	-87.7	40.2	-179.2	-151.1	15	0	0	0	114.1	R410 I423	R410-D414 IonicContact CZ-OD1 3.14Å; R410-D414 IonicContact CZ-OD2 3.88Å; R410-D414 IonicContact NE-OD1 2.64Å; R410-D414 PolarHBondContact NE-OD1 2.9Å; R410-D414 IonicContact NE-OD2 3.98Å; R410-D414 VanDerWaalsContact NH2-CG 3.29Å; R410-D414 IonicContact NH2-OD1 2.86Å; R410-D414 PolarHBondContact NH2-OD1 2.79Å; R410-D414 IonicContact NH2-OD2 2.9Å; R410-D414 PolarHBondContact NH2-OD2 2.88Å; D414-I423 PolarHBondContact O-N 2.76Å
415	E	96.2	Very high	94.4	Very high	90 Å²	90	78.9 Å²	78.9	42%	0.421	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-126	144	-176.3	-69.1	175.9	-179.2	0	0	110	W409 K413 P417	W409-E415 PolarHBondContact NE1-O 2.85Å; K413-E415 PolarHBondContact O-N 3.42Å; K413-E415 VanDerWaalsContact O-N 3.08Å; E415-P417 WeakPolarHBondContact O-CD 3.34Å
416	C	96.3	Very high	94.4	Very high	1 Å²	1	83 Å²	83	1%	0.007	40%	0.4	C	S	.	.			trans	-58.5	126.7	176.2	177.6	0	0	0	0	111.6	L395 I418 R420 Q421	L395-C416 HydrophobicContact CD1-CB 4.23Å; C416-I418 PolarHBondContact O-N 3.07Å; C416-R420 WeakPolarHBondContact O-CA 3.43Å; C416-R420 PolarHBondContact O-N 3.2Å; C416-Q421 WeakPolarHBondContact CB-O 3.13Å; C416-Q421 PolarHBondContact N-O 3.42Å
417	P	94.3	Very high	94.4	Very high	38 Å²	38	87.4 Å²	87.4	25%	0.247	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-29.6	178.4	-27.4	31.6	0	0	0	115.5	I384 F401 I406 W409 E415	I384-P417 HydrophobicContact CD1-CG 4.02Å; I384-P417 HydrophobicContact CG1-CG 4.26Å; F401-P417 HydrophobicContact CD1-CG 4.42Å; F401-P417 HydrophobicContact CE1-CB 3.99Å; F401-P417 HydrophobicContact CE1-CG 3.77Å; F401-P417 HydrophobicContact CZ-CB 4.24Å; F401-P417 HydrophobicContact CZ-CG 3.97Å; I406-P417 HydrophobicContact CD1-CG 4.13Å; W409-P417 HydrophobicContact CD2-CG 3.94Å; W409-P417 HydrophobicContact CG-CG 3.92Å; W409-P417 HydrophobicContact CZ2-CB 4.42Å; W409-P417 HydrophobicContact CZ2-CG 4.44Å; E415-P417 WeakPolarHBondContact O-CD 3.34Å
418	I	94.3	Very high	94.5	Very high	78 Å²	78	88.7 Å²	88.7	40%	0.4	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-60.3	-175.1	-60.4	168.7	0	0	0	110.9	I383 H399 F401 C416	I383-I418 HydrophobicContact CD1-CG1 4.25Å; I383-I418 HydrophobicContact CG2-CD1 4Å; I383-I418 HydrophobicContact CG2-CG1 4.07Å; H399-I418 HydrophobicContact CB-CD1 4.27Å; H399-I418 WeakPolarHBondContact NE2-CG2 3.19Å; F401-I418 HydrophobicContact CE1-CD1 3.97Å; F401-I418 HydrophobicContact CE1-CG1 4.18Å; F401-I418 HydrophobicContact CZ-CD1 3.78Å; F401-I418 HydrophobicContact CZ-CG1 3.99Å; C416-I418 PolarHBondContact O-N 3.07Å
419	C	95.4	Very high	94.5	Very high	55 Å²	55	86.7 Å²	86.7	37%	0.372	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-2.1	-172.9	64	0	0	0	0	115.3	H399 Q421	H399-C419 VanDerWaalsContact CE1-SG 3.58Å; C419-Q421 PolarHBondContact O-N 3.02Å
420	R	94.9	Very high	94.5	Very high	193 Å²	193	87.8 Å²	87.8	73%	0.728	43%	0.434	S	S	*	.			trans	59.5	7.6	-178.2	-50.2	-177.1	-171.3	179.4	2.7	116.2	C416	C416-R420 WeakPolarHBondContact O-CA 3.43Å; C416-R420 PolarHBondContact O-N 3.2Å
421	Q	96.3	Very high	94.5	Very high	97 Å²	97	87.8 Å²	87.8	45%	0.453	45%	0.45	S	S	.	.			trans	-64.7	136.4	172.1	-172.3	175.6	-3.3	0	0	110.6	C397 C416 C419	C397-Q421 HydrophobicContact CB-CB 4.12Å; C397-Q421 HydrophobicContact CB-CG 4.42Å; C416-Q421 WeakPolarHBondContact CB-O 3.13Å; C416-Q421 PolarHBondContact N-O 3.42Å; C419-Q421 PolarHBondContact O-N 3.02Å
422	A	96.1	Very high	94.6	Very high	56 Å²	56	84.5 Å²	84.5	46%	0.463	43%	0.432	S	S	.	.	B	Isolated β-bridge	trans	-59	141.5	178.4	0	0	0	0	0	112.5	N396 Q424	N396-A422 PolarHBondContact ND2-O 3.49Å; A422-Q424 PolarHBondContact O-N 2.91Å
423	I	95.8	Very high	94.6	Very high	9 Å²	9	77 Å²	77	5%	0.046	40%	0.401	C	S	.	.			trans	-89.8	95.3	-171.8	-55.6	178.4	0	0	0	110.7	L395 N396 I406 R410 D414	L395-I423 HydrophobicContact CD1-CD1 3.87Å; L395-I423 HydrophobicContact CD1-CG1 4.05Å; L395-I423 HydrophobicContact CD2-CG2 3.96Å; N396-I423 WeakPolarHBondContact OD1-CA 3.47Å; I406-I423 HydrophobicContact CD1-CD1 4.05Å; I406-I423 HydrophobicContact CG1-CD1 4.49Å; R410-I423 HydrophobicContact CG-CD1 3.89Å; R410-I423 PolarHBondContact NH2-O 3.27Å; D414-I423 PolarHBondContact O-N 2.76Å
424	Q	94.3	Very high	94.6	Very high	162 Å²	162	75.4 Å²	75.4	76%	0.757	40%	0.398	S	S	*	.			trans	-88.6	-33.9	-180	-64.5	178.7	-16.7	0	0	112.7	N396 A422	N396-Q424 HydrophobicContact CB-CB 4.41Å; N396-Q424 PolarHBondContact OD1-N 2.99Å; A422-Q424 PolarHBondContact O-N 2.91Å
