A0A077ZGC3_TRITR Loading...

PH domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZGC3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 575 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.5	Very low	49.8	Very low	203 Å²	203	140.5 Å²	140.5	100%	1	71%	0.709	S	S	*	*				0	140.5	0	-75.5	171.5	174	0	0	109
2	R	36.2	Very low	51.4	Low	164 Å²	164	141.2 Å²	141.2	62%	0.619	73%	0.725	S	S	*	*			trans	-78.7	147.5	167.4	-67.1	177.3	-176.3	157.7	0.8	108.5	E4 E5	R2-E4 PolarHBondContact O-N 3.28Å; R2-E4 VanDerWaalsContact O-N 3.11Å; R2-E5 PolarHBondContact N-OE2 3.01Å; R2-E5 VanDerWaalsContact N-OE2 3.11Å; R2-E5 PolarHBondContact O-N 3.37Å; R2-E5 VanDerWaalsContact O-N 3.08Å
3	I	49.5	Very low	52.9	Low	150 Å²	150	146.8 Å²	146.8	77%	0.769	73%	0.731	S	S	*	*	H	α-helix	trans	-58.9	-28.7	-176.4	-64.8	175.1	0	0	0	111.7	E5 V6	I3-E5 PolarHBondContact O-N 3.27Å; I3-V6 PolarHBondContact O-N 2.98Å
4	E	44.8	Very low	54.8	Low	155 Å²	155	145.2 Å²	145.2	72%	0.724	73%	0.733	S	S	*	*	H	α-helix	trans	-68	-30.2	178.3	-62.2	177.6	148.5	0	0	114	R2 V6 M7	R2-E4 PolarHBondContact O-N 3.28Å; R2-E4 VanDerWaalsContact O-N 3.11Å; E4-V6 VanDerWaalsContact C-N 3.34Å; E4-M7 PolarHBondContact O-N 3.48Å
5	E	45.5	Very low	56.6	Low	109 Å²	109	140 Å²	140	51%	0.509	71%	0.712	S	S	.	*	H	α-helix	trans	-70.4	-33	178.6	-69.5	173.1	126.6	0	0	111.7	R2 I3 M7 M8 H9	R2-E5 PolarHBondContact N-OE2 3.01Å; R2-E5 VanDerWaalsContact N-OE2 3.11Å; R2-E5 PolarHBondContact O-N 3.37Å; R2-E5 VanDerWaalsContact O-N 3.08Å; I3-E5 PolarHBondContact O-N 3.27Å; E5-M7 PolarHBondContact O-N 2.82Å; E5-M8 PolarHBondContact O-N 3.21Å; E5-H9 PolarHBondContact O-CD2 3.18Å
6	V	49.8	Very low	58.5	Low	90 Å²	90	135.1 Å²	135.1	55%	0.545	69%	0.688	S	S	.	*	H	α-helix	trans	-63.8	-26.9	-179.5	-173.8	0	0	0	0	111.5	I3 E4 M8	I3-V6 PolarHBondContact O-N 2.98Å; E4-V6 VanDerWaalsContact C-N 3.34Å; V6-M8 VanDerWaalsContact C-N 3.3Å; V6-M8 PolarHBondContact O-N 3.49Å
7	M	48.7	Very low	60.3	Low	169 Å²	169	130.2 Å²	130.2	83%	0.833	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-12	-179.8	-61.9	-167.2	76.1	0	0	114.5	E4 E5	E4-M7 PolarHBondContact O-N 3.48Å; E5-M7 PolarHBondContact O-N 2.82Å
8	M	53.8	Low	61.7	Low	169 Å²	169	127.9 Å²	127.9	83%	0.833	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-16.4	177.1	-79	-74.6	-174	0	0	113.8	E5 V6 S10	E5-M8 PolarHBondContact O-N 3.21Å; V6-M8 VanDerWaalsContact C-N 3.3Å; V6-M8 PolarHBondContact O-N 3.49Å; M8-S10 PolarHBondContact O-N 3.12Å
9	H	51.7	Low	62.9	Low	143 Å²	143	124.6 Å²	124.6	66%	0.662	64%	0.636	S	S	*	*			trans	-86.4	99.7	-176.9	-74.7	-75	0	0	0	111.9	E5	E5-H9 PolarHBondContact O-CD2 3.18Å
10	S	58.2	Low	64.2	Low	102 Å²	102	118.6 Å²	118.6	71%	0.713	61%	0.606	S	S	*	*			trans	-69.7	130.4	161.8	64.5	0	0	0	0	109.5	M8 V12	M8-S10 PolarHBondContact O-N 3.12Å; S10-V12 PolarHBondContact O-N 3.08Å
11	P	67	Low	65.3	Low	91 Å²	91	114.4 Å²	114.4	59%	0.591	59%	0.589	S	S	*	*			trans	-65.2	124.6	-179.5	24.5	-33.1	0	0	0	110.4	R13 V14	P11-R13 PolarHBondContact O-N 3.35Å; P11-V14 HydrophobicContact CB-CG2 4Å; P11-V14 HydrophobicContact CG-CG2 3.65Å
12	V	68.7	Low	67.6	Low	149 Å²	149	108.9 Å²	108.9	90%	0.903	56%	0.558	S	S	*	*	S	Bend	trans	-60	-33.2	179.9	178.4	0	0	0	0	111.5	S10	S10-V12 PolarHBondContact O-N 3.08Å
13	R	70.9	Confident	70.3	Confident	214 Å²	214	101.8 Å²	101.8	81%	0.808	53%	0.533	S	S	*	.			trans	-143.1	146.6	166.6	-70	-174.3	177.5	175.5	0.7	109.2	P11 V15	P11-R13 PolarHBondContact O-N 3.35Å; R13-V15 HydrophobicContact CB-CG2 4.2Å
14	V	79.8	Confident	72.3	Confident	125 Å²	125	98.4 Å²	98.4	76%	0.758	52%	0.515	S	S	*	.			trans	-111.9	126.6	161.7	-178.4	0	0	0	0	105.7	P11	P11-V14 HydrophobicContact CB-CG2 4Å; P11-V14 HydrophobicContact CG-CG2 3.65Å
15	V	82.2	Confident	74.6	Confident	67 Å²	67	97.5 Å²	97.5	41%	0.406	51%	0.505	S	S	.	.			trans	-135.5	128.4	178.4	-167.7	0	0	0	0	106.7	R13 I45	R13-V15 HydrophobicContact CB-CG2 4.2Å; V15-I45 HydrophobicContact CB-CD1 4.05Å; V15-I45 HydrophobicContact CG1-CD1 3.8Å
16	D	87.2	Confident	76.6	Confident	62 Å²	62	93.8 Å²	93.8	33%	0.332	49%	0.49	S	S	.	.			trans	-69.4	148	171.9	63.4	85.6	0	0	0	110.2	L18 R42 H375	D16-L18 HydrophobicContact CB-CD1 4.5Å; D16-L18 HydrophobicContact CB-CG 4.36Å; D16-R42 PolarHBondContact O-NH2 2.82Å; D16-R42 IonicContact OD1-CZ 2.71Å; D16-R42 IonicContact OD1-NH1 3.93Å; D16-R42 PolarHBondContact OD1-NH1 3.19Å; D16-R42 IonicContact OD1-NH2 3.7Å; D16-R42 PolarHBondContact OD1-NH2 3.02Å; D16-R42 VanDerWaalsContact OD1-NH2 3.15Å; D16-R42 IonicContact OD2-NH2 2.66Å; D16-H375 IonicContact OD2-CE1 3.44Å; D16-H375 IonicContact OD2-ND1 3.68Å
17	L	89	Confident	78.1	Confident	52 Å²	52	96.9 Å²	96.9	27%	0.272	51%	0.509	S	S	.	.			trans	-105.8	26.8	174.8	-58	-178.9	0	0	0	111.7	C20 I35 F37 I45 L66	L17-C20 WeakPolarHBondContact O-CB 3.49Å; L17-I35 HydrophobicContact CD2-CD1 4.41Å; L17-I35 HydrophobicContact CD2-CG2 4.39Å; L17-F37 HydrophobicContact CD2-CE1 4.46Å; L17-F37 HydrophobicContact CD2-CZ 4.36Å; L17-I45 HydrophobicContact CD2-CD1 3.82Å; L17-L66 HydrophobicContact CB-CD2 3.72Å; L17-L66 HydrophobicContact CD1-CD2 3.99Å
18	L	84.9	Confident	79.7	Confident	89 Å²	89	93.5 Å²	93.5	47%	0.466	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	149.3	171.5	-62.2	173.8	0	0	0	109.4	D16 C20 F37 R42	D16-L18 HydrophobicContact CB-CD1 4.5Å; D16-L18 HydrophobicContact CB-CG 4.36Å; L18-C20 PolarHBondContact O-N 2.68Å; L18-F37 WeakPolarHBondContact O-CD1 3.35Å; L18-R42 PolarHBondContact O-NH1 2.67Å
19	D	84.6	Confident	81.1	Confident	64 Å²	64	88.1 Å²	88.1	34%	0.342	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	35.2	-178.4	-36.6	-43.6	0	0	0	112.6	A21 F37 E38 H39	D19-A21 PolarHBondContact O-N 3.49Å; D19-F37 CarbonylContact O-C 3.54Å; D19-F37 VanDerWaalsContact O-CA 3.23Å; D19-F37 WeakPolarHBondContact O-CA 3.13Å; D19-E38 HydrophobicContact CB-CB 4.29Å; D19-E38 PolarHBondContact O-N 3.41Å; D19-H39 IonicContact OD2-CD2 2.96Å; D19-H39 IonicContact OD2-NE2 3.78Å
20	C	88.4	Confident	82.8	Confident	4 Å²	4	86.5 Å²	86.5	3%	0.027	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	113.3	177.7	179.8	0	0	0	0	109.9	L17 L18 I35 L66 C71 M72	L17-C20 WeakPolarHBondContact O-CB 3.49Å; L18-C20 PolarHBondContact O-N 2.68Å; C20-I35 VanDerWaalsContact SG-CG2 3.57Å; C20-L66 HydrophobicContact CB-CD1 4.44Å; C20-C71 PolarHBondContact N-O 2.9Å; C20-M72 HydrophobicContact CB-CB 4.46Å; C20-M72 WeakPolarHBondContact O-CA 3.48Å; C20-M72 WeakPolarHBondContact O-CB 3.22Å; C20-M72 VanDerWaalsContact O-CG 3.28Å; C20-M72 WeakPolarHBondContact O-CG 3.14Å
21	A	88.5	Confident	84.3	Confident	31 Å²	31	83.4 Å²	83.4	26%	0.256	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-31.4	-178.8	0	0	0	0	0	112.9	D19 G36 E38	D19-A21 PolarHBondContact O-N 3.49Å; A21-G36 PolarHBondContact N-O 3.29Å; A21-E38 HydrophobicContact CB-CB 4.35Å
22	Y	90.3	Very high	85.5	Confident	88 Å²	88	82.6 Å²	82.6	35%	0.345	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	152.1	-178.5	59.4	-99	0	0	0	113.6	I24 I35 G36	Y22-I24 HydrophobicContact CD2-CB 4.31Å; Y22-I24 HydrophobicContact CD2-CD1 3.89Å; Y22-I24 HydrophobicContact CD2-CG1 3.76Å; Y22-I24 HydrophobicContact CD2-CG2 3.8Å; Y22-I24 HydrophobicContact CE2-CD1 3.63Å; Y22-I24 HydrophobicContact CE2-CG1 3.83Å; Y22-I24 HydrophobicContact CG-CG2 4.31Å; Y22-I35 CarbonylContact O-C 3.59Å; Y22-I35 WeakPolarHBondContact O-CA 3.24Å; Y22-G36 PolarHBondContact N-O 2.9Å; Y22-G36 PolarHBondContact O-N 3.44Å
23	V	92.8	Very high	86.7	Confident	15 Å²	15	75.5 Å²	75.5	9%	0.091	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	117.6	162.2	-176.1	0	0	0	0	107.2	L33 I35 V59 L62 L66 M72	V23-L33 HydrophobicContact CG1-CD1 4.1Å; V23-I35 HydrophobicContact CG1-CG1 4.42Å; V23-I35 HydrophobicContact CG2-CG1 4.39Å; V23-I35 HydrophobicContact CG2-CG2 4.34Å; V23-V59 HydrophobicContact CG1-CB 4.46Å; V23-V59 HydrophobicContact CG1-CG1 4.29Å; V23-V59 HydrophobicContact CG1-CG2 4.24Å; V23-L62 HydrophobicContact CG1-CB 4.33Å; V23-L62 HydrophobicContact CG1-CD1 4.46Å; V23-L62 HydrophobicContact CG2-CB 4.35Å; V23-L66 HydrophobicContact CG2-CD1 3.65Å; V23-M72 HydrophobicContact CG2-CE 4.35Å; V23-M72 HydrophobicContact CG2-SD 4.3Å
24	I	91.9	Very high	87.7	Confident	79 Å²	79	65.8 Å²	65.8	41%	0.405	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	156.1	-175.2	64.2	176.2	0	0	0	112.6	Y22 L33 S34	Y22-I24 HydrophobicContact CD2-CB 4.31Å; Y22-I24 HydrophobicContact CD2-CD1 3.89Å; Y22-I24 HydrophobicContact CD2-CG1 3.76Å; Y22-I24 HydrophobicContact CD2-CG2 3.8Å; Y22-I24 HydrophobicContact CE2-CD1 3.63Å; Y22-I24 HydrophobicContact CE2-CG1 3.83Å; Y22-I24 HydrophobicContact CG-CG2 4.31Å; I24-L33 CarbonylContact O-C 3.53Å; I24-L33 WeakPolarHBondContact O-CA 3.4Å; I24-S34 PolarHBondContact N-O 2.96Å; I24-S34 PolarHBondContact O-N 3.39Å