425	S	93.3	Very high	94.4	Very high	60 Å²	60	73.6 Å²	73.6	42%	0.42	39%	0.391	S	S	.	.			trans	-147.9	153.8	177.5	68.9	0	0	0	0	111.8	L395 N396	L395-S425 WeakPolarHBondContact CA-O 3.33Å; N396-S425 PolarHBondContact N-O 3.35Å; N396-S425 VanDerWaalsContact N-O 3.11Å; N396-S425 PolarHBondContact OD1-N 3.5Å; N396-S425 PolarHBondContact OD1-O 2.82Å
426	Q	94.7	Very high	94.2	Very high	96 Å²	96	69.3 Å²	69.3	45%	0.449	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	128.8	-179.9	71.7	-170.6	19.8	0	0	108.6	V393 I394 L395	V393-Q426 HydrophobicContact CG1-CB 3.74Å; V393-Q426 HydrophobicContact CG1-CG 4.48Å; I394-Q426 WeakPolarHBondContact O-CA 3.43Å; L395-Q426 HydrophobicContact CD2-CB 3.76Å
427	T	96	Very high	93.8	Very high	93 Å²	93	73 Å²	73	57%	0.571	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.8	132.2	-171.8	-56.8	0	0	0	0	110.2	V393 I394	V393-T427 WeakPolarHBondContact CA-O 3.25Å; I394-T427 PolarHBondContact N-O 3Å; I394-T427 PolarHBondContact O-N 2.87Å
428	R	95.3	Very high	93.6	Very high	114 Å²	114	78.8 Å²	78.8	43%	0.43	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	130.3	176.8	-74.7	-159.6	172.6	-165.6	-7.1	111.6	E391 A392 V393 S403 L430	E391-R428 VanDerWaalsContact CD-CZ 3.48Å; E391-R428 IonicContact OE1-CZ 2.68Å; E391-R428 IonicContact OE1-NH1 3.59Å; E391-R428 PolarHBondContact OE1-NH1 3.11Å; E391-R428 IonicContact OE1-NH2 3.86Å; E391-R428 IonicContact OE2-CZ 2.65Å; E391-R428 IonicContact OE2-NH1 2.67Å; E391-R428 PolarHBondContact OE2-NH1 3.44Å; E391-R428 IonicContact OE2-NH2 3.46Å; E391-R428 PolarHBondContact OE2-NH2 3.04Å; A392-R428 CarbonylContact O-C 3.5Å; A392-R428 VanDerWaalsContact O-CA 3.29Å; A392-R428 WeakPolarHBondContact O-CA 3.3Å; V393-R428 HydrophobicContact CG2-CG 3.92Å; S403-R428 VanDerWaalsContact CB-NH2 3.31Å; S403-R428 PolarHBondContact OG-NH2 2.91Å; R428-L430 PolarHBondContact O-N 3.31Å
429	C	95.1	Very high	93.3	Very high	26 Å²	26	77.6 Å²	77.6	18%	0.176	40%	0.401	C	S	.	.			trans	-100.9	81.1	179.3	-166.4	0	0	0	0	110.8	A392 I394 A431 L432 D433	A392-C429 HydrophobicContact CB-CB 4.32Å; A392-C429 PolarHBondContact O-N 3.41Å; I394-C429 HydrophobicContact CD1-CB 3.64Å; I394-C429 HydrophobicContact CG1-CB 3.93Å; C429-A431 PolarHBondContact O-N 2.87Å; C429-L432 HydrophobicContact CB-CB 4.32Å; C429-L432 HydrophobicContact CB-CD1 4.02Å; C429-L432 HydrophobicContact CB-CG 4.24Å; C429-L432 PolarHBondContact O-N 3.24Å; C429-D433 PolarHBondContact O-N 2.71Å
430	L	94.5	Very high	93	Very high	114 Å²	114	75.7 Å²	75.7	60%	0.597	39%	0.387	S	S	*	.	H	α-helix	trans	-56.7	-22.4	175.9	-58.3	179	0	0	0	112.7	R428 N434	R428-L430 PolarHBondContact O-N 3.31Å; L430-N434 WeakPolarHBondContact O-CB 3.45Å; L430-N434 VanDerWaalsContact O-CG 3.3Å; L430-N434 PolarHBondContact O-N 2.88Å; L430-N434 PolarHBondContact O-ND2 2.89Å
431	A	93.8	Very high	92.4	Very high	73 Å²	73	73 Å²	73	60%	0.603	38%	0.383	S	S	*	.	H	α-helix	trans	-67.3	-39.4	174.4	0	0	0	0	0	112.5	C429 C435	C429-A431 PolarHBondContact O-N 2.87Å; A431-C435 VanDerWaalsContact O-CB 3.24Å; A431-C435 WeakPolarHBondContact O-CB 3.47Å; A431-C435 PolarHBondContact O-N 2.83Å; A431-C435 VanDerWaalsContact O-N 3.08Å
432	L	91.9	Very high	91.7	Very high	39 Å²	39	73.9 Å²	73.9	20%	0.204	39%	0.391	C	S	.	.	H	α-helix	trans	-71.7	-45.3	174.9	-70.2	173.6	0	0	0	111	L380 A392 I394 C429 N434 C435 I436	L380-L432 HydrophobicContact CD2-CD2 3.75Å; A392-L432 HydrophobicContact CB-CB 3.78Å; A392-L432 HydrophobicContact CB-CD1 4.08Å; I394-L432 HydrophobicContact CD1-CD1 4.47Å; C429-L432 HydrophobicContact CB-CB 4.32Å; C429-L432 HydrophobicContact CB-CD1 4.02Å; C429-L432 HydrophobicContact CB-CG 4.24Å; C429-L432 PolarHBondContact O-N 3.24Å; L432-N434 PolarHBondContact O-N 2.89Å; L432-C435 WeakPolarHBondContact O-CB 3.45Å; L432-C435 PolarHBondContact O-N 3.36Å; L432-I436 WeakPolarHBondContact O-CG1 3.44Å; L432-I436 PolarHBondContact O-N 3.06Å
433	D	91.2	Very high	91	Very high	20 Å²	20	71.7 Å²	71.7	11%	0.107	37%	0.371	C	S	.	.	H	α-helix	trans	-56.6	-51.2	176.1	-66.5	-44.4	0	0	0	111	E391 A392 C429 C435 I436 D437	E391-D433 VanDerWaalsContact CA-OD1 3.22Å; E391-D433 WeakPolarHBondContact CA-OD1 3.37Å; E391-D433 PolarHBondContact N-OD1 2.8Å; A392-D433 PolarHBondContact N-OD1 3.05Å; A392-D433 PolarHBondContact N-OD2 3.11Å; C429-D433 PolarHBondContact O-N 2.71Å; D433-C435 PolarHBondContact O-N 2.87Å; D433-I436 PolarHBondContact O-N 3.38Å; D433-D437 WeakPolarHBondContact O-CB 3.2Å; D433-D437 PolarHBondContact O-N 3.14Å