25	R	92.4	Very high	88.4	Confident	135 Å²	135	60 Å²	60	51%	0.509	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	142.4	168.7	14.5	179.4	-179.3	-144.8	-0	110.1	E56	R25-E56 IonicContact CZ-OE1 3.9Å; R25-E56 IonicContact CZ-OE2 3.71Å; R25-E56 IonicContact NH1-OE1 2.91Å; R25-E56 PolarHBondContact NH1-OE1 2.91Å; R25-E56 IonicContact NH1-OE2 2.77Å; R25-E56 PolarHBondContact NH1-OE2 3.21Å
26	T	87.5	Confident	88.8	Confident	31 Å²	31	56.9 Å²	56.9	19%	0.19	31%	0.311	C	S	.	.			trans	-87.3	117	179.5	-50.1	0	0	0	0	109.7	A28 D29 K32	T26-A28 HydrophobicContact CG2-CB 4.41Å; T26-A28 PolarHBondContact O-N 3.34Å; T26-A28 VanDerWaalsContact O-N 3.11Å; T26-D29 PolarHBondContact O-N 3.12Å; T26-D29 VanDerWaalsContact O-O 3.11Å; T26-K32 WeakPolarHBondContact CB-O 3.49Å; T26-K32 HydrophobicContact CG2-CB 4.41Å; T26-K32 PolarHBondContact N-O 3.11Å; T26-K32 PolarHBondContact OG1-O 3.09Å; T26-K32 VanDerWaalsContact OG1-O 3.06Å
27	V	82	Confident	89	Confident	155 Å²	155	54.8 Å²	54.8	94%	0.939	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-21.8	-176	-174.4	0	0	0	0	113.1
28	A	80.9	Confident	88.8	Confident	98 Å²	98	57.4 Å²	57.4	81%	0.81	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-8.6	-178.2	0	0	0	0	0	114.9	T26	T26-A28 HydrophobicContact CG2-CB 4.41Å; T26-A28 PolarHBondContact O-N 3.34Å; T26-A28 VanDerWaalsContact O-N 3.11Å
29	D	84.6	Confident	88.6	Confident	56 Å²	56	58 Å²	58	30%	0.299	31%	0.31	S	S	.	.			trans	-157.4	116.6	-173.9	-170.3	-36.9	0	0	0	111.4	T26 C31 K32	T26-D29 PolarHBondContact O-N 3.12Å; T26-D29 VanDerWaalsContact O-O 3.11Å; D29-C31 PolarHBondContact O-N 3.03Å; D29-C31 VanDerWaalsContact O-N 3.12Å; D29-C31 PolarHBondContact OD1-N 3.26Å; D29-C31 VanDerWaalsContact OD1-N 3.08Å; D29-K32 HydrophobicContact CB-CB 4.03Å; D29-K32 HydrophobicContact CB-CD 3.83Å; D29-K32 HydrophobicContact CB-CG 3.93Å; D29-K32 PolarHBondContact O-N 3.41Å; D29-K32 WeakPolarHBondContact OD2-CD 3.29Å; D29-K32 WeakPolarHBondContact OD2-CE 3.41Å; D29-K32 IonicContact OD2-NZ 2.66Å; D29-K32 PolarHBondContact OD2-NZ 3.41Å
30	D	86.9	Confident	88.3	Confident	110 Å²	110	62.3 Å²	62.3	59%	0.588	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-19.7	-172.9	-71.8	-41.1	0	0	0	114.4	L52 R55	D30-L52 HydrophobicContact CB-CD1 4.29Å; D30-R55 WeakPolarHBondContact O-CD 3.33Å; D30-R55 VanDerWaalsContact O-CZ 3.27Å; D30-R55 PolarHBondContact O-NE 3.44Å; D30-R55 PolarHBondContact O-NH1 3.31Å
31	C	90.7	Very high	87.9	Confident	37 Å²	37	67 Å²	67	25%	0.25	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	14.5	177.5	-63.5	0	0	0	0	113	D29 A48 T49	D29-C31 PolarHBondContact O-N 3.03Å; D29-C31 VanDerWaalsContact O-N 3.12Å; D29-C31 PolarHBondContact OD1-N 3.26Å; D29-C31 VanDerWaalsContact OD1-N 3.08Å; C31-A48 CarbonylContact O-C 3.53Å; C31-A48 VanDerWaalsContact O-CA 3.27Å; C31-A48 WeakPolarHBondContact O-CA 3.3Å; C31-T49 PolarHBondContact O-N 3.13Å; C31-T49 PolarHBondContact O-OG1 3.33Å
32	K	91.5	Very high	87.6	Confident	73 Å²	73	66.5 Å²	66.5	32%	0.317	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	138.4	177.4	-70.5	-176.9	-178.8	127.7	0	114.4	T26 D29 M47 A48 R55	T26-K32 WeakPolarHBondContact CB-O 3.49Å; T26-K32 HydrophobicContact CG2-CB 4.41Å; T26-K32 PolarHBondContact N-O 3.11Å; T26-K32 PolarHBondContact OG1-O 3.09Å; T26-K32 VanDerWaalsContact OG1-O 3.06Å; D29-K32 HydrophobicContact CB-CB 4.03Å; D29-K32 HydrophobicContact CB-CD 3.83Å; D29-K32 HydrophobicContact CB-CG 3.93Å; D29-K32 PolarHBondContact O-N 3.41Å; D29-K32 WeakPolarHBondContact OD2-CD 3.29Å; D29-K32 WeakPolarHBondContact OD2-CE 3.41Å; D29-K32 IonicContact OD2-NZ 2.66Å; D29-K32 PolarHBondContact OD2-NZ 3.41Å; K32-M47 VanDerWaalsContact CA-O 3.31Å; K32-M47 WeakPolarHBondContact CA-O 3.09Å; K32-A48 HydrophobicContact CG-CB 4.2Å; K32-R55 WeakPolarHBondContact O-CD 3.34Å
33	L	93.4	Very high	87.5	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	154.7	168.4	77.3	96.9	0	0	0	110.8	V23 I24 I35 Q46 M47 T49 R55 W58 V59 L62	V23-L33 HydrophobicContact CG1-CD1 4.1Å; I24-L33 CarbonylContact O-C 3.53Å; I24-L33 WeakPolarHBondContact O-CA 3.4Å; L33-I35 HydrophobicContact CD1-CD1 4.48Å; L33-I35 HydrophobicContact CD1-CG1 3.94Å; L33-Q46 WeakPolarHBondContact O-CA 3.39Å; L33-M47 HydrophobicContact CD1-CE 4.13Å; L33-M47 HydrophobicContact CD2-CE 4.06Å; L33-M47 HydrophobicContact CG-CB 4.23Å; L33-M47 HydrophobicContact CG-CE 4.38Å; L33-M47 PolarHBondContact N-O 3.48Å; L33-M47 PolarHBondContact O-N 2.82Å; L33-T49 HydrophobicContact CD2-CG2 4.34Å; L33-R55 HydrophobicContact CB-CG 4.2Å; L33-W58 HydrophobicContact CD2-CB 3.71Å; L33-V59 HydrophobicContact CB-CG2 3.81Å; L33-V59 HydrophobicContact CD2-CG2 4.19Å; L33-V59 HydrophobicContact CG-CG2 4.43Å; L33-L62 HydrophobicContact CD1-CD1 4.16Å
34	S	93	Very high	87.3	Confident	11 Å²	11	71.5 Å²	71.5	8%	0.077	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	127	-177.3	-171.9	0	0	0	0	110.4	I24 I45	I24-S34 PolarHBondContact N-O 2.96Å; I24-S34 PolarHBondContact O-N 3.39Å; S34-I45 CarbonylContact C-O 3.51Å; S34-I45 WeakPolarHBondContact CA-O 3.49Å
35	I	92.9	Very high	87.3	Confident	4 Å²	4	69.8 Å²	69.8	2%	0.021	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118.9	173.8	-51.7	172.6	0	0	0	107.5	L17 C20 Y22 V23 L33 P44 I45 L62	L17-I35 HydrophobicContact CD2-CD1 4.41Å; L17-I35 HydrophobicContact CD2-CG2 4.39Å; C20-I35 VanDerWaalsContact SG-CG2 3.57Å; Y22-I35 CarbonylContact O-C 3.59Å; Y22-I35 WeakPolarHBondContact O-CA 3.24Å; V23-I35 HydrophobicContact CG1-CG1 4.42Å; V23-I35 HydrophobicContact CG2-CG1 4.39Å; V23-I35 HydrophobicContact CG2-CG2 4.34Å; L33-I35 HydrophobicContact CD1-CD1 4.48Å; L33-I35 HydrophobicContact CD1-CG1 3.94Å; I35-P44 CarbonylContact O-C 3.56Å; I35-P44 WeakPolarHBondContact O-CA 3.39Å; I35-P44 VanDerWaalsContact O-CB 3.29Å; I35-P44 WeakPolarHBondContact O-CB 3.29Å; I35-I45 HydrophobicContact CB-CB 4.3Å; I35-I45 PolarHBondContact N-O 3.06Å; I35-I45 PolarHBondContact O-N 2.8Å; I35-L62 HydrophobicContact CD1-CD1 4.03Å
36	G	91.2	Very high	87.2	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	157.9	179.6	0	0	0	0	0	113.1	A21 Y22	A21-G36 PolarHBondContact N-O 3.29Å; Y22-G36 PolarHBondContact N-O 2.9Å; Y22-G36 PolarHBondContact O-N 3.44Å
37	F	91.6	Very high	87.4	Confident	19 Å²	19	71 Å²	71	8%	0.083	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	158.3	-176	-57.3	-80.6	0	0	0	111.5	L17 L18 D19 H39 R42 I45	L17-F37 HydrophobicContact CD2-CE1 4.46Å; L17-F37 HydrophobicContact CD2-CZ 4.36Å; L18-F37 WeakPolarHBondContact O-CD1 3.35Å; D19-F37 CarbonylContact O-C 3.54Å; D19-F37 VanDerWaalsContact O-CA 3.23Å; D19-F37 WeakPolarHBondContact O-CA 3.13Å; F37-H39 VanDerWaalsContact C-N 3.31Å; F37-R42 HydrophobicContact CB-CB 3.81Å; F37-R42 HydrophobicContact CB-CG 4.39Å; F37-R42 HydrophobicContact CD2-CB 3.61Å; F37-R42 HydrophobicContact CD2-CG 4.48Å; F37-R42 VanDerWaalsContact CE1-CZ 3.41Å; F37-R42 HydrophobicContact CE2-CB 4.46Å; F37-R42 HydrophobicContact CG-CB 3.87Å; F37-R42 HydrophobicContact CG-CG 4.43Å; F37-I45 HydrophobicContact CE2-CD1 4.25Å; F37-I45 HydrophobicContact CE2-CG1 4.02Å; F37-I45 HydrophobicContact CZ-CD1 3.79Å; F37-I45 HydrophobicContact CZ-CG1 4.08Å
38	E	84.9	Confident	87.8	Confident	106 Å²	106	67.2 Å²	67.2	50%	0.495	37%	0.365	S	S	.	.	S	Bend	trans	-69.6	-30	179.3	-164.3	174	155.8	0	0	112.3	D19 A21 F85	D19-E38 HydrophobicContact CB-CB 4.29Å; D19-E38 PolarHBondContact O-N 3.41Å; A21-E38 HydrophobicContact CB-CB 4.35Å; E38-F85 HydrophobicContact CG-CZ 4.08Å; E38-F85 VanDerWaalsContact OE1-CZ 3.23Å; E38-F85 WeakPolarHBondContact OE1-CZ 3.28Å
39	H	81.1	Confident	88.3	Confident	102 Å²	102	63.4 Å²	63.4	47%	0.472	33%	0.332	S	S	.	.	S	Bend	trans	-85.6	119.4	177.7	-70.7	-42.3	0	0	0	112.8	D19 F37 D41 R42	D19-H39 IonicContact OD2-CD2 2.96Å; D19-H39 IonicContact OD2-NE2 3.78Å; F37-H39 VanDerWaalsContact C-N 3.31Å; H39-D41 PolarHBondContact O-N 3.45Å; H39-R42 HydrophobicContact CB-CG 4.44Å; H39-R42 PolarHBondContact O-N 3.01Å
40	E	78.3	Confident	88.6	Confident	154 Å²	154	67.2 Å²	67.2	72%	0.72	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-27.1	174.8	-69.3	-169.5	-171	0	0	114	R42 K299	E40-R42 PolarHBondContact O-N 3.44Å; E40-K299 IonicContact OE2-NZ 2.8Å; E40-K299 PolarHBondContact OE2-NZ 3.29Å
41	D	79	Confident	88.8	Confident	103 Å²	103	64 Å²	64	55%	0.551	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-17.3	178.2	-83.6	15.7	0	0	0	113.4	H39 K456	H39-D41 PolarHBondContact O-N 3.45Å; D41-K456 IonicContact OD2-NZ 3.23Å; D41-K456 PolarHBondContact OD2-NZ 2.94Å