434	N	92.3	Very high	90.4	Very high	91 Å²	91	74 Å²	74	49%	0.487	39%	0.388	S	S	.	.	H	α-helix	trans	-68.3	-12.5	175.9	-73.9	-61.6	0	0	0	114.1	L430 L432 R438	L430-N434 WeakPolarHBondContact O-CB 3.45Å; L430-N434 VanDerWaalsContact O-CG 3.3Å; L430-N434 PolarHBondContact O-N 2.88Å; L430-N434 PolarHBondContact O-ND2 2.89Å; L432-N434 PolarHBondContact O-N 2.89Å; N434-R438 VanDerWaalsContact O-CZ 3.32Å; N434-R438 PolarHBondContact O-NE 2.94Å; N434-R438 PolarHBondContact O-NH2 2.71Å
435	C	90.7	Very high	90	Very high	41 Å²	41	71.6 Å²	71.6	28%	0.277	38%	0.38	S	S	.	.	H	α-helix	trans	-85.1	-53.8	173.8	-172.9	0	0	0	0	109.5	A431 L432 D433 D437 R438 M439	A431-C435 VanDerWaalsContact O-CB 3.24Å; A431-C435 WeakPolarHBondContact O-CB 3.47Å; A431-C435 PolarHBondContact O-N 2.83Å; A431-C435 VanDerWaalsContact O-N 3.08Å; L432-C435 WeakPolarHBondContact O-CB 3.45Å; L432-C435 PolarHBondContact O-N 3.36Å; D433-C435 PolarHBondContact O-N 2.87Å; C435-D437 PolarHBondContact O-N 3.41Å; C435-R438 PolarHBondContact O-N 3.06Å; C435-M439 WeakPolarHBondContact O-CG 3.21Å; C435-M439 PolarHBondContact O-N 3.15Å
436	I	91.3	Very high	89.7	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-58.4	-46.9	-179.9	-63.7	161.7	0	0	0	110.5	L376 L380 L388 F389 L432 D433 R438 M439 V440 R451	L376-I436 HydrophobicContact CD2-CG2 4.35Å; L380-I436 HydrophobicContact CB-CD1 4.33Å; L380-I436 HydrophobicContact CB-CG1 4.15Å; L380-I436 HydrophobicContact CD1-CG1 3.96Å; L380-I436 HydrophobicContact CD2-CD1 4.47Å; L380-I436 HydrophobicContact CD2-CG1 4.31Å; L380-I436 HydrophobicContact CG-CG1 4.37Å; L388-I436 HydrophobicContact CB-CG2 4.19Å; L388-I436 HydrophobicContact CD1-CG2 4.32Å; F389-I436 HydrophobicContact CB-CD1 3.65Å; F389-I436 HydrophobicContact CD2-CD1 4.11Å; F389-I436 HydrophobicContact CG-CD1 4.39Å; L432-I436 WeakPolarHBondContact O-CG1 3.44Å; L432-I436 PolarHBondContact O-N 3.06Å; D433-I436 PolarHBondContact O-N 3.38Å; I436-R438 VanDerWaalsContact C-N 3.34Å; I436-R438 PolarHBondContact O-N 3.42Å; I436-M439 PolarHBondContact O-N 3.4Å; I436-V440 HydrophobicContact CG2-CG2 3.91Å; I436-V440 VanDerWaalsContact O-CB 3.29Å; I436-V440 WeakPolarHBondContact O-CB 3.39Å; I436-V440 WeakPolarHBondContact O-CG2 3.43Å; I436-V440 PolarHBondContact O-N 2.88Å; I436-R451 VanDerWaalsContact CG2-CZ 3.42Å
437	D	89.4	Confident	89.1	Confident	78 Å²	78	70.2 Å²	70.2	42%	0.417	37%	0.37	S	S	.	.	H	α-helix	trans	-64.3	-37.5	-176.4	-70.6	-12.8	0	0	0	112.1	D433 C435 V440 E441 R451	D433-D437 WeakPolarHBondContact O-CB 3.2Å; D433-D437 PolarHBondContact O-N 3.14Å; C435-D437 PolarHBondContact O-N 3.41Å; D437-V440 PolarHBondContact O-N 2.75Å; D437-E441 WeakPolarHBondContact O-CG 3.34Å; D437-E441 PolarHBondContact O-N 3.35Å; D437-E441 VanDerWaalsContact O-N 3.11Å; D437-R451 IonicContact OD1-CZ 3.4Å; D437-R451 IonicContact OD1-NE 2.64Å; D437-R451 PolarHBondContact OD1-NE 3.03Å; D437-R451 IonicContact OD1-NH2 3.2Å; D437-R451 PolarHBondContact OD1-NH2 3.37Å
438	R	89.1	Confident	88.8	Confident	159 Å²	159	68.7 Å²	68.7	60%	0.6	36%	0.356	S	S	*	.	H	α-helix	trans	-72.5	-31.4	174.6	-80.9	-177.6	-70.2	-176.7	-1.6	113.9	N434 C435 I436 N442	N434-R438 VanDerWaalsContact O-CZ 3.32Å; N434-R438 PolarHBondContact O-NE 2.94Å; N434-R438 PolarHBondContact O-NH2 2.71Å; C435-R438 PolarHBondContact O-N 3.06Å; I436-R438 VanDerWaalsContact C-N 3.34Å; I436-R438 PolarHBondContact O-N 3.42Å; R438-N442 PolarHBondContact O-ND2 2.91Å; R438-N442 VanDerWaalsContact O-ND2 3.14Å
439	M	88	Confident	88.5	Confident	54 Å²	54	66 Å²	66	27%	0.266	36%	0.358	S	S	.	.	H	α-helix	trans	-71	-45.3	172	-70.9	176.1	167.1	0	0	110.4	V372 V375 L376 L380 C435 I436 E441 N442	V372-M439 HydrophobicContact CG1-CB 4.01Å; V372-M439 HydrophobicContact CG1-CG 4.28Å; V375-M439 HydrophobicContact CG1-CE 4.37Å; L376-M439 HydrophobicContact CD1-CB 4Å; L376-M439 HydrophobicContact CD2-CB 4.03Å; L376-M439 HydrophobicContact CD2-SD 4.05Å; L376-M439 HydrophobicContact CG-CB 4.26Å; L376-M439 HydrophobicContact CG-SD 4.23Å; L380-M439 HydrophobicContact CD1-SD 3.92Å; C435-M439 WeakPolarHBondContact O-CG 3.21Å; C435-M439 PolarHBondContact O-N 3.15Å; I436-M439 PolarHBondContact O-N 3.4Å; M439-E441 VanDerWaalsContact C-N 3.29Å; M439-E441 PolarHBondContact O-N 3.07Å; M439-N442 PolarHBondContact O-N 3.32Å
440	V	88.3	Confident	88.2	Confident	14 Å²	14	71 Å²	71	9%	0.085	37%	0.373	C	S	.	.	H	α-helix	trans	-58.2	-36	178.4	167	0	0	0	0	112.4	L388 I436 D437 N442 L443 K448	L388-V440 HydrophobicContact CD1-CG2 3.96Å; I436-V440 HydrophobicContact CG2-CG2 3.91Å; I436-V440 VanDerWaalsContact O-CB 3.29Å; I436-V440 WeakPolarHBondContact O-CB 3.39Å; I436-V440 WeakPolarHBondContact O-CG2 3.43Å; I436-V440 PolarHBondContact O-N 2.88Å; D437-V440 PolarHBondContact O-N 2.75Å; V440-N442 PolarHBondContact O-N 3.11Å; V440-L443 HydrophobicContact CB-CD1 4.28Å; V440-L443 HydrophobicContact CG2-CD1 3.91Å; V440-L443 PolarHBondContact O-N 3.09Å; V440-L443 VanDerWaalsContact O-N 3.13Å; V440-K448 HydrophobicContact CG1-CG 3.87Å; V440-K448 WeakPolarHBondContact O-CE 3.27Å
441	E	83.8	Confident	88	Confident	138 Å²	138	66.6 Å²	66.6	65%	0.645	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-27.4	173.7	-81.1	177.1	171.7	0	0	113.9	D437 M439 K448	D437-E441 WeakPolarHBondContact O-CG 3.34Å; D437-E441 PolarHBondContact O-N 3.35Å; D437-E441 VanDerWaalsContact O-N 3.11Å; M439-E441 VanDerWaalsContact C-N 3.29Å; M439-E441 PolarHBondContact O-N 3.07Å; E441-K448 WeakPolarHBondContact O-CE 3.4Å; E441-K448 PolarHBondContact O-NZ 3Å
442	N	80.2	Confident	87.8	Confident	114 Å²	114	68.5 Å²	68.5	61%	0.61	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-5.5	-175.3	-66.9	-79.1	0	0	0	114.9	R438 M439 V440	R438-N442 PolarHBondContact O-ND2 2.91Å; R438-N442 VanDerWaalsContact O-ND2 3.14Å; M439-N442 PolarHBondContact O-N 3.32Å; V440-N442 PolarHBondContact O-N 3.11Å
443	L	82.8	Confident	87.8	Confident	10 Å²	10	69.2 Å²	69.2	5%	0.052	36%	0.356	C	S	.	.	S	Bend	trans	-79.5	-177	-176.9	-60.4	176.9	0	0	0	114.7	V372 L376 V440 M447 K448	V372-L443 HydrophobicContact CG1-CD2 4.16Å; L376-L443 HydrophobicContact CD1-CD1 3.51Å; L376-L443 HydrophobicContact CD1-CD2 3.83Å; L376-L443 HydrophobicContact CD1-CG 4.08Å; V440-L443 HydrophobicContact CB-CD1 4.28Å; V440-L443 HydrophobicContact CG2-CD1 3.91Å; V440-L443 PolarHBondContact O-N 3.09Å; V440-L443 VanDerWaalsContact O-N 3.13Å; L443-M447 HydrophobicContact CB-CB 4.4Å; L443-M447 HydrophobicContact CB-SD 4.24Å; L443-M447 HydrophobicContact CD1-CB 4.22Å; L443-M447 HydrophobicContact CD1-CE 3.91Å; L443-M447 HydrophobicContact CD1-SD 3.96Å; L443-M447 HydrophobicContact CD2-SD 4.41Å; L443-M447 HydrophobicContact CG-SD 4.44Å; L443-K448 VanDerWaalsContact O-CE 3.25Å; L443-K448 WeakPolarHBondContact O-CE 3.47Å; L443-K448 PolarHBondContact O-NZ 3.42Å
444	S	83.1	Confident	87.8	Confident	57 Å²	57	69.9 Å²	69.9	40%	0.399	36%	0.36	S	S	.	.			trans	-56.5	160.3	168.2	69.2	0	0	0	0	112.8	M447 K448	S444-M447 VanDerWaalsContact OG-CG 3.3Å; S444-M447 WeakPolarHBondContact OG-CG 3.46Å; S444-M447 PolarHBondContact OG-N 3.28Å; S444-K448 VanDerWaalsContact O-CD 3.3Å; S444-K448 WeakPolarHBondContact O-CD 3.49Å; S444-K448 WeakPolarHBondContact O-CG 3.47Å; S444-K448 PolarHBondContact O-N 3.23Å
445	L	85.5	Confident	87.8	Confident	112 Å²	112	66.5 Å²	66.5	59%	0.586	34%	0.342	S	S	*	.	H	α-helix	trans	-71.4	-34.5	178.5	-63.6	179.3	0	0	0	112.3	V162 K448 A449	V162-L445 HydrophobicContact CG1-CD1 4.22Å; L445-K448 HydrophobicContact CD2-CD 4.43Å; L445-K448 WeakPolarHBondContact O-CB 3.37Å; L445-K448 PolarHBondContact O-N 3.03Å; L445-A449 WeakPolarHBondContact O-CB 3.43Å; L445-A449 PolarHBondContact O-N 3.11Å
446	D	85.9	Confident	87.8	Confident	85 Å²	85	68.1 Å²	68.1	46%	0.455	35%	0.351	S	S	.	.	H	α-helix	trans	-60.8	-55.5	174.8	167	52.4	0	0	0	112.1	K448 A449 R450	D446-K448 PolarHBondContact O-N 3.07Å; D446-K448 VanDerWaalsContact O-N 3.08Å; D446-A449 CarbonylContact O-C 3.56Å; D446-A449 WeakPolarHBondContact O-CA 3.47Å; D446-A449 WeakPolarHBondContact O-CB 3.43Å; D446-A449 PolarHBondContact O-N 3.29Å; D446-R450 WeakPolarHBondContact O-CB 3.35Å; D446-R450 PolarHBondContact O-N 2.86Å
447	M	83.9	Confident	87.8	Confident	43 Å²	43	73.9 Å²	73.9	21%	0.212	38%	0.378	C	S	.	.	H	α-helix	trans	-55.6	-35.9	179.9	-68.6	174.8	91.4	0	0	112.1	T373 L443 S444 R451	T373-M447 HydrophobicContact CG2-CE 4.17Å; L443-M447 HydrophobicContact CB-CB 4.4Å; L443-M447 HydrophobicContact CB-SD 4.24Å; L443-M447 HydrophobicContact CD1-CB 4.22Å; L443-M447 HydrophobicContact CD1-CE 3.91Å; L443-M447 HydrophobicContact CD1-SD 3.96Å; L443-M447 HydrophobicContact CD2-SD 4.41Å; L443-M447 HydrophobicContact CG-SD 4.44Å; S444-M447 VanDerWaalsContact OG-CG 3.3Å; S444-M447 WeakPolarHBondContact OG-CG 3.46Å; S444-M447 PolarHBondContact OG-N 3.28Å; M447-R451 WeakPolarHBondContact O-CB 3.44Å; M447-R451 PolarHBondContact O-N 3.45Å
448	K	89.2	Confident	87.9	Confident	61 Å²	61	71.4 Å²	71.4	27%	0.265	36%	0.363	S	S	.	.	H	α-helix	trans	-65.8	-48	172.6	-69.8	163.8	179.1	164.7	0	111.8	V440 E441 L443 S444 L445 D446 Q452	V440-K448 HydrophobicContact CG1-CG 3.87Å; V440-K448 WeakPolarHBondContact O-CE 3.27Å; E441-K448 WeakPolarHBondContact O-CE 3.4Å; E441-K448 PolarHBondContact O-NZ 3Å; L443-K448 VanDerWaalsContact O-CE 3.25Å; L443-K448 WeakPolarHBondContact O-CE 3.47Å; L443-K448 PolarHBondContact O-NZ 3.42Å; S444-K448 VanDerWaalsContact O-CD 3.3Å; S444-K448 WeakPolarHBondContact O-CD 3.49Å; S444-K448 WeakPolarHBondContact O-CG 3.47Å; S444-K448 PolarHBondContact O-N 3.23Å; L445-K448 HydrophobicContact CD2-CD 4.43Å; L445-K448 WeakPolarHBondContact O-CB 3.37Å; L445-K448 PolarHBondContact O-N 3.03Å; D446-K448 PolarHBondContact O-N 3.07Å; D446-K448 VanDerWaalsContact O-N 3.08Å; K448-Q452 WeakPolarHBondContact O-CB 3.45Å; K448-Q452 PolarHBondContact O-N 2.99Å