42	R	83.5	Confident	88.8	Confident	20 Å²	20	66.2 Å²	66.2	8%	0.075	35%	0.352	C	S	.	.	S	Bend	trans	-98.1	116.9	-179.1	-66.5	-171.2	72.9	162.2	10.7	110.9	D16 L18 F37 H39 E40 H375	D16-R42 PolarHBondContact O-NH2 2.82Å; D16-R42 IonicContact OD1-CZ 2.71Å; D16-R42 IonicContact OD1-NH1 3.93Å; D16-R42 PolarHBondContact OD1-NH1 3.19Å; D16-R42 IonicContact OD1-NH2 3.7Å; D16-R42 PolarHBondContact OD1-NH2 3.02Å; D16-R42 VanDerWaalsContact OD1-NH2 3.15Å; D16-R42 IonicContact OD2-NH2 2.66Å; L18-R42 PolarHBondContact O-NH1 2.67Å; F37-R42 HydrophobicContact CB-CB 3.81Å; F37-R42 HydrophobicContact CB-CG 4.39Å; F37-R42 HydrophobicContact CD2-CB 3.61Å; F37-R42 HydrophobicContact CD2-CG 4.48Å; F37-R42 VanDerWaalsContact CE1-CZ 3.41Å; F37-R42 HydrophobicContact CE2-CB 4.46Å; F37-R42 HydrophobicContact CG-CB 3.87Å; F37-R42 HydrophobicContact CG-CG 4.43Å; H39-R42 HydrophobicContact CB-CG 4.44Å; H39-R42 PolarHBondContact O-N 3.01Å; E40-R42 PolarHBondContact O-N 3.44Å; R42-H375 PolarHBondContact NE-CE1 3.45Å; R42-H375 PolarHBondContact NE-NE2 3.15Å; R42-H375 PolarHBondContact NH2-CE1 3.02Å
43	L	86.4	Confident	88.8	Confident	155 Å²	155	69.8 Å²	69.8	81%	0.812	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-64.4	137.8	169.6	-67.3	174.3	0	0	0	110.4
44	P	89.8	Confident	88.8	Confident	53 Å²	53	72.7 Å²	72.7	34%	0.344	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-63.6	142.7	177	26.3	-34.1	0	0	0	111.4	I35	I35-P44 CarbonylContact O-C 3.56Å; I35-P44 WeakPolarHBondContact O-CA 3.39Å; I35-P44 VanDerWaalsContact O-CB 3.29Å; I35-P44 WeakPolarHBondContact O-CB 3.29Å
45	I	91.2	Very high	88.8	Confident	43 Å²	43	73 Å²	73	22%	0.221	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	118.2	174.1	-58	170.8	0	0	0	108	V15 L17 S34 I35 F37 M47	V15-I45 HydrophobicContact CB-CD1 4.05Å; V15-I45 HydrophobicContact CG1-CD1 3.8Å; L17-I45 HydrophobicContact CD2-CD1 3.82Å; S34-I45 CarbonylContact C-O 3.51Å; S34-I45 WeakPolarHBondContact CA-O 3.49Å; I35-I45 HydrophobicContact CB-CB 4.3Å; I35-I45 PolarHBondContact N-O 3.06Å; I35-I45 PolarHBondContact O-N 2.8Å; F37-I45 HydrophobicContact CE2-CD1 4.25Å; F37-I45 HydrophobicContact CE2-CG1 4.02Å; F37-I45 HydrophobicContact CZ-CD1 3.79Å; F37-I45 HydrophobicContact CZ-CG1 4.08Å; I45-M47 HydrophobicContact CG2-CG 4.09Å
46	Q	91.2	Very high	88.7	Confident	129 Å²	129	75.5 Å²	75.5	60%	0.603	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	133.3	168.7	-65.7	-178.7	2	0	0	110.1	L33	L33-Q46 WeakPolarHBondContact O-CA 3.39Å
47	M	90.6	Very high	88.8	Confident	63 Å²	63	80.7 Å²	80.7	31%	0.31	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	151.3	172.5	-47.6	-157.3	-50.7	0	0	109.6	K32 L33 I45 W58 L62	K32-M47 VanDerWaalsContact CA-O 3.31Å; K32-M47 WeakPolarHBondContact CA-O 3.09Å; L33-M47 HydrophobicContact CD1-CE 4.13Å; L33-M47 HydrophobicContact CD2-CE 4.06Å; L33-M47 HydrophobicContact CG-CB 4.23Å; L33-M47 HydrophobicContact CG-CE 4.38Å; L33-M47 PolarHBondContact N-O 3.48Å; L33-M47 PolarHBondContact O-N 2.82Å; I45-M47 HydrophobicContact CG2-CG 4.09Å; M47-W58 HydrophobicContact CE-CE3 4.48Å; M47-L62 HydrophobicContact CE-CD1 3.96Å
48	A	91	Very high	88.9	Confident	75 Å²	75	85.1 Å²	85.1	62%	0.62	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	136.8	171.9	0	0	0	0	0	109.4	C31 K32	C31-A48 CarbonylContact O-C 3.53Å; C31-A48 VanDerWaalsContact O-CA 3.27Å; C31-A48 WeakPolarHBondContact O-CA 3.3Å; K32-A48 HydrophobicContact CG-CB 4.2Å
49	T	92.1	Very high	89.3	Confident	19 Å²	19	81 Å²	81	12%	0.117	42%	0.421	C	S	.	.			trans	-103.1	169.9	176.5	56.4	0	0	0	0	110.8	C31 L33 S51 R55 W58	C31-T49 PolarHBondContact O-N 3.13Å; C31-T49 PolarHBondContact O-OG1 3.33Å; L33-T49 HydrophobicContact CD2-CG2 4.34Å; T49-S51 PolarHBondContact OG1-O 2.69Å; T49-R55 HydrophobicContact CG2-CB 4.32Å; T49-R55 WeakPolarHBondContact OG1-CB 3.42Å; T49-W58 HydrophobicContact CG2-CG 4.3Å
50	V	91	Very high	89.8	Confident	135 Å²	135	81.6 Å²	81.6	82%	0.818	42%	0.423	S	S	*	.	S	Bend	trans	-79.4	-31.2	177.7	-172.6	0	0	0	0	111.1	E54	V50-E54 WeakPolarHBondContact CB-OE2 3.42Å; V50-E54 PolarHBondContact N-OE2 2.77Å
51	S	91	Very high	90.5	Very high	43 Å²	43	76.8 Å²	76.8	30%	0.301	41%	0.41	S	S	.	.	S	Bend	trans	-138.4	166.9	176.6	78.1	0	0	0	0	113.2	T49 E53 E54 R55	T49-S51 PolarHBondContact OG1-O 2.69Å; S51-E53 PolarHBondContact OG-N 3.29Å; S51-E54 WeakPolarHBondContact OG-CB 3.44Å; S51-E54 PolarHBondContact OG-N 3.21Å; S51-E54 VanDerWaalsContact OG-N 3.07Å; S51-R55 PolarHBondContact O-N 3.45Å; S51-R55 VanDerWaalsContact O-N 3.07Å
52	L	91	Very high	91.2	Very high	84 Å²	84	73.1 Å²	73.1	44%	0.44	39%	0.391	S	S	.	.	H	α-helix	trans	-65.4	-36.9	171.9	175.6	151.1	0	0	0	112	D30 R55 E56	D30-L52 HydrophobicContact CB-CD1 4.29Å; L52-R55 WeakPolarHBondContact O-CB 2.99Å; L52-R55 PolarHBondContact O-N 3.3Å; L52-E56 PolarHBondContact O-N 2.87Å
53	E	91.5	Very high	91.6	Very high	147 Å²	147	74.1 Å²	74.1	69%	0.687	40%	0.399	S	S	*	.	H	α-helix	trans	-63	-48.5	175.9	-65.1	171	156.4	0	0	109.9	S51 R55 E56 D57	S51-E53 PolarHBondContact OG-N 3.29Å; E53-R55 PolarHBondContact O-N 2.85Å; E53-E56 PolarHBondContact O-N 3.01Å; E53-E56 VanDerWaalsContact O-N 3.07Å; E53-D57 PolarHBondContact O-N 3.5Å
54	E	92.2	Very high	91.8	Very high	61 Å²	61	72.3 Å²	72.3	29%	0.285	39%	0.386	S	S	.	.	H	α-helix	trans	-60.5	-33.2	176.4	-156.7	-154.8	164.7	0	0	111.5	V50 S51 W58	V50-E54 WeakPolarHBondContact CB-OE2 3.42Å; V50-E54 PolarHBondContact N-OE2 2.77Å; S51-E54 WeakPolarHBondContact OG-CB 3.44Å; S51-E54 PolarHBondContact OG-N 3.21Å; S51-E54 VanDerWaalsContact OG-N 3.07Å; E54-W58 WeakPolarHBondContact O-CB 3.34Å; E54-W58 PolarHBondContact O-N 2.71Å; E54-W58 PolarHBondContact OE1-NE1 3.29Å
55	R	93.2	Very high	91.9	Very high	18 Å²	18	75.9 Å²	75.9	7%	0.068	40%	0.397	C	S	.	.	H	α-helix	trans	-61.1	-47.9	173.4	-171.9	-165.1	66.1	-168.6	-3.9	111.8	D30 K32 L33 T49 S51 L52 E53 W58 V59	D30-R55 WeakPolarHBondContact O-CD 3.33Å; D30-R55 VanDerWaalsContact O-CZ 3.27Å; D30-R55 PolarHBondContact O-NE 3.44Å; D30-R55 PolarHBondContact O-NH1 3.31Å; K32-R55 WeakPolarHBondContact O-CD 3.34Å; L33-R55 HydrophobicContact CB-CG 4.2Å; T49-R55 HydrophobicContact CG2-CB 4.32Å; T49-R55 WeakPolarHBondContact OG1-CB 3.42Å; S51-R55 PolarHBondContact O-N 3.45Å; S51-R55 VanDerWaalsContact O-N 3.07Å; L52-R55 WeakPolarHBondContact O-CB 2.99Å; L52-R55 PolarHBondContact O-N 3.3Å; E53-R55 PolarHBondContact O-N 2.85Å; R55-W58 PolarHBondContact O-N 2.82Å; R55-V59 HydrophobicContact CG-CG2 4.49Å; R55-V59 WeakPolarHBondContact O-CB 3.2Å; R55-V59 VanDerWaalsContact O-CG2 3.27Å; R55-V59 WeakPolarHBondContact O-CG2 3.45Å; R55-V59 PolarHBondContact O-N 2.97Å
56	E	91.4	Very high	91.9	Very high	57 Å²	57	74.1 Å²	74.1	27%	0.266	39%	0.387	S	S	.	.	H	α-helix	trans	-66.5	-41.9	-179.6	-62.2	-66	144.2	0	0	110.5	R25 L52 E53 W58 V59 Q60	R25-E56 IonicContact CZ-OE1 3.9Å; R25-E56 IonicContact CZ-OE2 3.71Å; R25-E56 IonicContact NH1-OE1 2.91Å; R25-E56 PolarHBondContact NH1-OE1 2.91Å; R25-E56 IonicContact NH1-OE2 2.77Å; R25-E56 PolarHBondContact NH1-OE2 3.21Å; L52-E56 PolarHBondContact O-N 2.87Å; E53-E56 PolarHBondContact O-N 3.01Å; E53-E56 VanDerWaalsContact O-N 3.07Å; E56-W58 PolarHBondContact O-N 3.1Å; E56-V59 PolarHBondContact O-N 3.48Å; E56-Q60 WeakPolarHBondContact O-CB 3.38Å; E56-Q60 PolarHBondContact O-N 2.99Å
57	D	92.5	Very high	91.8	Very high	108 Å²	108	69.7 Å²	69.7	58%	0.578	37%	0.37	S	S	*	.	H	α-helix	trans	-57.2	-48	173	-72.9	-17.8	0	0	0	111.8	E53 Q60 A61	E53-D57 PolarHBondContact O-N 3.5Å; D57-Q60 PolarHBondContact O-N 3.26Å; D57-A61 WeakPolarHBondContact O-CB 3.13Å; D57-A61 PolarHBondContact O-N 2.92Å
58	W	93.8	Very high	91.7	Very high	112 Å²	112	70.5 Å²	70.5	42%	0.424	38%	0.382	S	S	.	.	H	α-helix	trans	-63.9	-42.4	176.9	-85.9	110.7	0	0	0	112.5	L33 M47 T49 E54 R55 E56 L62	L33-W58 HydrophobicContact CD2-CB 3.71Å; M47-W58 HydrophobicContact CE-CE3 4.48Å; T49-W58 HydrophobicContact CG2-CG 4.3Å; E54-W58 WeakPolarHBondContact O-CB 3.34Å; E54-W58 PolarHBondContact O-N 2.71Å; E54-W58 PolarHBondContact OE1-NE1 3.29Å; R55-W58 PolarHBondContact O-N 2.82Å; E56-W58 PolarHBondContact O-N 3.1Å; W58-L62 HydrophobicContact CE3-CD1 4.29Å; W58-L62 HydrophobicContact CE3-CG 4.26Å; W58-L62 WeakPolarHBondContact O-CB 3.34Å; W58-L62 WeakPolarHBondContact O-CD1 3.39Å; W58-L62 WeakPolarHBondContact O-CG 3.39Å; W58-L62 PolarHBondContact O-N 3.34Å
59	V	93.4	Very high	91.6	Very high	20 Å²	20	71.3 Å²	71.3	12%	0.121	38%	0.375	C	S	.	.	H	α-helix	trans	-63.1	-44.6	177.7	168.1	0	0	0	0	110.6	V23 L33 R55 E56 T63	V23-V59 HydrophobicContact CG1-CB 4.46Å; V23-V59 HydrophobicContact CG1-CG1 4.29Å; V23-V59 HydrophobicContact CG1-CG2 4.24Å; L33-V59 HydrophobicContact CB-CG2 3.81Å; L33-V59 HydrophobicContact CD2-CG2 4.19Å; L33-V59 HydrophobicContact CG-CG2 4.43Å; R55-V59 HydrophobicContact CG-CG2 4.49Å; R55-V59 WeakPolarHBondContact O-CB 3.2Å; R55-V59 VanDerWaalsContact O-CG2 3.27Å; R55-V59 WeakPolarHBondContact O-CG2 3.45Å; R55-V59 PolarHBondContact O-N 2.97Å; E56-V59 PolarHBondContact O-N 3.48Å; V59-T63 WeakPolarHBondContact O-CB 3.37Å; V59-T63 PolarHBondContact O-N 3.05Å; V59-T63 PolarHBondContact O-OG1 2.79Å