449	A	89.3	Confident	87.8	Confident	58 Å²	58	68.9 Å²	68.9	48%	0.479	36%	0.356	S	S	.	.	H	α-helix	trans	-63.1	-48.4	179.3	0	0	0	0	0	111.9	L445 D446 Q452 A453	L445-A449 WeakPolarHBondContact O-CB 3.43Å; L445-A449 PolarHBondContact O-N 3.11Å; D446-A449 CarbonylContact O-C 3.56Å; D446-A449 WeakPolarHBondContact O-CA 3.47Å; D446-A449 WeakPolarHBondContact O-CB 3.43Å; D446-A449 PolarHBondContact O-N 3.29Å; A449-Q452 PolarHBondContact O-N 3.03Å; A449-A453 WeakPolarHBondContact O-CB 3.23Å; A449-A453 PolarHBondContact O-N 3.46Å
450	R	88.1	Confident	87.8	Confident	131 Å²	131	69.1 Å²	69.1	49%	0.494	37%	0.367	S	S	.	.	H	α-helix	trans	-56.7	-52.7	175.8	-179.3	174.7	173.8	162.4	-2.6	112.2	E387 D446 Q452 A453 L454	E387-R450 IonicContact OE1-CZ 2.71Å; E387-R450 IonicContact OE1-NE 2.92Å; E387-R450 PolarHBondContact OE1-NE 3.02Å; E387-R450 IonicContact OE1-NH2 2.66Å; E387-R450 PolarHBondContact OE1-NH2 3.21Å; E387-R450 IonicContact OE2-NE 2.63Å; D446-R450 WeakPolarHBondContact O-CB 3.35Å; D446-R450 PolarHBondContact O-N 2.86Å; R450-Q452 VanDerWaalsContact C-N 3.33Å; R450-Q452 PolarHBondContact O-N 2.84Å; R450-A453 PolarHBondContact O-N 3.26Å; R450-L454 HydrophobicContact CG-CD1 4.35Å; R450-L454 WeakPolarHBondContact O-CG 3.49Å; R450-L454 PolarHBondContact O-N 3.3Å; R450-L454 VanDerWaalsContact O-N 3.14Å
451	R	89.4	Confident	87.4	Confident	20 Å²	20	70.4 Å²	70.4	8%	0.075	38%	0.379	C	S	.	.	H	α-helix	trans	-59	-45	174.3	-179.5	176.9	173.4	78.2	-6.3	111.1	L388 F389 I436 D437 M447 A453 L454 V455	L388-R451 PolarHBondContact O-NH1 3.44Å; F389-R451 PolarHBondContact O-NH1 3.17Å; F389-R451 PolarHBondContact O-NH2 3.26Å; F389-R451 VanDerWaalsContact O-NH2 3.15Å; I436-R451 VanDerWaalsContact CG2-CZ 3.42Å; D437-R451 IonicContact OD1-CZ 3.4Å; D437-R451 IonicContact OD1-NE 2.64Å; D437-R451 PolarHBondContact OD1-NE 3.03Å; D437-R451 IonicContact OD1-NH2 3.2Å; D437-R451 PolarHBondContact OD1-NH2 3.37Å; M447-R451 WeakPolarHBondContact O-CB 3.44Å; M447-R451 PolarHBondContact O-N 3.45Å; R451-A453 VanDerWaalsContact C-N 3.34Å; R451-A453 PolarHBondContact O-N 3.44Å; R451-L454 PolarHBondContact O-N 2.94Å; R451-V455 HydrophobicContact CG-CG2 4.18Å; R451-V455 WeakPolarHBondContact O-CB 3.49Å; R451-V455 WeakPolarHBondContact O-CG2 3.49Å; R451-V455 PolarHBondContact O-N 3.43Å
452	Q	90.8	Very high	87.2	Confident	114 Å²	114	66.1 Å²	66.1	53%	0.533	37%	0.367	S	S	.	.	H	α-helix	trans	-63.8	-38.2	-177.8	-176.2	58.4	87.1	0	0	112.4	K448 A449 R450 T456	K448-Q452 WeakPolarHBondContact O-CB 3.45Å; K448-Q452 PolarHBondContact O-N 2.99Å; A449-Q452 PolarHBondContact O-N 3.03Å; R450-Q452 VanDerWaalsContact C-N 3.33Å; R450-Q452 PolarHBondContact O-N 2.84Å; Q452-T456 PolarHBondContact O-N 2.67Å; Q452-T456 PolarHBondContact O-OG1 2.64Å; Q452-T456 VanDerWaalsContact O-OG1 3.07Å
453	A	92.3	Very high	87.2	Confident	53 Å²	53	65.9 Å²	65.9	44%	0.438	37%	0.365	S	S	.	.	H	α-helix	trans	-62.9	-53.9	175.3	0	0	0	0	0	111.3	A449 R450 R451 V455 T456 E457	A449-A453 WeakPolarHBondContact O-CB 3.23Å; A449-A453 PolarHBondContact O-N 3.46Å; R450-A453 PolarHBondContact O-N 3.26Å; R451-A453 VanDerWaalsContact C-N 3.34Å; R451-A453 PolarHBondContact O-N 3.44Å; A453-V455 VanDerWaalsContact C-N 3.28Å; A453-V455 PolarHBondContact O-N 3.33Å; A453-T456 WeakPolarHBondContact CA-OG1 3.31Å; A453-T456 PolarHBondContact O-N 2.91Å; A453-T456 PolarHBondContact O-OG1 3.13Å; A453-E457 PolarHBondContact O-N 3.28Å
454	L	90.1	Very high	86.8	Confident	34 Å²	34	68 Å²	68	18%	0.178	38%	0.384	C	S	.	.	H	α-helix	trans	-59.6	-36.6	177.5	-68.4	168.4	0	0	0	112.6	E387 I390 R450 R451 R458	E387-L454 HydrophobicContact CB-CD1 4.42Å; E387-L454 HydrophobicContact CG-CD1 3.7Å; E387-L454 WeakPolarHBondContact OE2-CD1 3.35Å; I390-L454 HydrophobicContact CD1-CB 3.71Å; R450-L454 HydrophobicContact CG-CD1 4.35Å; R450-L454 WeakPolarHBondContact O-CG 3.49Å; R450-L454 PolarHBondContact O-N 3.3Å; R450-L454 VanDerWaalsContact O-N 3.14Å; R451-L454 PolarHBondContact O-N 2.94Å; L454-R458 WeakPolarHBondContact O-CB 3.32Å; L454-R458 VanDerWaalsContact O-CG 3.27Å; L454-R458 WeakPolarHBondContact O-CG 3.5Å; L454-R458 PolarHBondContact O-N 2.97Å; L454-R458 VanDerWaalsContact O-N 3.07Å