60	Q	92.4	Very high	91.2	Very high	114 Å²	114	73.5 Å²	73.5	53%	0.533	40%	0.401	S	S	.	.	H	α-helix	trans	-66.2	-52.2	177.6	-178.2	168	-8.9	0	0	111.4	E56 D57 L62 T63 E64	E56-Q60 WeakPolarHBondContact O-CB 3.38Å; E56-Q60 PolarHBondContact O-N 2.99Å; D57-Q60 PolarHBondContact O-N 3.26Å; Q60-L62 PolarHBondContact O-N 3.49Å; Q60-T63 PolarHBondContact O-N 3.19Å; Q60-T63 VanDerWaalsContact O-N 3.14Å; Q60-E64 HydrophobicContact CG-CG 4.36Å; Q60-E64 VanDerWaalsContact CG-OE1 3.29Å; Q60-E64 WeakPolarHBondContact CG-OE1 3.48Å; Q60-E64 PolarHBondContact NE2-OE1 2.98Å; Q60-E64 WeakPolarHBondContact O-CG 3.43Å; Q60-E64 PolarHBondContact O-N 3.24Å
61	A	92.9	Very high	90.9	Very high	54 Å²	54	68.4 Å²	68.4	45%	0.446	37%	0.371	S	S	.	.	H	α-helix	trans	-61.9	-40	-178.3	0	0	0	0	0	112.7	D57 K65	D57-A61 WeakPolarHBondContact O-CB 3.13Å; D57-A61 PolarHBondContact O-N 2.92Å; A61-K65 WeakPolarHBondContact O-CB 3.47Å; A61-K65 PolarHBondContact O-N 3.5Å
62	L	92.9	Very high	90.4	Very high	26 Å²	26	66.9 Å²	66.9	14%	0.136	36%	0.359	C	S	.	.	H	α-helix	trans	-66.2	-44.3	173.4	-74	168.1	0	0	0	111.4	V23 L33 I35 M47 W58 Q60 K65 L66	V23-L62 HydrophobicContact CG1-CB 4.33Å; V23-L62 HydrophobicContact CG1-CD1 4.46Å; V23-L62 HydrophobicContact CG2-CB 4.35Å; L33-L62 HydrophobicContact CD1-CD1 4.16Å; I35-L62 HydrophobicContact CD1-CD1 4.03Å; M47-L62 HydrophobicContact CE-CD1 3.96Å; W58-L62 HydrophobicContact CE3-CD1 4.29Å; W58-L62 HydrophobicContact CE3-CG 4.26Å; W58-L62 WeakPolarHBondContact O-CB 3.34Å; W58-L62 WeakPolarHBondContact O-CD1 3.39Å; W58-L62 WeakPolarHBondContact O-CG 3.39Å; W58-L62 PolarHBondContact O-N 3.34Å; Q60-L62 PolarHBondContact O-N 3.49Å; L62-K65 PolarHBondContact O-N 2.78Å; L62-L66 HydrophobicContact CB-CD1 4.41Å; L62-L66 VanDerWaalsContact O-CB 3.24Å; L62-L66 WeakPolarHBondContact O-CB 3.47Å; L62-L66 WeakPolarHBondContact O-CD1 3.47Å; L62-L66 WeakPolarHBondContact O-CG 3.47Å; L62-L66 PolarHBondContact O-N 2.87Å
63	T	92	Very high	89.6	Confident	41 Å²	41	69.8 Å²	69.8	25%	0.252	38%	0.375	S	S	.	.	H	α-helix	trans	-61	-52	179.6	-63.4	0	0	0	0	111.3	V59 Q60 K65 L66 C67 M72	V59-T63 WeakPolarHBondContact O-CB 3.37Å; V59-T63 PolarHBondContact O-N 3.05Å; V59-T63 PolarHBondContact O-OG1 2.79Å; Q60-T63 PolarHBondContact O-N 3.19Å; Q60-T63 VanDerWaalsContact O-N 3.14Å; T63-K65 VanDerWaalsContact C-N 3.32Å; T63-K65 PolarHBondContact O-N 2.89Å; T63-L66 PolarHBondContact O-N 3.23Å; T63-C67 WeakPolarHBondContact O-CB 3.47Å; T63-C67 PolarHBondContact O-N 2.78Å; T63-C67 PolarHBondContact O-SG 2.8Å; T63-M72 HydrophobicContact CG2-CE 3.76Å
64	E	90.5	Very high	88.4	Confident	116 Å²	116	68 Å²	68	54%	0.542	38%	0.375	S	S	.	.	H	α-helix	trans	-59.1	-44	176.5	-72	178.7	-167.6	0	0	111.2	Q60 S68	Q60-E64 HydrophobicContact CG-CG 4.36Å; Q60-E64 VanDerWaalsContact CG-OE1 3.29Å; Q60-E64 WeakPolarHBondContact CG-OE1 3.48Å; Q60-E64 PolarHBondContact NE2-OE1 2.98Å; Q60-E64 WeakPolarHBondContact O-CG 3.43Å; Q60-E64 PolarHBondContact O-N 3.24Å; E64-S68 VanDerWaalsContact O-CB 3.31Å; E64-S68 WeakPolarHBondContact O-CB 3.26Å; E64-S68 PolarHBondContact O-N 2.64Å
65	K	91.5	Very high	86.8	Confident	129 Å²	129	68.3 Å²	68.3	56%	0.561	38%	0.382	S	S	*	.	H	α-helix	trans	-67.7	-45.6	-177.8	-169.6	63.7	-172.5	161.4	0	112.2	A61 L62 T63 S68 I69	A61-K65 WeakPolarHBondContact O-CB 3.47Å; A61-K65 PolarHBondContact O-N 3.5Å; L62-K65 PolarHBondContact O-N 2.78Å; T63-K65 VanDerWaalsContact C-N 3.32Å; T63-K65 PolarHBondContact O-N 2.89Å; K65-S68 PolarHBondContact O-N 2.93Å; K65-S68 PolarHBondContact O-OG 3.42Å; K65-I69 WeakPolarHBondContact O-CG1 3.11Å; K65-I69 PolarHBondContact O-N 3.5Å; K65-I69 VanDerWaalsContact O-N 3.16Å
66	L	90.7	Very high	84.9	Confident	5 Å²	5	73.9 Å²	73.9	3%	0.026	42%	0.418	C	S	.	.	H	α-helix	trans	-64.9	-39.7	179.5	-70.6	166.2	0	0	0	112.1	L17 C20 V23 L62 T63 I69 G70 C71 M72	L17-L66 HydrophobicContact CB-CD2 3.72Å; L17-L66 HydrophobicContact CD1-CD2 3.99Å; C20-L66 HydrophobicContact CB-CD1 4.44Å; V23-L66 HydrophobicContact CG2-CD1 3.65Å; L62-L66 HydrophobicContact CB-CD1 4.41Å; L62-L66 VanDerWaalsContact O-CB 3.24Å; L62-L66 WeakPolarHBondContact O-CB 3.47Å; L62-L66 WeakPolarHBondContact O-CD1 3.47Å; L62-L66 WeakPolarHBondContact O-CG 3.47Å; L62-L66 PolarHBondContact O-N 2.87Å; T63-L66 PolarHBondContact O-N 3.23Å; L66-I69 HydrophobicContact CD2-CD1 4.28Å; L66-I69 WeakPolarHBondContact O-CG1 3.38Å; L66-G70 PolarHBondContact O-N 2.97Å; L66-C71 HydrophobicContact CD2-CB 4.17Å; L66-C71 PolarHBondContact O-N 3.17Å; L66-M72 HydrophobicContact CB-CB 3.98Å; L66-M72 HydrophobicContact CB-CE 4.26Å; L66-M72 PolarHBondContact O-N 3.25Å
67	C	89.1	Confident	82.8	Confident	36 Å²	36	76.8 Å²	76.8	24%	0.243	44%	0.435	C	S	.	.	H	α-helix	trans	-63.6	-43.9	170.3	-69.4	0	0	0	0	111.5	T63 I69 G70 V74	T63-C67 WeakPolarHBondContact O-CB 3.47Å; T63-C67 PolarHBondContact O-N 2.78Å; T63-C67 PolarHBondContact O-SG 2.8Å; C67-I69 PolarHBondContact O-N 3.25Å; C67-G70 PolarHBondContact O-N 3.4Å; C67-V74 HydrophobicContact CB-CG2 4.48Å
68	S	89.2	Confident	80.8	Confident	80 Å²	80	78.3 Å²	78.3	56%	0.559	44%	0.443	S	S	*	.	H	α-helix	trans	-63.8	-24.5	-178.8	78.6	0	0	0	0	114.4	E64 K65	E64-S68 VanDerWaalsContact O-CB 3.31Å; E64-S68 WeakPolarHBondContact O-CB 3.26Å; E64-S68 PolarHBondContact O-N 2.64Å; K65-S68 PolarHBondContact O-N 2.93Å; K65-S68 PolarHBondContact O-OG 3.42Å
69	I	88.6	Confident	78.5	Confident	93 Å²	93	83.8 Å²	83.8	48%	0.477	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	4.2	176.9	66.4	177.1	0	0	0	112.9	K65 L66 C67 C71	K65-I69 WeakPolarHBondContact O-CG1 3.11Å; K65-I69 PolarHBondContact O-N 3.5Å; K65-I69 VanDerWaalsContact O-N 3.16Å; L66-I69 HydrophobicContact CD2-CD1 4.28Å; L66-I69 WeakPolarHBondContact O-CG1 3.38Å; C67-I69 PolarHBondContact O-N 3.25Å; I69-C71 VanDerWaalsContact C-N 3.27Å; I69-C71 HydrophobicContact CD1-CB 4.03Å; I69-C71 VanDerWaalsContact CD1-SG 3.59Å; I69-C71 HydrophobicContact CG1-CB 3.87Å; I69-C71 PolarHBondContact O-N 3.33Å
70	G	85.2	Confident	76.1	Confident	64 Å²	64	85.5 Å²	85.5	66%	0.66	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	15.8	179.7	0	0	0	0	0	115.3	L66 C67	L66-G70 PolarHBondContact O-N 2.97Å; C67-G70 PolarHBondContact O-N 3.4Å
71	C	83	Confident	73.7	Confident	28 Å²	28	84.9 Å²	84.9	19%	0.189	49%	0.492	C	S	.	.	S	Bend	trans	-88	-7.8	180	-69.5	0	0	0	0	113.8	C20 L66 I69	C20-C71 PolarHBondContact N-O 2.9Å; L66-C71 HydrophobicContact CD2-CB 4.17Å; L66-C71 PolarHBondContact O-N 3.17Å; I69-C71 VanDerWaalsContact C-N 3.27Å; I69-C71 HydrophobicContact CD1-CB 4.03Å; I69-C71 VanDerWaalsContact CD1-SG 3.59Å; I69-C71 HydrophobicContact CG1-CB 3.87Å; I69-C71 PolarHBondContact O-N 3.33Å
72	M	82.2	Confident	71	Confident	11 Å²	11	91.3 Å²	91.3	5%	0.054	51%	0.506	C	S	.	.	S	Bend	trans	-145.2	131.8	175.5	-175.3	169.1	70.5	0	0	109.4	C20 V23 T63 L66	C20-M72 HydrophobicContact CB-CB 4.46Å; C20-M72 WeakPolarHBondContact O-CA 3.48Å; C20-M72 WeakPolarHBondContact O-CB 3.22Å; C20-M72 VanDerWaalsContact O-CG 3.28Å; C20-M72 WeakPolarHBondContact O-CG 3.14Å; V23-M72 HydrophobicContact CG2-CE 4.35Å; V23-M72 HydrophobicContact CG2-SD 4.3Å; T63-M72 HydrophobicContact CG2-CE 3.76Å; L66-M72 HydrophobicContact CB-CB 3.98Å; L66-M72 HydrophobicContact CB-CE 4.26Å; L66-M72 PolarHBondContact O-N 3.25Å
73	N	74.1	Confident	68.4	Low	145 Å²	145	93.9 Å²	93.9	78%	0.775	52%	0.524	S	S	*	.			trans	-78.8	137.8	172	-74	-49.7	0	0	0	109.8	P75	N73-P75 WeakPolarHBondContact O-CD 3.39Å; N73-P75 VanDerWaalsContact O-N 3.12Å
74	V	65.8	Low	65.7	Low	111 Å²	111	103.2 Å²	103.2	67%	0.673	56%	0.555	S	S	*	*			trans	-58.3	117.1	178.2	-179.7	0	0	0	0	109.2	C67 T76	C67-V74 HydrophobicContact CB-CG2 4.48Å; V74-T76 PolarHBondContact O-N 3.46Å; V74-T76 VanDerWaalsContact O-N 3.12Å
75	P	59.3	Low	63.5	Low	66 Å²	66	105.4 Å²	105.4	43%	0.429	56%	0.563	S	S	.	*			trans	-72.2	111.4	-173.3	27.2	-33.4	0	0	0	110.4	N73 N77 L78	N73-P75 WeakPolarHBondContact O-CD 3.39Å; N73-P75 VanDerWaalsContact O-N 3.12Å; P75-N77 PolarHBondContact O-N 3.29Å; P75-L78 HydrophobicContact CG-CD1 4.13Å
76	T	51.8	Low	60.8	Low	136 Å²	136	102.5 Å²	102.5	83%	0.834	57%	0.57	S	S	*	*	S	Bend	trans	-68.9	-8.9	178.8	44.3	0	0	0	0	113.9	V74	V74-T76 PolarHBondContact O-N 3.46Å; V74-T76 VanDerWaalsContact O-N 3.12Å
77	N	47.5	Very low	58	Low	118 Å²	118	107 Å²	107	63%	0.631	60%	0.601	S	S	*	*			trans	-151.6	112.7	171.6	-85.4	-67.2	0	0	0	111.7	P75 Y79	P75-N77 PolarHBondContact O-N 3.29Å; N77-Y79 PolarHBondContact O-N 2.83Å