455	V	91.8	Very high	86	Confident	20 Å²	20	69.3 Å²	69.3	12%	0.121	38%	0.384	C	S	.	.	H	α-helix	trans	-65.2	-40.7	173.1	168.2	0	0	0	0	111.3	I390 R451 A453 K459	I390-V455 HydrophobicContact CB-CG2 4.47Å; I390-V455 HydrophobicContact CD1-CG2 3.71Å; I390-V455 HydrophobicContact CG1-CG2 3.74Å; I390-V455 HydrophobicContact CG2-CG2 3.95Å; R451-V455 HydrophobicContact CG-CG2 4.18Å; R451-V455 WeakPolarHBondContact O-CB 3.49Å; R451-V455 WeakPolarHBondContact O-CG2 3.49Å; R451-V455 PolarHBondContact O-N 3.43Å; A453-V455 VanDerWaalsContact C-N 3.28Å; A453-V455 PolarHBondContact O-N 3.33Å; V455-K459 HydrophobicContact CG1-CD 3.98Å; V455-K459 WeakPolarHBondContact O-CB 3.35Å; V455-K459 WeakPolarHBondContact O-CD 3.47Å; V455-K459 VanDerWaalsContact O-CG 3.23Å; V455-K459 WeakPolarHBondContact O-CG 3.43Å; V455-K459 PolarHBondContact O-N 3.42Å
456	T	91.9	Very high	84.9	Confident	76 Å²	76	69.1 Å²	69.1	47%	0.466	39%	0.387	S	S	.	.	H	α-helix	trans	-71.4	-39.7	177.1	43.5	0	0	0	0	113.1	Q452 A453 K459 A460	Q452-T456 PolarHBondContact O-N 2.67Å; Q452-T456 PolarHBondContact O-OG1 2.64Å; Q452-T456 VanDerWaalsContact O-OG1 3.07Å; A453-T456 WeakPolarHBondContact CA-OG1 3.31Å; A453-T456 PolarHBondContact O-N 2.91Å; A453-T456 PolarHBondContact O-OG1 3.13Å; T456-K459 PolarHBondContact O-N 3.22Å; T456-A460 WeakPolarHBondContact O-CB 3.46Å; T456-A460 PolarHBondContact O-N 2.86Å
457	E	91.6	Very high	83.5	Confident	120 Å²	120	72.3 Å²	72.3	56%	0.561	40%	0.401	S	S	*	.	H	α-helix	trans	-60.2	-54.1	176.8	-175.1	-159.8	166.9	0	0	111	A453 K459 A460 A461	A453-E457 PolarHBondContact O-N 3.28Å; E457-K459 VanDerWaalsContact C-N 3.26Å; E457-K459 PolarHBondContact O-N 3.01Å; E457-A460 PolarHBondContact O-N 3.08Å; E457-A460 VanDerWaalsContact O-N 3.09Å; E457-A461 PolarHBondContact O-N 2.81Å
458	R	90.6	Very high	82.3	Confident	27 Å²	27	76.3 Å²	76.3	10%	0.102	43%	0.427	C	S	.	.	H	α-helix	trans	-63.1	-32.1	-179.3	-67.3	172.6	-173.8	-169	2.1	112.3	C385 C402 Y404 L454 A462	C385-R458 PolarHBondContact SG-NH2 3.16Å; C385-R458 VanDerWaalsContact SG-NH2 3.41Å; C402-R458 PolarHBondContact SG-NH1 3.17Å; C402-R458 VanDerWaalsContact SG-NH1 3.38Å; Y404-R458 HydrophobicContact CD1-CG 4.18Å; Y404-R458 HydrophobicContact CG-CG 4.16Å; L454-R458 WeakPolarHBondContact O-CB 3.32Å; L454-R458 VanDerWaalsContact O-CG 3.27Å; L454-R458 WeakPolarHBondContact O-CG 3.5Å; L454-R458 PolarHBondContact O-N 2.97Å; L454-R458 VanDerWaalsContact O-N 3.07Å; R458-A462 WeakPolarHBondContact O-CB 3.41Å; R458-A462 PolarHBondContact O-N 3.39Å; R458-A462 VanDerWaalsContact O-N 3.11Å
459	K	87.2	Confident	80.6	Confident	105 Å²	105	79 Å²	79	46%	0.457	44%	0.443	S	S	.	.	H	α-helix	trans	-71.8	-39.3	173	-75.7	174.9	179.6	175.9	0	112.5	V455 T456 E457 A462 I463	V455-K459 HydrophobicContact CG1-CD 3.98Å; V455-K459 WeakPolarHBondContact O-CB 3.35Å; V455-K459 WeakPolarHBondContact O-CD 3.47Å; V455-K459 VanDerWaalsContact O-CG 3.23Å; V455-K459 WeakPolarHBondContact O-CG 3.43Å; V455-K459 PolarHBondContact O-N 3.42Å; T456-K459 PolarHBondContact O-N 3.22Å; E457-K459 VanDerWaalsContact C-N 3.26Å; E457-K459 PolarHBondContact O-N 3.01Å; K459-A462 PolarHBondContact O-N 2.9Å; K459-I463 WeakPolarHBondContact O-CD1 3.5Å; K459-I463 VanDerWaalsContact O-CG1 3.31Å; K459-I463 WeakPolarHBondContact O-CG1 3.5Å; K459-I463 PolarHBondContact O-N 3.31Å; K459-I463 VanDerWaalsContact O-N 3.11Å
460	A	87.1	Confident	78.4	Confident	60 Å²	60	84 Å²	84	50%	0.496	46%	0.456	S	S	.	.	H	α-helix	trans	-64.3	-44.2	174.4	0	0	0	0	0	111.7	T456 E457 A462 I463 A464	T456-A460 WeakPolarHBondContact O-CB 3.46Å; T456-A460 PolarHBondContact O-N 2.86Å; E457-A460 PolarHBondContact O-N 3.08Å; E457-A460 VanDerWaalsContact O-N 3.09Å; A460-A462 PolarHBondContact O-N 2.86Å; A460-I463 PolarHBondContact O-N 2.64Å; A460-A464 PolarHBondContact O-N 2.85Å
461	A	81.6	Confident	76.1	Confident	41 Å²	41	84.8 Å²	84.8	34%	0.339	47%	0.47	S	S	.	.	H	α-helix	trans	-59	-44.6	175.2	0	0	0	0	0	112.2	E457 I463 A464 E465	E457-A461 PolarHBondContact O-N 2.81Å; A461-I463 VanDerWaalsContact C-N 3.32Å; A461-I463 PolarHBondContact O-N 3.08Å; A461-A464 PolarHBondContact O-N 3.24Å; A461-E465 WeakPolarHBondContact O-CB 3.19Å; A461-E465 PolarHBondContact O-N 3.47Å
462	A	79.1	Confident	74	Confident	48 Å²	48	91.7 Å²	91.7	40%	0.397	51%	0.509	S	S	.	.	H	α-helix	trans	-64.8	-32	177.2	0	0	0	0	0	113.6	R458 K459 A460 V466	R458-A462 WeakPolarHBondContact O-CB 3.41Å; R458-A462 PolarHBondContact O-N 3.39Å; R458-A462 VanDerWaalsContact O-N 3.11Å; K459-A462 PolarHBondContact O-N 2.9Å; A460-A462 PolarHBondContact O-N 2.86Å; A462-V466 WeakPolarHBondContact O-CG2 3.5Å
463	I	79.4	Confident	71.7	Confident	109 Å²	109	93.8 Å²	93.8	56%	0.559	52%	0.524	S	S	*	.	H	α-helix	trans	-72.6	-44.4	174.7	-68.4	163.7	0	0	0	110.6	K459 A460 A461 E465 V466 M467	K459-I463 WeakPolarHBondContact O-CD1 3.5Å; K459-I463 VanDerWaalsContact O-CG1 3.31Å; K459-I463 WeakPolarHBondContact O-CG1 3.5Å; K459-I463 PolarHBondContact O-N 3.31Å; K459-I463 VanDerWaalsContact O-N 3.11Å; A460-I463 PolarHBondContact O-N 2.64Å; A461-I463 VanDerWaalsContact C-N 3.32Å; A461-I463 PolarHBondContact O-N 3.08Å; I463-E465 VanDerWaalsContact C-N 3.3Å; I463-E465 PolarHBondContact O-N 3.33Å; I463-V466 PolarHBondContact O-N 3.47Å; I463-V466 VanDerWaalsContact O-N 3.13Å; I463-M467 HydrophobicContact CG2-SD 4.25Å; I463-M467 PolarHBondContact O-N 2.96Å
464	A	75.4	Confident	69.5	Low	54 Å²	54	96 Å²	96	45%	0.446	54%	0.536	S	S	.	.	H	α-helix	trans	-60.1	-40.4	177.4	0	0	0	0	0	112	A460 A461 V466 M467 V468	A460-A464 PolarHBondContact O-N 2.85Å; A461-A464 PolarHBondContact O-N 3.24Å; A464-V466 PolarHBondContact O-N 3.19Å; A464-M467 PolarHBondContact O-N 3.41Å; A464-V468 WeakPolarHBondContact O-CG2 3.46Å
465	E	65.9	Low	67.1	Low	85 Å²	85	99.4 Å²	99.4	40%	0.397	56%	0.563	S	S	.	*	H	α-helix	trans	-63.1	-26	177.3	-158.3	-176.3	175.2	0	0	113.3	K407 A461 I463	K407-E465 WeakPolarHBondContact CE-OE1 3.35Å; K407-E465 IonicContact NZ-OE1 2.68Å; K407-E465 PolarHBondContact NZ-OE1 2.88Å; K407-E465 IonicContact NZ-OE2 2.64Å; K407-E465 PolarHBondContact NZ-OE2 3.33Å; A461-E465 WeakPolarHBondContact O-CB 3.19Å; A461-E465 PolarHBondContact O-N 3.47Å; I463-E465 VanDerWaalsContact C-N 3.3Å; I463-E465 PolarHBondContact O-N 3.33Å
466	V	62.6	Low	64.6	Low	108 Å²	108	109.6 Å²	109.6	66%	0.655	60%	0.599	S	S	*	*	H	α-helix	trans	-84.4	-29.6	176	172.1	0	0	0	0	112.2	A462 I463 A464 V468	A462-V466 WeakPolarHBondContact O-CG2 3.5Å; I463-V466 PolarHBondContact O-N 3.47Å; I463-V466 VanDerWaalsContact O-N 3.13Å; A464-V466 PolarHBondContact O-N 3.19Å; V466-V468 PolarHBondContact O-N 3.19Å
467	M	57.2	Low	61.8	Low	151 Å²	151	112 Å²	112	74%	0.744	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-6.2	-178.6	-72.2	-176.3	65.2	0	0	114.8	I463 A464 I469	I463-M467 HydrophobicContact CG2-SD 4.25Å; I463-M467 PolarHBondContact O-N 2.96Å; A464-M467 PolarHBondContact O-N 3.41Å; M467-I469 VanDerWaalsContact C-N 3.34Å
468	V	57.2	Low	59.3	Low	127 Å²	127	111.5 Å²	111.5	77%	0.77	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	8	-178.1	177.7	0	0	0	0	112.2	A464 V466	A464-V468 WeakPolarHBondContact O-CG2 3.46Å; V466-V468 PolarHBondContact O-N 3.19Å
469	I	54.7	Low	56.4	Low	118 Å²	118	117.6 Å²	117.6	61%	0.605	66%	0.658	S	S	*	*			trans	-125.9	126	-176.2	-51.2	177.4	0	0	0	109.2	M467	M467-I469 VanDerWaalsContact C-N 3.34Å
470	H	41.8	Very low	54	Low	162 Å²	162	117.4 Å²	117.4	75%	0.75	67%	0.67	S	S	*	*			trans	91.7	129	-163.3	-61	80.3	0	0	0	112.8
471	D	41.3	Very low	51.5	Low	148 Å²	148	120.4 Å²	120.4	79%	0.791	69%	0.688	S	S	*	*			cis	-142	151.1	-1.3	-87.3	-46.3	0	0	0	111.2
472	D	44.7	Very low	49.3	Very low	165 Å²	165	126.7 Å²	126.7	88%	0.882	71%	0.712	S	S	*	*			trans	-148.9	89.7	170.9	-166.5	6.1	0	0	0	110.1
473	D	42.5	Very low	47.1	Very low	158 Å²	158	131.6 Å²	131.6	85%	0.845	74%	0.737	S	S	*	*			trans	-147.1	159.1	167.6	-163.9	10.2	0	0	0	110.6
474	S	46.5	Very low	44.9	Very low	100 Å²	100	130.7 Å²	130.7	70%	0.699	74%	0.74	S	S	*	*			trans	-102.5	138.3	-153	-67.6	0	0	0	0	115.5
475	S	39.5	Very low	42.9	Very low	106 Å²	106	135.2 Å²	135.2	74%	0.741	76%	0.755	S	S	*	*				168.6	143.1	110.9	51.1	0	0	0	0	115.9
476	R	38.7	Very low	41.3	Very low	234 Å²	234	138.8 Å²	138.8	88%	0.883	78%	0.777	S	S	*	*			trans	48.1	128.3	139.4	-68.3	179.5	179.6	-156.2	-0.4	119.6
477	T	33.5	Very low	40.1	Very low	125 Å²	125	138.6 Å²	138.6	77%	0.767	78%	0.78	S	S	*	*			cis	-151.9	157.7	7.6	47.2	0	0	0	0	112.3
478	S	38.2	Very low	38.8	Very low	111 Å²	111	137.3 Å²	137.3	78%	0.776	79%	0.787	S	S	*	*			trans	-1.9	130.7	157.7	-42.1	0	0	0	0	120.1
479	D	31.3	Very low	37.8	Very low	155 Å²	155	139 Å²	139	83%	0.829	79%	0.791	S	S	*	*				-151.6	-173.6	89.8	-148.4	-18.5	0	0	0	111.4
480	S	35.8	Very low	36.6	Very low	101 Å²	101	138.6 Å²	138.6	71%	0.706	80%	0.798	S	S	*	*			trans	-114.5	133.7	-143.5	-48.8	0	0	0	0	115.1
481	S	33.7	Very low	36.1	Very low	123 Å²	123	136.3 Å²	136.3	86%	0.86	80%	0.8	S	S	*	*			trans	-160.8	127.9	134.5	40.2	0	0	0	0	110.9
482	M	36.8	Very low	35.6	Very low	172 Å²	172	135.9 Å²	135.9	85%	0.847	80%	0.802	S	S	*	*			trans	-94.9	140.6	173.7	-73.5	-178	171	0	0	110.7
483	V	33.6	Very low	35.2	Very low	152 Å²	152	134.4 Å²	134.4	92%	0.921	80%	0.799	S	S	*	*				-145.1	136	127.2	-105.4	0	0	0	0	108.5