78	L	50.9	Low	55.6	Low	139 Å²	139	111.2 Å²	111.2	73%	0.728	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-11.5	177	-102	82.7	0	0	0	114.9	P75	P75-L78 HydrophobicContact CG-CD1 4.13Å
79	Y	46.2	Very low	53.1	Low	228 Å²	228	113 Å²	113	89%	0.894	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	2.6	-168.6	-76.2	-78.7	0	0	0	115.3	N77	N77-Y79 PolarHBondContact O-N 2.83Å
80	S	41.2	Very low	50.7	Low	56 Å²	56	117.4 Å²	117.4	39%	0.392	66%	0.659	S	S	.	*			trans	-83.6	118.5	174.8	61.9	0	0	0	0	111.1	Y82	S80-Y82 WeakPolarHBondContact CB-O 3.5Å; S80-Y82 PolarHBondContact O-N 2.85Å; S80-Y82 PolarHBondContact OG-O 2.96Å
81	A	42.9	Very low	48.5	Very low	100 Å²	100	121.8 Å²	121.8	83%	0.826	67%	0.668	S	S	*	*	S	Bend	trans	-57	-19.9	177.9	0	0	0	0	0	114.3
82	Y	36.3	Very low	46.3	Very low	190 Å²	190	129.8 Å²	129.8	75%	0.745	70%	0.702	S	S	*	*	S	Bend	trans	-142.4	137.6	159.7	-78.9	-92.9	0	0	0	107.9	S80 R84	S80-Y82 WeakPolarHBondContact CB-O 3.5Å; S80-Y82 PolarHBondContact O-N 2.85Å; S80-Y82 PolarHBondContact OG-O 2.96Å; Y82-R84 PolarHBondContact O-N 3.42Å
83	P	37.9	Very low	44.1	Very low	79 Å²	79	138.8 Å²	138.8	51%	0.513	74%	0.741	S	S	.	*			trans	-66.5	109.6	170.1	26.9	-29.7	0	0	0	108.3	F85	P83-F85 PolarHBondContact O-N 2.72Å
84	R	36.5	Very low	42.5	Very low	237 Å²	237	140.1 Å²	140.1	89%	0.894	75%	0.747	S	S	*	*			trans	-73.8	116.6	171.8	-71.3	-173.7	177.5	177.2	1.5	108	Y82 G86	Y82-R84 PolarHBondContact O-N 3.42Å; R84-G86 PolarHBondContact O-N 3.45Å
85	F	44.1	Very low	41.1	Very low	162 Å²	162	138 Å²	138	71%	0.711	75%	0.747	S	S	*	*			trans	-55.6	113.5	168.4	-74.4	-87.2	0	0	0	109.5	E38 P83 S87	E38-F85 HydrophobicContact CG-CZ 4.08Å; E38-F85 VanDerWaalsContact OE1-CZ 3.23Å; E38-F85 WeakPolarHBondContact OE1-CZ 3.28Å; P83-F85 PolarHBondContact O-N 2.72Å; F85-S87 PolarHBondContact O-N 3.39Å
86	G	33.7	Very low	40	Very low	69 Å²	69	141.3 Å²	141.3	71%	0.711	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-69.3	125.6	165.3	0	0	0	0	0	108.5	R84	R84-G86 PolarHBondContact O-N 3.45Å
87	S	33.2	Very low	39.2	Very low	99 Å²	99	139.9 Å²	139.9	69%	0.692	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-54.1	142	157.6	47.7	0	0	0	0	109	F85 S89	F85-S87 PolarHBondContact O-N 3.39Å; S87-S89 PolarHBondContact O-N 3.25Å; S87-S89 VanDerWaalsContact O-N 3.09Å
88	P	38.2	Very low	38.9	Very low	125 Å²	125	143 Å²	143	81%	0.812	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-62	118.1	174.4	27.1	-33	0	0	0	108.5	E90	P88-E90 PolarHBondContact O-N 3.15Å; P88-E90 VanDerWaalsContact O-N 3.14Å
89	S	35.8	Very low	38.4	Very low	116 Å²	116	144.5 Å²	144.5	81%	0.811	78%	0.776	S	S	*	*			trans	-66.3	113.2	174.5	-60.5	0	0	0	0	109.4	S87 D91	S87-S89 PolarHBondContact O-N 3.25Å; S87-S89 VanDerWaalsContact O-N 3.09Å; S89-D91 PolarHBondContact O-N 3.22Å
90	E	39.3	Very low	38.2	Very low	187 Å²	187	141.3 Å²	141.3	87%	0.874	77%	0.772	S	S	*	*			trans	-59.3	112.9	150.4	-64.5	-178.6	112.6	0	0	107.4	P88	P88-E90 PolarHBondContact O-N 3.15Å; P88-E90 VanDerWaalsContact O-N 3.14Å
91	D	38.1	Very low	38.3	Very low	155 Å²	155	143.4 Å²	143.4	83%	0.829	78%	0.784	S	S	*	*			trans	-178.5	89.5	149.6	-97.9	-27.8	0	0	0	110.6	S89	S89-D91 PolarHBondContact O-N 3.22Å
92	Q	36.8	Very low	38.2	Very low	197 Å²	197	145.4 Å²	145.4	92%	0.921	79%	0.785	S	S	*	*			trans	-163	85.9	161	-128.2	177.3	90.9	0	0	113.2
93	K	36.5	Very low	38.5	Very low	199 Å²	199	140.1 Å²	140.1	87%	0.865	78%	0.781	S	S	*	*			trans	-172.2	147.4	143.7	-111.8	169.4	-175.8	179.2	0	113.7
94	L	40.3	Very low	38.7	Very low	174 Å²	174	141.3 Å²	141.3	91%	0.911	79%	0.791	S	S	*	*			trans	67.8	137.2	-175.4	-70.7	71.3	0	0	0	114.5
95	G	36.3	Very low	39	Very low	65 Å²	65	134.7 Å²	134.7	67%	0.67	78%	0.781	S	S	*	*			cis	165	105	-6	0	0	0	0	0	113.9
96	T	36.8	Very low	38.9	Very low	136 Å²	136	133 Å²	133	83%	0.834	79%	0.785	S	S	*	*			trans	61.9	105.2	144.9	-34.9	0	0	0	0	121.1
97	S	35.2	Very low	39.5	Very low	106 Å²	106	138.4 Å²	138.4	74%	0.741	79%	0.791	S	S	*	*			trans	53.4	114.8	139.7	-55.2	0	0	0	0	123.6
98	Q	41.1	Very low	39.8	Very low	183 Å²	183	138 Å²	138	86%	0.855	79%	0.794	S	S	*	*				174.6	116.2	115.6	-91.5	169.3	35.6	0	0	108.6
99	Q	39.3	Very low	39.7	Very low	172 Å²	172	138 Å²	138	80%	0.804	80%	0.795	S	S	*	*				51.4	123.7	89.3	-96.6	-174	-12.3	0	0	113.4
100	M	43	Very low	40	Very low	161 Å²	161	138 Å²	138	79%	0.793	79%	0.792	S	S	*	*			cis	-153.7	179.9	30.1	-90.8	-68	-81.9	0	0	112.1
101	P	43	Very low	39.9	Very low	100 Å²	100	136.6 Å²	136.6	65%	0.649	79%	0.79	S	S	*	*			trans	-124.8	-148.8	-152	44.6	-30.3	0	0	0	116.1
102	V	41.6	Very low	40.1	Very low	141 Å²	141	133.8 Å²	133.8	86%	0.855	79%	0.788	S	S	*	*			trans	94.6	133.7	171.8	-173.1	0	0	0	0	113.9
103	A	41.9	Very low	40	Very low	79 Å²	79	132.8 Å²	132.8	65%	0.653	78%	0.784	S	S	*	*			cis	-149.6	162.6	13.2	0	0	0	0	0	115.6
104	S	42.2	Very low	40.1	Very low	104 Å²	104	129.6 Å²	129.6	73%	0.727	79%	0.785	S	S	*	*			trans	8.6	151	145.8	59.9	0	0	0	0	122.1
105	S	43.3	Very low	39.8	Very low	99 Å²	99	127.5 Å²	127.5	69%	0.692	78%	0.779	S	S	*	*			cis	-159.1	143.7	42.1	-56.5	0	0	0	0	115.1
106	T	41.1	Very low	39.9	Very low	127 Å²	127	128.6 Å²	128.6	78%	0.779	78%	0.777	S	S	*	*				19.7	140.3	124.7	2.7	0	0	0	0	119.2
107	E	45.9	Very low	39.9	Very low	182 Å²	182	131.2 Å²	131.2	85%	0.85	77%	0.773	S	S	*	*			cis	-155.3	173.2	31.4	-78.7	-168.4	125.7	0	0	110.2
108	A	39.7	Very low	40.1	Very low	90 Å²	90	133 Å²	133	74%	0.744	77%	0.77	S	S	*	*			cis	-167	-167.9	-18.9	0	0	0	0	0	110.4
109	C	37.1	Very low	39.8	Very low	124 Å²	124	128.4 Å²	128.4	84%	0.838	76%	0.758	S	S	*	*			trans	-120.8	-172.1	178.4	-80.9	0	0	0	0	110.2
110	P	42.5	Very low	40	Very low	116 Å²	116	128.8 Å²	128.8	75%	0.753	76%	0.764	S	S	*	*			cis	-149.5	168.8	15.8	43.7	-22	0	0	0	120.9
111	L	36.7	Very low	39.8	Very low	159 Å²	159	132 Å²	132	83%	0.832	77%	0.768	S	S	*	*			trans	25.1	129.1	134.1	-141.7	83.8	0	0	0	123.8
112	A	41.1	Very low	39.4	Very low	95 Å²	95	133 Å²	133	79%	0.785	77%	0.774	S	S	*	*			trans	-168.5	113.7	137.5	0	0	0	0	0	107.8
113	E	36.4	Very low	39.3	Very low	177 Å²	177	133 Å²	133	83%	0.827	78%	0.775	S	S	*	*				52.4	107.6	82.1	-73.5	-163.2	152.7	0	0	116.3
114	C	38.2	Very low	39	Very low	132 Å²	132	135.7 Å²	135.7	89%	0.892	78%	0.783	S	S	*	*				-161	140.6	128.7	-136.6	0	0	0	0	112.4
115	T	32.6	Very low	39	Very low	129 Å²	129	135.3 Å²	135.3	79%	0.791	79%	0.785	S	S	*	*			trans	-83.8	179.3	169.3	60.5	0	0	0	0	108.9
116	S	39.1	Very low	38.6	Very low	89 Å²	89	135 Å²	135	62%	0.622	79%	0.789	S	S	*	*			cis	-167.2	-174.3	21.4	38.6	0	0	0	0	109.3
117	Y	37.6	Very low	38.9	Very low	190 Å²	190	135.5 Å²	135.5	75%	0.745	79%	0.792	S	S	*	*			trans	-7.3	162.7	159	83.3	-30.3	0	0	0	121.6
118	E	38.8	Very low	38.6	Very low	144 Å²	144	133.9 Å²	133.9	67%	0.673	79%	0.789	S	S	*	*			cis	-163.1	168.6	24.6	-146.5	-164.8	131.6	0	0	112.8
119	S	35.4	Very low	38.7	Very low	87 Å²	87	134.1 Å²	134.1	61%	0.608	79%	0.791	S	S	*	*			trans	32.2	128.1	145.8	-69.6	0	0	0	0	121.9
120	L	42.6	Very low	39	Very low	179 Å²	179	133.8 Å²	133.8	94%	0.937	79%	0.787	S	S	*	*				-167.5	149.8	105.9	-98.7	168.3	0	0	0	113.4
121	R	38.1	Very low	38.6	Very low	230 Å²	230	135.5 Å²	135.5	87%	0.868	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-88.7	167.3	-171	-106.2	-176	172	170.6	-2.2	113.4
122	P	35.3	Very low	38.9	Very low	121 Å²	121	134.7 Å²	134.7	79%	0.786	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-82.1	147.3	-174.4	34.1	-35.1	0	0	0	113.3
123	T	39.2	Very low	39.1	Very low	141 Å²	141	138.1 Å²	138.1	87%	0.865	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-99.5	129.9	177	-45.9	0	0	0	0	111.4
124	V	36.1	Very low	39.1	Very low	135 Å²	135	137.2 Å²	137.2	82%	0.818	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-74	136.2	175.1	-176.6	0	0	0	0	110
125	A	41.3	Very low	39.4	Very low	95 Å²	95	140 Å²	140	79%	0.785	79%	0.791	S	S	*	*			trans	-138	107.6	164.4	0	0	0	0	0	109.5
126	A	35.5	Very low	39.8	Very low	92 Å²	92	142.2 Å²	142.2	76%	0.76	79%	0.792	S	S	*	*			trans	-81.8	140.1	168.2	0	0	0	0	0	109.5
127	V	47.9	Very low	39.8	Very low	139 Å²	139	146.7 Å²	146.7	84%	0.842	80%	0.803	S	S	*	*			trans	-141.3	132.3	163.7	-176.4	0	0	0	0	108
128	D	40.1	Very low	39.9	Very low	148 Å²	148	147.9 Å²	147.9	79%	0.791	81%	0.808	S	S	*	*			trans	-80.2	147.5	-171.6	-65.3	-74.7	0	0	0	115.1
129	A	42	Very low	40	Very low	95 Å²	95	147.6 Å²	147.6	79%	0.785	81%	0.811	S	S	*	*			trans	64	171.6	141.7	0	0	0	0	0	119.1
130	P	41.6	Very low	40.4	Very low	117 Å²	117	149.6 Å²	149.6	76%	0.76	82%	0.819	S	S	*	*			cis	-125.7	-176	-6.2	35.6	-16.5	0	0	0	115
131	D	35.4	Very low	40.3	Very low	152 Å²	152	146 Å²	146	81%	0.813	81%	0.806	S	S	*	*			trans	-38.2	146.3	171.9	-57.2	-72.2	0	0	0	116.7
132	N	41.9	Very low	40.2	Very low	141 Å²	141	143.7 Å²	143.7	75%	0.754	81%	0.805	S	S	*	*			trans	-151.8	97.8	149.3	-135.8	-20.8	0	0	0	115.2
133	M	46.5	Very low	40.6	Very low	168 Å²	168	143.7 Å²	143.7	83%	0.828	81%	0.808	S	S	*	*			trans	43.4	118.4	142.9	-63.3	-162.9	-104.9	0	0	122.1
134	D	36.6	Very low	40.4	Very low	158 Å²	158	143.1 Å²	143.1	85%	0.845	80%	0.804	S	S	*	*			trans	-48	147.9	146.5	-101.9	-46.8	0	0	0	113.1
135	M	43.6	Very low	40.8	Very low	191 Å²	191	143.5 Å²	143.5	94%	0.941	81%	0.807	S	S	*	*			trans	-139.5	63.8	164.8	-164.4	-173.7	-77.5	0	0	111.4
136	E	40.9	Very low	40.9	Very low	174 Å²	174	145.4 Å²	145.4	81%	0.813	80%	0.799	S	S	*	*			trans	-102	104.4	156.6	-78.7	-156.5	149.5	0	0	110.3
137	Q	39.4	Very low	41.5	Very low	183 Å²	183	147.1 Å²	147.1	86%	0.855	81%	0.806	S	S	*	*			trans	-176.9	121.7	151.1	-108.8	159.8	75.6	0	0	112.2
138	Y	40.7	Very low	41.2	Very low	215 Å²	215	148.2 Å²	148.2	84%	0.843	80%	0.799	S	S	*	*			trans	176.5	92.6	147	-94.5	-69	0	0	0	105.4
139	L	40.8	Very low	41.6	Very low	139 Å²	139	152.8 Å²	152.8	73%	0.728	81%	0.806	S	S	*	*				59.4	104.2	99.9	-65	165.9	0	0	0	112.4
140	V	42.7	Very low	41.6	Very low	128 Å²	128	152.6 Å²	152.6	78%	0.776	80%	0.804	S	S	*	*				70.7	132.4	57	-179.2	0	0	0	0	112.2
141	P	40.2	Very low	41.8	Very low	103 Å²	103	152.7 Å²	152.7	67%	0.669	81%	0.808	S	S	*	*			cis	-137.8	-164.5	-30.9	41	-20.5	0	0	0	113.6
142	E	36.9	Very low	42.1	Very low	182 Å²	182	150.2 Å²	150.2	85%	0.85	80%	0.802	S	S	*	*			trans	23.8	126.5	152.8	-66.3	-180	144.3	0	0	122.5
143	S	42.4	Very low	42.5	Very low	121 Å²	121	154.2 Å²	154.2	85%	0.846	81%	0.807	S	S	*	*				-175.8	149.1	113.7	38.6	0	0	0	0	115.2
144	T	36.4	Very low	42.6	Very low	129 Å²	129	152.1 Å²	152.1	79%	0.791	80%	0.803	S	S	*	*			trans	-46.7	135.8	175.4	-42.1	0	0	0	0	116.6
145	V	44.8	Very low	43.3	Very low	143 Å²	143	148.9 Å²	148.9	87%	0.867	79%	0.793	S	S	*	*			trans	-138.3	121.4	150.4	-178.7	0	0	0	0	109.7
146	E	41.5	Very low	43.5	Very low	135 Å²	135	146.6 Å²	146.6	63%	0.631	79%	0.785	S	S	*	*			trans	-68	150.6	171.4	-68.4	179.2	86.4	0	0	111.9	K148	E146-K148 VanDerWaalsContact OE1-CE 3.3Å; E146-K148 WeakPolarHBondContact OE1-CE 3.15Å; E146-K148 IonicContact OE1-NZ 2.65Å; E146-K148 PolarHBondContact OE1-NZ 2.9Å; E146-K148 IonicContact OE2-NZ 3.18Å
147	S	49.8	Very low	44.1	Very low	129 Å²	129	145.6 Å²	145.6	90%	0.902	78%	0.783	S	S	*	*			trans	-141.9	115.2	151.4	-149.9	0	0	0	0	111.7
148	K	41.8	Very low	44.5	Very low	161 Å²	161	142.2 Å²	142.2	70%	0.7	78%	0.775	S	S	*	*			trans	-91.1	129.7	-178.1	-72.6	165.2	165.8	121.4	0	110.8	E146	E146-K148 VanDerWaalsContact OE1-CE 3.3Å; E146-K148 WeakPolarHBondContact OE1-CE 3.15Å; E146-K148 IonicContact OE1-NZ 2.65Å; E146-K148 PolarHBondContact OE1-NZ 2.9Å; E146-K148 IonicContact OE2-NZ 3.18Å
149	R	48.5	Very low	44.7	Very low	245 Å²	245	139.5 Å²	139.5	93%	0.925	77%	0.77	S	S	*	*			trans	-166.5	95.8	151.1	-103.5	168.1	-171.7	-175	2.7	106.7
150	A	40.8	Very low	44.8	Very low	91 Å²	91	140.7 Å²	140.7	75%	0.752	77%	0.772	S	S	*	*				83.4	138.9	66.5	0	0	0	0	0	113.3
151	S	45.5	Very low	44.9	Very low	119 Å²	119	140 Å²	140	83%	0.832	77%	0.77	S	S	*	*			trans	81.4	126.2	-177.8	-49.7	0	0	0	0	116.1
152	S	43.4	Very low	45.3	Very low	100 Å²	100	141 Å²	141	70%	0.699	77%	0.774	S	S	*	*			cis	157.6	127.5	-21.4	45.2	0	0	0	0	107.6
153	R	49.6	Very low	45.7	Very low	225 Å²	225	138.4 Å²	138.4	85%	0.849	77%	0.766	S	S	*	*				158.5	135.7	124.5	-94.1	-175.7	158.7	170.7	-6.4	113.8
154	T	47.2	Very low	45.8	Very low	123 Å²	123	140 Å²	140	76%	0.755	76%	0.761	S	S	*	*			trans	55.1	134.1	146.1	56.5	0	0	0	0	119.2
155	S	53.2	Low	46.3	Very low	91 Å²	91	141.9 Å²	141.9	64%	0.636	76%	0.764	S	S	*	*			cis	-164.2	137.5	5.4	40.2	0	0	0	0	110.1
156	D	46.9	Very low	46.1	Very low	143 Å²	143	139 Å²	139	77%	0.765	76%	0.755	S	S	*	*				43.7	135.1	119.9	-33.2	-46.9	0	0	0	118.1
157	I	52.8	Low	46.2	Very low	152 Å²	152	140.1 Å²	140.1	78%	0.779	77%	0.766	S	S	*	*			cis	-163.2	129.6	48.5	-86.3	-170.1	0	0	0	112
158	V	48.6	Very low	45.7	Very low	113 Å²	113	139.4 Å²	139.4	69%	0.685	76%	0.756	S	S	*	*			trans	62.1	110.5	131.4	179.4	0	0	0	0	121.7
159	E	44.4	Very low	45.9	Very low	157 Å²	157	142.1 Å²	142.1	73%	0.734	77%	0.768	S	S	*	*				74.3	151.1	104.7	-55.6	-173.6	174.3	0	0	116.1
160	Q	43.5	Very low	45.4	Very low	164 Å²	164	135.8 Å²	135.8	77%	0.766	76%	0.761	S	S	*	*			cis	-159.3	152.2	26.3	-153.4	167.2	68.4	0	0	112.3
161	P	45.2	Very low	45.5	Very low	113 Å²	113	137.5 Å²	137.5	73%	0.734	77%	0.766	S	S	*	*			trans	-120.2	162.2	176.7	39.7	-29.5	0	0	0	114.8
162	T	47.6	Very low	45.1	Very low	124 Å²	124	139.2 Å²	139.2	76%	0.761	77%	0.766	S	S	*	*			trans	-160.7	123.5	160.3	-15.5	0	0	0	0	112.6
163	D	45.9	Very low	45.4	Very low	128 Å²	128	141.3 Å²	141.3	68%	0.684	78%	0.775	S	S	*	*			trans	37.8	149.4	134.9	-63	-28.6	0	0	0	121.7
164	Q	44.1	Very low	45.1	Very low	156 Å²	156	135.9 Å²	135.9	73%	0.729	77%	0.771	S	S	*	*			cis	175.8	177.3	-3.6	-107.6	175.6	56.5	0	0	105.1
165	I	47.7	Very low	45.1	Very low	167 Å²	167	141.6 Å²	141.6	86%	0.856	78%	0.779	S	S	*	*			trans	103.3	120.5	164.4	-57.4	163.7	0	0	0	113.9
166	A	40.8	Very low	44.7	Very low	82 Å²	82	141.8 Å²	141.8	68%	0.678	78%	0.78	S	S	*	*			trans	-91.2	150.3	169.4	0	0	0	0	0	109.7
167	D	42.7	Very low	45.2	Very low	160 Å²	160	144 Å²	144	86%	0.856	79%	0.788	S	S	*	*				-162.2	162.5	120.2	-122.2	-36.7	0	0	0	114.7
168	T	38.9	Very low	44.9	Very low	114 Å²	114	145.2 Å²	145.2	70%	0.699	79%	0.791	S	S	*	*			trans	-69.8	134.3	-173	-52.7	0	0	0	0	113.5
169	F	46.8	Very low	45.3	Very low	217 Å²	217	149.1 Å²	149.1	95%	0.952	80%	0.798	S	S	*	*			trans	-159.4	147.6	143.1	-96.5	-66	0	0	0	112.4
170	S	37.5	Very low	46.2	Very low	112 Å²	112	146.9 Å²	146.9	78%	0.783	80%	0.798	S	S	*	*			trans	-105.8	135.7	178.7	-178.1	0	0	0	0	110.7
171	C	43.4	Very low	47.4	Very low	127 Å²	127	145.1 Å²	145.1	86%	0.858	80%	0.8	S	S	*	*			trans	-168.5	138.8	155.6	-119.5	0	0	0	0	111.9
172	D	37.7	Very low	48.2	Very low	155 Å²	155	147.5 Å²	147.5	83%	0.829	81%	0.806	S	S	*	*			trans	-60.6	153.6	164.8	-72.4	-73	0	0	0	112.5
173	V	48.3	Very low	49.4	Very low	145 Å²	145	146.9 Å²	146.9	88%	0.879	80%	0.804	S	S	*	*			trans	-178	142	130.1	144	0	0	0	0	111.6
174	S	43.1	Very low	50.1	Low	111 Å²	111	146.7 Å²	146.7	78%	0.776	81%	0.81	S	S	*	*			trans	-73.1	139.5	-173.5	-42.2	0	0	0	0	115.7
175	R	47.3	Very low	51	Low	243 Å²	243	150.4 Å²	150.4	92%	0.917	82%	0.817	S	S	*	*			trans	-144.2	104.7	147.3	-81.2	-175.9	176.2	177.3	-1.6	108
176	S	44.9	Very low	51.5	Low	95 Å²	95	149.5 Å²	149.5	66%	0.664	81%	0.814	S	S	*	*				58.5	93.8	75.9	-164.7	0	0	0	0	113
177	M	57.6	Low	51.5	Low	189 Å²	189	151 Å²	151	93%	0.931	82%	0.819	S	S	*	*			trans	-116.9	111.9	159.1	-87.1	-72.4	155.4	0	0	107.2
178	Q	46.3	Very low	52	Low	178 Å²	178	150.1 Å²	150.1	83%	0.832	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-76.9	137.7	-170.7	-74	174.5	-49.5	0	0	112
179	K	57.9	Low	52.2	Low	194 Å²	194	151.5 Å²	151.5	84%	0.843	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-76.8	137.9	172.2	-169.8	176.7	-175.4	177.8	0	109.2
180	P	62.3	Low	51.9	Low	111 Å²	111	145.8 Å²	145.8	72%	0.721	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-64.2	142.7	178.9	25.9	-34.1	0	0	0	111.5
181	P	70.4	Confident	52.1	Low	126 Å²	126	148.8 Å²	148.8	82%	0.818	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-75	146.5	179.4	31.2	-34.5	0	0	0	111.7
182	L	61.6	Low	52.1	Low	163 Å²	163	148.3 Å²	148.3	85%	0.853	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-79.9	149.8	169.1	-72.4	168.2	0	0	0	110.3
183	P	72.8	Confident	52.2	Low	111 Å²	111	145.9 Å²	145.9	72%	0.721	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-68.1	159	-178	27.7	-35.2	0	0	0	113
184	P	61.1	Low	51.8	Low	124 Å²	124	147.2 Å²	147.2	81%	0.805	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-65.2	153.5	179.6	-16.6	31.1	0	0	0	112.3
185	R	63	Low	51.7	Low	234 Å²	234	148 Å²	148	88%	0.883	80%	0.799	S	S	*	*			trans	-103.3	107	175.7	-168.5	178.7	-169.5	172.5	2.9	109.6
186	D	57.5	Low	51.5	Low	149 Å²	149	144.2 Å²	144.2	80%	0.797	80%	0.796	S	S	*	*			trans	-59.1	140.1	176.1	-68.3	-50.8	0	0	0	111.7
187	S	39.8	Very low	51.1	Low	113 Å²	113	143.5 Å²	143.5	79%	0.79	80%	0.795	S	S	*	*			trans	-123.6	110.8	-177.8	-61.6	0	0	0	0	109
188	I	54.4	Low	50.4	Low	142 Å²	142	144 Å²	144	73%	0.728	79%	0.793	S	S	*	*			trans	-130.6	111.6	178.9	-63.7	-177.4	0	0	0	108.8
189	I	43.1	Very low	50.2	Low	143 Å²	143	142 Å²	142	73%	0.733	79%	0.793	S	S	*	*			trans	44.6	117.8	138.5	-49.5	171.2	0	0	0	115.4
190	S	39.3	Very low	49.3	Very low	97 Å²	97	142.6 Å²	142.6	68%	0.678	80%	0.796	S	S	*	*				-176.5	164.2	60.6	10.3	0	0	0	0	112.7
191	H	42.4	Very low	48.2	Very low	174 Å²	174	142.9 Å²	142.9	81%	0.806	80%	0.8	S	S	*	*			trans	8.9	144.9	151.3	-36.5	-62.9	0	0	0	119.8
192	S	42.9	Very low	46.9	Very low	118 Å²	118	142.7 Å²	142.7	83%	0.825	80%	0.799	S	S	*	*			cis	-158.5	167.6	28.2	51.4	0	0	0	0	113.3