484	S	32	Very low	34.5	Very low	90 Å²	90	132.1 Å²	132.1	63%	0.629	80%	0.796	S	S	*	*			trans	-92.8	133.1	-160.9	-59.7	0	0	0	0	114.3
485	I	33.2	Very low	34.2	Very low	148 Å²	148	133.3 Å²	133.3	76%	0.759	80%	0.798	S	S	*	*				18.8	121	121.9	-37.7	168.5	0	0	0	116.4
486	N	32.5	Very low	33.6	Very low	160 Å²	160	136.8 Å²	136.8	86%	0.856	80%	0.803	S	S	*	*			trans	-149.3	80.2	135.2	47.5	-2.1	0	0	0	111.6
487	S	37.8	Very low	33.4	Very low	104 Å²	104	131.5 Å²	131.5	73%	0.727	80%	0.797	S	S	*	*			trans	-63.3	142.2	165	-46.8	0	0	0	0	111.3
488	S	30.6	Very low	33	Very low	125 Å²	125	132.6 Å²	132.6	87%	0.874	80%	0.798	S	S	*	*			trans	-142.3	126.9	152.7	-90.1	0	0	0	0	109.8
489	L	35	Very low	32.6	Very low	163 Å²	163	131.6 Å²	131.6	85%	0.853	79%	0.791	S	S	*	*			trans	-97.5	-172	174.7	-74.4	166.6	0	0	0	110.1
490	S	29.5	Very low	32.5	Very low	108 Å²	108	129 Å²	129	76%	0.755	79%	0.785	S	S	*	*			trans	74.4	117.3	176.1	70.8	0	0	0	0	114.3
491	S	31.4	Very low	32.3	Very low	115 Å²	115	131 Å²	131	80%	0.804	79%	0.786	S	S	*	*				83.7	114.8	55.1	-64.1	0	0	0	0	112.9
492	V	31.2	Very low	32.1	Very low	138 Å²	138	133.3 Å²	133.3	84%	0.836	78%	0.783	S	S	*	*				-157.8	149.9	122	-95.9	0	0	0	0	109.2
493	V	36.3	Very low	31.9	Very low	134 Å²	134	129.8 Å²	129.8	81%	0.812	77%	0.771	S	S	*	*			trans	-107.5	129.7	162.3	178.4	0	0	0	0	106.3	V495	V493-V495 HydrophobicContact CG1-CG2 4.11Å
494	S	28.6	Very low	31.7	Very low	110 Å²	110	129.9 Å²	129.9	77%	0.769	77%	0.767	S	S	*	*			trans	-131.2	130.4	170.6	-63.7	0	0	0	0	108.9
495	V	39	Very low	31.8	Very low	125 Å²	125	130.7 Å²	130.7	76%	0.758	77%	0.772	S	S	*	*			trans	-140.1	101.6	179.5	-177.8	0	0	0	0	108.8	V493	V493-V495 HydrophobicContact CG1-CG2 4.11Å
496	E	27.5	Very low	31.9	Very low	179 Å²	179	133.2 Å²	133.2	84%	0.836	78%	0.781	S	S	*	*			trans	-141.4	119.3	165.9	-64.1	-173.3	150.1	0	0	104.4
497	T	33.9	Very low	31.9	Very low	124 Å²	124	133 Å²	133	76%	0.761	78%	0.78	S	S	*	*				52.8	123	72.5	68.7	0	0	0	0	111.1
498	D	26	Very low	31.7	Very low	148 Å²	148	133.9 Å²	133.9	79%	0.791	79%	0.786	S	S	*	*			cis	-169.5	-175.9	29.2	-170.8	19.2	0	0	0	111.6
499	S	29.1	Very low	32	Very low	89 Å²	89	135.5 Å²	135.5	62%	0.622	78%	0.777	S	S	*	*			trans	81.5	117.2	148.8	-75.1	0	0	0	0	122.9
500	S	29.1	Very low	32.3	Very low	101 Å²	101	135.4 Å²	135.4	71%	0.706	78%	0.778	S	S	*	*				81	98.5	127.3	-59.5	0	0	0	0	123.8
501	I	31.5	Very low	33.1	Very low	142 Å²	142	137.7 Å²	137.7	73%	0.728	78%	0.776	S	S	*	*				47.6	117	112.5	-56.6	159.3	0	0	0	119.7	V503	I501-V503 HydrophobicContact CG2-CG2 4.46Å
502	H	29.6	Very low	33.7	Very low	172 Å²	172	140.6 Å²	140.6	80%	0.796	78%	0.782	S	S	*	*			trans	-157.4	104.7	133.7	-108.9	-85.5	0	0	0	107.1
503	V	33.2	Very low	34.5	Very low	98 Å²	98	142.6 Å²	142.6	59%	0.594	78%	0.782	S	S	*	*				21.5	104.7	96.4	-73.1	0	0	0	0	116.9	I501	I501-V503 HydrophobicContact CG2-CG2 4.46Å
504	D	28	Very low	35.1	Very low	155 Å²	155	146.7 Å²	146.7	83%	0.829	81%	0.807	S	S	*	*				-160.7	133.8	119.9	-76.6	-37	0	0	0	105.4
505	S	34.3	Very low	35.4	Very low	107 Å²	107	148.6 Å²	148.6	75%	0.748	81%	0.809	S	S	*	*			cis	75.8	86.7	21.1	-63.6	0	0	0	0	116.5
506	E	35.1	Very low	35.2	Very low	201 Å²	201	149.8 Å²	149.8	94%	0.939	81%	0.812	S	S	*	*			trans	-152.9	138.3	140.4	-121.4	171.1	-167.2	0	0	111.2
507	D	33.7	Very low	35.6	Very low	155 Å²	155	148.2 Å²	148.2	83%	0.829	81%	0.81	S	S	*	*			trans	-85	157.8	179	-83.8	-64.5	0	0	0	111.9
508	S	34	Very low	35.7	Very low	122 Å²	122	149.6 Å²	149.6	85%	0.853	81%	0.813	S	S	*	*			trans	-149.5	114.9	141.2	-10.8	0	0	0	0	110.7
509	F	35.6	Very low	36.3	Very low	160 Å²	160	149.7 Å²	149.7	70%	0.702	82%	0.815	S	S	*	*			trans	-68.3	149.2	164.9	-124.6	-109.3	0	0	0	109.8	E511	F509-E511 HydrophobicContact CE1-CG 4.07Å
510	D	41.2	Very low	36.8	Very low	161 Å²	161	153.7 Å²	153.7	86%	0.861	83%	0.827	S	S	*	*				-161.3	125.4	121.7	-109.2	-23.1	0	0	0	110.7
511	E	46.3	Very low	37.4	Very low	156 Å²	156	157.5 Å²	157.5	73%	0.729	84%	0.836	S	S	*	*			trans	-83.5	147.6	159.3	-66.4	174.7	98.8	0	0	108.3	F509	F509-E511 HydrophobicContact CE1-CG 4.07Å
512	L	45	Very low	37.8	Very low	175 Å²	175	158.7 Å²	158.7	92%	0.916	84%	0.844	S	S	*	*			trans	-154.9	129.1	151.1	-110.2	176.3	0	0	0	111.1
513	E	47.3	Very low	38.5	Very low	181 Å²	181	157.6 Å²	157.6	85%	0.846	85%	0.848	S	S	*	*			trans	-79.7	143.9	178.1	-56.1	173.2	110.5	0	0	112.2
514	V	48.3	Very low	39	Very low	220 Å²	220	163 Å²	163	100%	1.333	87%	0.871	S	S	*	*			trans	-146.9	0	137	-174.8	0	0	0	0	109

Retrieved 514 of 514 residues in 671.1 ms (Link to these results)

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