193	S	40.4	Very low	46.2	Very low	104 Å²	104	143.2 Å²	143.2	73%	0.727	80%	0.801	S	S	*	*			trans	-65.6	148.5	-174.6	-41.3	0	0	0	0	115.2
194	N	40.2	Very low	44.7	Very low	172 Å²	172	142.8 Å²	142.8	92%	0.92	80%	0.8	S	S	*	*				-155.7	145	125.7	-103.3	-30	0	0	0	112.6
195	V	41.5	Very low	43.8	Very low	128 Å²	128	144.8 Å²	144.8	78%	0.776	80%	0.799	S	S	*	*			trans	-103.4	138.1	-170	171.2	0	0	0	0	109.8
196	L	43	Very low	42.8	Very low	163 Å²	163	140.7 Å²	140.7	85%	0.853	80%	0.795	S	S	*	*			trans	-169.2	129.1	136.8	-103.7	165.8	0	0	0	109.5
197	A	35.6	Very low	42.1	Very low	80 Å²	80	140 Å²	140	66%	0.661	80%	0.795	S	S	*	*			trans	-112.6	144.2	178.9	0	0	0	0	0	110
198	F	41.9	Very low	42.2	Very low	201 Å²	201	140.5 Å²	140.5	88%	0.882	79%	0.793	S	S	*	*			trans	-137.2	144.8	156.9	-98.3	-79.5	0	0	0	110.5
199	T	43.8	Very low	41.6	Very low	136 Å²	136	139.6 Å²	139.6	83%	0.834	79%	0.794	S	S	*	*			trans	-97.9	159	-161.3	38.1	0	0	0	0	113.7
200	K	39.2	Very low	41.4	Very low	206 Å²	206	137.5 Å²	137.5	90%	0.896	79%	0.792	S	S	*	*			trans	-69.3	148.7	174.6	-65.2	172.1	172.8	177.1	0	112.6
201	S	39.2	Very low	41.4	Very low	117 Å²	117	139.1 Å²	139.1	82%	0.818	79%	0.793	S	S	*	*			trans	-160.1	134.2	137.5	53.2	0	0	0	0	111.4
202	P	42.8	Very low	41.4	Very low	122 Å²	122	137.3 Å²	137.3	79%	0.792	79%	0.79	S	S	*	*			trans	-114.8	143.3	167.4	36.9	-27.2	0	0	0	112.1
203	I	45.8	Very low	41.3	Very low	174 Å²	174	136 Å²	136	89%	0.892	78%	0.78	S	S	*	*			trans	-138.3	148.9	165.1	-63.4	-175.3	0	0	0	108.9
204	S	41.1	Very low	41.4	Very low	101 Å²	101	136.7 Å²	136.7	71%	0.706	79%	0.785	S	S	*	*			trans	-97	-179.6	-163.9	-50.3	0	0	0	0	115.5
205	E	43.8	Very low	41.5	Very low	167 Å²	167	132.4 Å²	132.4	78%	0.78	77%	0.773	S	S	*	*			trans	95.3	100.7	144.5	-79	169	-154.1	0	0	121.7
206	N	40.4	Very low	41.5	Very low	148 Å²	148	136.6 Å²	136.6	79%	0.791	78%	0.777	S	S	*	*				62.9	143.3	118.9	-68.1	-18.2	0	0	0	123.6
207	V	44.5	Very low	41.4	Very low	134 Å²	134	136.5 Å²	136.5	81%	0.812	78%	0.777	S	S	*	*			trans	127.6	98.8	160.4	170.3	0	0	0	0	109
208	V	40.5	Very low	41.7	Very low	123 Å²	123	137.6 Å²	137.6	75%	0.745	78%	0.775	S	S	*	*				93.9	109.2	56.7	167.6	0	0	0	0	113.2
209	V	41.4	Very low	41.7	Very low	124 Å²	124	133 Å²	133	75%	0.752	77%	0.766	S	S	*	*			trans	83.3	97.7	145.4	167.8	0	0	0	0	121.2
210	S	39.9	Very low	41.5	Very low	98 Å²	98	132.6 Å²	132.6	69%	0.685	76%	0.764	S	S	*	*				94.4	131.5	113.3	-64.8	0	0	0	0	125.5
211	N	39.9	Very low	41.1	Very low	131 Å²	131	128.3 Å²	128.3	70%	0.701	76%	0.759	S	S	*	*			trans	84	130.8	136.4	-89.5	51.5	0	0	0	123.6
212	D	40.9	Very low	41.1	Very low	137 Å²	137	127.9 Å²	127.9	73%	0.733	76%	0.756	S	S	*	*			trans	63.5	151.1	146.5	-62.4	-35.3	0	0	0	120
213	S	41.6	Very low	40.6	Very low	90 Å²	90	128.3 Å²	128.3	63%	0.629	76%	0.757	S	S	*	*			cis	-171.4	158.4	-27.6	59.6	0	0	0	0	107.2
214	S	41.6	Very low	40.3	Very low	119 Å²	119	128.4 Å²	128.4	83%	0.832	76%	0.758	S	S	*	*			trans	63.4	164.6	169.6	84.3	0	0	0	0	115.6
215	A	43	Very low	40	Very low	81 Å²	81	128.7 Å²	128.7	67%	0.669	76%	0.76	S	S	*	*			cis	-160.7	150	-31.6	0	0	0	0	0	107.5
216	Y	40.7	Very low	39.6	Very low	216 Å²	216	125 Å²	125	85%	0.847	76%	0.759	S	S	*	*			trans	17.8	120.5	165.9	-62.7	-80.5	0	0	0	120.2
217	D	42.4	Very low	39.3	Very low	162 Å²	162	123.3 Å²	123.3	87%	0.866	76%	0.758	S	S	*	*			trans	-145.8	145.1	134.3	-129.1	-26.8	0	0	0	111.8
218	V	42.2	Very low	39	Very low	102 Å²	102	125.1 Å²	125.1	62%	0.618	76%	0.763	S	S	*	*			trans	-131.6	132.2	-176.3	175.4	0	0	0	0	109.3
219	P	41.6	Very low	38.7	Very low	106 Å²	106	127.3 Å²	127.3	69%	0.688	77%	0.769	S	S	*	*			trans	-123.1	126.1	152.3	1.1	21.3	0	0	0	114.5
220	T	39.9	Very low	38.4	Very low	127 Å²	127	127.1 Å²	127.1	78%	0.779	77%	0.773	S	S	*	*			trans	37.3	131.6	130.8	52.5	0	0	0	0	122.4
221	S	30.7	Very low	38.3	Very low	115 Å²	115	126.6 Å²	126.6	80%	0.804	78%	0.775	S	S	*	*			trans	-65.2	146.1	169.6	48.9	0	0	0	0	116.4
222	S	38.4	Very low	38.4	Very low	108 Å²	108	130 Å²	130	76%	0.755	79%	0.789	S	S	*	*			trans	-148	110.6	146.1	48	0	0	0	0	112.1
223	T	32.4	Very low	38.4	Very low	132 Å²	132	133.5 Å²	133.5	81%	0.81	79%	0.792	S	S	*	*			trans	3.6	126.9	137.7	51.3	0	0	0	0	118.5
224	L	39.2	Very low	38.3	Very low	175 Å²	175	139.7 Å²	139.7	92%	0.916	80%	0.801	S	S	*	*			trans	-152	135.8	133.2	-109.1	171.4	0	0	0	111.1
225	S	34.3	Very low	38.5	Very low	108 Å²	108	139.8 Å²	139.8	76%	0.755	80%	0.802	S	S	*	*			trans	-93.2	151.6	-178.7	44.8	0	0	0	0	111.8
226	A	36.8	Very low	38.1	Very low	90 Å²	90	144.6 Å²	144.6	74%	0.744	81%	0.811	S	S	*	*				175.5	126.7	125.7	0	0	0	0	0	113.2
227	S	32.7	Very low	38.1	Very low	112 Å²	112	138.8 Å²	138.8	78%	0.783	80%	0.799	S	S	*	*			trans	38.8	125.5	131.4	-50.4	0	0	0	0	121.2
228	L	39.4	Very low	38	Very low	172 Å²	172	138.8 Å²	138.8	90%	0.901	80%	0.799	S	S	*	*				-167.6	114.5	104.2	-100.5	163.1	0	0	0	112.2
229	L	33.3	Very low	38.2	Very low	169 Å²	169	139.1 Å²	139.1	89%	0.885	81%	0.805	S	S	*	*			trans	-110	117.2	166.2	-95.4	169.4	0	0	0	108.7
230	S	35.5	Very low	37.9	Very low	119 Å²	119	143 Å²	143	83%	0.832	81%	0.814	S	S	*	*			trans	173.5	149.1	159.9	-84.3	0	0	0	0	108.6
231	A	37.2	Very low	38.4	Very low	87 Å²	87	142.6 Å²	142.6	72%	0.719	81%	0.814	S	S	*	*			cis	-167.5	150	-17.8	0	0	0	0	0	106.7
232	M	43.6	Very low	38.8	Very low	203 Å²	203	142.8 Å²	142.8	100%	1	82%	0.816	S	S	*	*			trans	-164.1	132.5	147.9	-114.1	173.3	141.2	0	0	110.8
233	R	39.8	Very low	39.6	Very low	211 Å²	211	144.3 Å²	144.3	80%	0.796	82%	0.82	S	S	*	*			trans	-127.7	141.9	-172.1	-112.5	-175.5	175.6	-179.7	-0.1	108.9
234	R	40.3	Very low	40.2	Very low	219 Å²	219	146.8 Å²	146.8	83%	0.826	82%	0.822	S	S	*	*			trans	64.6	138	159.5	-59.9	173.4	173.5	-179.8	-5.4	114.5
235	S	44.8	Very low	40.3	Very low	122 Å²	122	144.9 Å²	144.9	85%	0.853	82%	0.818	S	S	*	*				-164.6	159.3	50.4	42.6	0	0	0	0	113.7
236	E	36	Very low	40.7	Very low	181 Å²	181	144.7 Å²	144.7	85%	0.846	81%	0.813	S	S	*	*			trans	-120.7	179.5	167.2	-110.9	-160.8	172.9	0	0	108
237	P	39.9	Very low	40.9	Very low	94 Å²	94	147.5 Å²	147.5	61%	0.61	82%	0.816	S	S	*	*			cis	-133.5	-148	-29.8	34	-13	0	0	0	111.6
238	L	40.6	Very low	41.6	Very low	162 Å²	162	151.4 Å²	151.4	85%	0.848	82%	0.822	S	S	*	*			trans	76.8	146.6	-177.5	-68.1	98	0	0	0	115.3
239	S	45.7	Very low	41.8	Very low	109 Å²	109	148.6 Å²	148.6	76%	0.762	82%	0.816	S	S	*	*			cis	-154.3	159.3	7.6	28.6	0	0	0	0	112.5
240	Q	36.4	Very low	42	Very low	188 Å²	188	147 Å²	147	88%	0.879	82%	0.817	S	S	*	*			trans	-91.2	160.2	162.6	-72.4	-178.4	-52.5	0	0	111.1
241	P	50.1	Low	42.2	Very low	119 Å²	119	145 Å²	145	77%	0.773	82%	0.816	S	S	*	*			trans	-134.7	149	136.2	36.6	-25.5	0	0	0	113.9
242	S	38.2	Very low	42.2	Very low	119 Å²	119	145.1 Å²	145.1	83%	0.832	83%	0.825	S	S	*	*			trans	-80.9	151.6	168.2	-53	0	0	0	0	111.2
243	V	55.9	Low	41.9	Very low	139 Å²	139	139.3 Å²	139.3	84%	0.842	82%	0.817	S	S	*	*			trans	-136.4	152.6	166.7	-180	0	0	0	0	109.3
244	E	44.9	Very low	42	Very low	185 Å²	185	134.9 Å²	134.9	86%	0.864	82%	0.819	S	S	*	*			trans	-91.9	167.8	-157.6	-61.8	160.2	127.3	0	0	115.4
245	V	40.5	Very low	41.8	Very low	135 Å²	135	129.9 Å²	129.9	82%	0.818	81%	0.813	S	S	*	*			trans	-79	164.9	165.7	-149.4	0	0	0	0	106.9
246	P	44.2	Very low	41.6	Very low	103 Å²	103	133.4 Å²	133.4	67%	0.669	81%	0.813	S	S	*	*			cis	-154.6	-176.8	33.8	45.2	-21.8	0	0	0	120.9
247	D	39.8	Very low	41.5	Very low	150 Å²	150	130.8 Å²	130.8	80%	0.802	81%	0.809	S	S	*	*			trans	51.6	117.8	149.3	-67.7	-27.9	0	0	0	123.1
248	E	47.9	Very low	41.6	Very low	194 Å²	194	133.9 Å²	133.9	91%	0.907	82%	0.82	S	S	*	*			trans	-142.1	125.8	138.8	-85.3	-153.4	113.2	0	0	114.1
249	C	42.6	Very low	41.5	Very low	113 Å²	113	130.2 Å²	130.2	76%	0.764	81%	0.813	S	S	*	*			trans	14.8	120.8	152.4	-66	0	0	0	0	124.2
250	C	38.9	Very low	41.1	Very low	134 Å²	134	129.9 Å²	129.9	91%	0.905	81%	0.811	S	S	*	*				39.5	125.5	117	-58.6	0	0	0	0	122.4
251	G	37.9	Very low	41.1	Very low	79 Å²	79	127.5 Å²	127.5	81%	0.814	81%	0.813	S	S	*	*			trans	166.5	96.6	149.5	0	0	0	0	0	118.6
252	G	39.2	Very low	40.5	Very low	89 Å²	89	126.4 Å²	126.4	92%	0.918	81%	0.809	S	S	*	*			trans	74.6	146.7	163.5	0	0	0	0	0	116.8
253	G	35.6	Very low	40.5	Very low	81 Å²	81	130.2 Å²	130.2	84%	0.835	81%	0.813	S	S	*	*			cis	137.3	88.2	-0.6	0	0	0	0	0	112.5
254	S	42.3	Very low	39.7	Very low	118 Å²	118	127.9 Å²	127.9	83%	0.825	81%	0.809	S	S	*	*			trans	-164.1	125.9	153.1	-167.9	0	0	0	0	112
255	T	35.9	Very low	39.6	Very low	114 Å²	114	125.4 Å²	125.4	70%	0.699	81%	0.806	S	S	*	*			trans	-83.1	133.7	177.5	-52.8	0	0	0	0	110.7
256	F	40.9	Very low	39.4	Very low	196 Å²	196	124 Å²	124	86%	0.86	80%	0.802	S	S	*	*			trans	-152.2	110.4	146.5	-100.4	-71.7	0	0	0	111
257	T	33.6	Very low	39.2	Very low	125 Å²	125	130 Å²	130	77%	0.767	81%	0.811	S	S	*	*			trans	-101.9	130.8	167	34.3	0	0	0	0	109
258	L	42.9	Very low	39.3	Very low	159 Å²	159	130.8 Å²	130.8	83%	0.832	82%	0.815	S	S	*	*			trans	-150.3	123.2	165.5	-110.5	172.4	0	0	0	112.8
259	A	38.3	Very low	38.9	Very low	85 Å²	85	126.3 Å²	126.3	70%	0.702	80%	0.804	S	S	*	*			trans	53	111.8	150.1	0	0	0	0	0	120.9
260	S	36	Very low	38.8	Very low	102 Å²	102	128.4 Å²	128.4	71%	0.713	81%	0.808	S	S	*	*			trans	-61.1	144.4	148.6	171.9	0	0	0	0	112
261	C	38.3	Very low	39.1	Very low	138 Å²	138	130.1 Å²	130.1	93%	0.932	81%	0.809	S	S	*	*			trans	-139.1	102.7	151.1	-81.5	0	0	0	0	110.3
262	S	35.9	Very low	39.2	Very low	97 Å²	97	130.2 Å²	130.2	68%	0.678	80%	0.801	S	S	*	*			trans	-125	109.2	161.5	56.9	0	0	0	0	108.2
263	E	38.6	Very low	39.3	Very low	198 Å²	198	130.8 Å²	130.8	93%	0.925	79%	0.791	S	S	*	*			trans	173.6	168.5	157.9	-105.2	174	172	0	0	111.6
264	A	38.8	Very low	39.8	Very low	91 Å²	91	138.1 Å²	138.1	75%	0.752	79%	0.794	S	S	*	*			trans	96.2	75.3	-178	0	0	0	0	0	114.7
265	V	42.5	Very low	39.9	Very low	132 Å²	132	141.7 Å²	141.7	80%	0.8	79%	0.794	S	S	*	*				81.3	121.9	70.6	175.5	0	0	0	0	113.4
266	S	36.4	Very low	40.4	Very low	106 Å²	106	141.1 Å²	141.1	74%	0.741	80%	0.795	S	S	*	*			trans	-70.2	-172.6	175.5	-34.4	0	0	0	0	113.5
267	R	41	Very low	40.6	Very low	230 Å²	230	136.4 Å²	136.4	87%	0.868	79%	0.786	S	S	*	*			trans	89.2	142.1	-179.2	-49.8	166.2	178.7	-165.4	-0.8	111.6
268	L	42.6	Very low	40.9	Very low	166 Å²	166	136.6 Å²	136.6	87%	0.869	79%	0.788	S	S	*	*			cis	-134.3	157.2	15.4	-72.8	162.4	0	0	0	112.3
269	S	38.2	Very low	41	Very low	99 Å²	99	134.3 Å²	134.3	69%	0.692	79%	0.785	S	S	*	*			trans	-92.6	165.6	159.9	-57	0	0	0	0	111.1
270	D	40.9	Very low	41.1	Very low	158 Å²	158	136.1 Å²	136.1	85%	0.845	79%	0.792	S	S	*	*			trans	58	116.6	154	-50.4	-36.9	0	0	0	119.9
271	D	45.8	Very low	41.3	Very low	170 Å²	170	134.9 Å²	134.9	91%	0.909	80%	0.796	S	S	*	*				-157.4	172.3	111.6	-141.5	-30.6	0	0	0	111.7
272	A	39.8	Very low	41.2	Very low	80 Å²	80	138.1 Å²	138.1	66%	0.661	80%	0.797	S	S	*	*			trans	-117	160	-148.5	0	0	0	0	0	117.2
273	S	41.6	Very low	41.3	Very low	102 Å²	102	139 Å²	139	71%	0.713	80%	0.803	S	S	*	*			trans	53.1	111	135.6	-165.8	0	0	0	0	121.4
274	R	46.5	Very low	41.4	Very low	234 Å²	234	135.2 Å²	135.2	88%	0.883	80%	0.799	S	S	*	*				-170.7	118.1	129.8	-93.9	144.7	-164.8	-136	6	108
275	K	44	Very low	41.3	Very low	193 Å²	193	140 Å²	140	84%	0.839	81%	0.806	S	S	*	*				52.5	127.9	96.2	-69.6	-176.2	178.2	-178.7	0	113
276	S	46.6	Very low	40.9	Very low	103 Å²	103	138.3 Å²	138.3	72%	0.72	81%	0.806	S	S	*	*			cis	-169.8	162.5	15.8	48.1	0	0	0	0	113.5
277	S	43.4	Very low	40.9	Very low	96 Å²	96	137.5 Å²	137.5	67%	0.671	80%	0.8	S	S	*	*			trans	54	142.4	140.7	61.2	0	0	0	0	121.9
278	T	41.2	Very low	41.1	Very low	129 Å²	129	132.8 Å²	132.8	79%	0.791	79%	0.791	S	S	*	*			cis	-172	178.8	-7.6	19.5	0	0	0	0	108.5
279	S	44.5	Very low	41	Very low	112 Å²	112	128.5 Å²	128.5	78%	0.783	78%	0.775	S	S	*	*			trans	85	105.3	175.6	77.1	0	0	0	0	114.4
280	S	41.3	Very low	41.2	Very low	122 Å²	122	127.7 Å²	127.7	85%	0.853	77%	0.769	S	S	*	*			cis	96.2	92.3	49.2	70.6	0	0	0	0	112.5
281	G	38.5	Very low	41.3	Very low	76 Å²	76	127.8 Å²	127.8	78%	0.784	76%	0.762	S	S	*	*			trans	-153.6	111.3	169.8	0	0	0	0	0	109.2
282	Q	36.7	Very low	41.1	Very low	206 Å²	206	125.8 Å²	125.8	96%	0.963	74%	0.743	S	S	*	*			trans	-74.9	129.3	-174.7	-66.5	168.2	-21.1	0	0	110.8
283	S	37.9	Very low	41.4	Very low	115 Å²	115	130.2 Å²	130.2	80%	0.804	75%	0.747	S	S	*	*			trans	-152.1	123.9	162.6	-171.3	0	0	0	0	110.8	Q285	S283-Q285 PolarHBondContact O-N 2.88Å; S283-Q285 VanDerWaalsContact O-N 3.15Å
284	S	40.9	Very low	41.4	Very low	120 Å²	120	130.2 Å²	130.2	84%	0.839	75%	0.747	S	S	*	*			trans	-71.9	102.9	-165.9	-52.6	0	0	0	0	113.1	A286	S284-A286 PolarHBondContact O-N 3.09Å; S284-A286 VanDerWaalsContact O-N 3.15Å
285	Q	36.4	Very low	41.2	Very low	191 Å²	191	123.5 Å²	123.5	89%	0.893	73%	0.728	S	S	*	*			trans	-77.1	91.6	159.8	-73.3	-169.3	-6.5	0	0	109.7	S283 S287	S283-Q285 PolarHBondContact O-N 2.88Å; S283-Q285 VanDerWaalsContact O-N 3.15Å; Q285-S287 PolarHBondContact O-N 2.76Å
286	A	35.9	Very low	41	Very low	96 Å²	96	118.7 Å²	118.7	79%	0.793	72%	0.717	S	S	*	*			trans	-73.1	104.8	169.1	0	0	0	0	0	109.7	S284	S284-A286 PolarHBondContact O-N 3.09Å; S284-A286 VanDerWaalsContact O-N 3.15Å
287	S	36.4	Very low	40.9	Very low	89 Å²	89	122.6 Å²	122.6	62%	0.622	72%	0.721	S	S	*	*			trans	-58.8	140.6	-176.4	-58	0	0	0	0	113.5	Q285 S289	Q285-S287 PolarHBondContact O-N 2.76Å; S287-S289 PolarHBondContact O-N 2.93Å
288	I	43.4	Very low	41	Very low	131 Å²	131	126.2 Å²	126.2	67%	0.672	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	8.2	179.6	-39.4	175.7	0	0	0	112.5	Y292	I288-Y292 HydrophobicContact CG2-CE2 4.34Å; I288-Y292 WeakPolarHBondContact O-CD2 3.28Å
289	S	40.7	Very low	41.3	Very low	77 Å²	77	127.5 Å²	127.5	54%	0.538	72%	0.722	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.7	-23.6	-177.3	-177.3	0	0	0	0	114.1	S287	S287-S289 PolarHBondContact O-N 2.93Å
290	S	42.2	Very low	41.3	Very low	82 Å²	82	127.7 Å²	127.7	57%	0.573	71%	0.71	S	S	*	*	S	Bend	trans	-78.8	-32.1	-175.4	54.3	0	0	0	0	114	Y292 K293	S290-Y292 VanDerWaalsContact C-N 3.31Å; S290-Y292 PolarHBondContact O-N 2.88Å; S290-K293 PolarHBondContact O-N 2.86Å
291	F	43.3	Very low	41	Very low	160 Å²	160	132.8 Å²	132.8	70%	0.702	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-18.3	-175.8	-103.5	-88	0	0	0	114.7
292	Y	42.6	Very low	41	Very low	128 Å²	128	136.3 Å²	136.3	50%	0.502	72%	0.717	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.8	-2.7	179	-70.1	-85.2	0	0	0	113.8	I288 S290 L295 Q300	I288-Y292 HydrophobicContact CG2-CE2 4.34Å; I288-Y292 WeakPolarHBondContact O-CD2 3.28Å; S290-Y292 VanDerWaalsContact C-N 3.31Å; S290-Y292 PolarHBondContact O-N 2.88Å; Y292-L295 HydrophobicContact CD1-CD1 4.14Å; Y292-Q300 PolarHBondContact O-NE2 3.4Å
293	K	44.8	Very low	40.9	Very low	173 Å²	173	135.1 Å²	135.1	75%	0.752	71%	0.711	S	S	*	*	S	Bend	trans	-92.3	-6.2	-177	-68.8	-173.8	177.5	-177.3	0	114.6	S290	S290-K293 PolarHBondContact O-N 2.86Å
294	S	41.4	Very low	40.6	Very low	101 Å²	101	141.1 Å²	141.1	71%	0.706	72%	0.716	S	S	*	*	S	Bend	trans	-105.8	8.4	178	58.2	0	0	0	0	113.9
295	L	43.3	Very low	40.1	Very low	94 Å²	94	143.6 Å²	143.6	49%	0.492	72%	0.719	S	S	.	*	S	Bend	trans	-79.3	143.6	173.9	-78	160.4	0	0	0	110.6	Y292 K297	Y292-L295 HydrophobicContact CD1-CD1 4.14Å; L295-K297 PolarHBondContact O-N 2.86Å
296	P	40.3	Very low	39.9	Very low	92 Å²	92	140.2 Å²	140.2	60%	0.597	72%	0.715	S	S	*	*			trans	-54.5	134.2	171.9	-25.4	34.6	0	0	0	111.6	E298 K299	P296-E298 PolarHBondContact O-N 3.05Å; P296-K299 PolarHBondContact O-N 2.73Å; P296-K299 VanDerWaalsContact O-N 3.16Å
297	K	45	Very low	39.8	Very low	184 Å²	184	141.6 Å²	141.6	80%	0.8	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-62	-16.3	-174.4	-67	180	-179.5	174.2	0	113.8	L295 K299 Q300	L295-K297 PolarHBondContact O-N 2.86Å; K297-K299 VanDerWaalsContact C-N 3.29Å; K297-K299 PolarHBondContact O-N 2.92Å; K297-Q300 PolarHBondContact O-N 2.67Å
298	E	44.7	Very low	39.5	Very low	173 Å²	173	143 Å²	143	81%	0.808	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-52.4	-42.2	171.6	-132.1	71.6	-141.9	0	0	112.5	P296 Q300	P296-E298 PolarHBondContact O-N 3.05Å; E298-Q300 PolarHBondContact O-N 3.47Å
299	K	47.3	Very low	38.9	Very low	155 Å²	155	141.8 Å²	141.8	67%	0.674	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-93.4	19.8	-173.7	-61.6	-161.6	171.5	-162.8	0	114.4	E40 P296 K297	E40-K299 IonicContact OE2-NZ 2.8Å; E40-K299 PolarHBondContact OE2-NZ 3.29Å; P296-K299 PolarHBondContact O-N 2.73Å; P296-K299 VanDerWaalsContact O-N 3.16Å; K297-K299 VanDerWaalsContact C-N 3.29Å; K297-K299 PolarHBondContact O-N 2.92Å
300	Q	44.7	Very low	38.7	Very low	116 Å²	116	145.7 Å²	145.7	54%	0.542	74%	0.743	S	S	.	*	G	3₁₀ helix	trans	-112.1	16.3	177.7	-82.6	-175	-9.5	0	0	114.3	Y292 K297 E298	Y292-Q300 PolarHBondContact O-NE2 3.4Å; K297-Q300 PolarHBondContact O-N 2.67Å; E298-Q300 PolarHBondContact O-N 3.47Å
301	R	34.3	Very low	38.6	Very low	229 Å²	229	147 Å²	147	86%	0.864	75%	0.748	S	S	*	*			trans	-118.6	34.7	-164.5	-144.4	175.7	-174.1	166.7	0.4	117.1
302	V	38.1	Very low	38.3	Very low	151 Å²	151	147.6 Å²	147.6	92%	0.915	75%	0.753	S	S	*	*	S	Bend	trans	-131.3	55.7	163.3	-164.5	0	0	0	0	110.7
303	Q	35	Very low	38	Very low	180 Å²	180	150 Å²	150	84%	0.841	77%	0.768	S	S	*	*			trans	-146.6	59.3	173.3	-161.6	-176.8	38.6	0	0	111.4
304	R	31.9	Very low	37.5	Very low	241 Å²	241	147.8 Å²	147.8	91%	0.909	77%	0.773	S	S	*	*			trans	-171	106.9	169.3	-102.1	163.8	-149.1	-165.5	4.7	108
305	L	30.9	Very low	37.1	Very low	173 Å²	173	147.4 Å²	147.4	91%	0.906	78%	0.776	S	S	*	*			trans	161.6	77.5	152.9	-90.5	167.5	0	0	0	109.4
306	C	31.5	Very low	36.9	Very low	119 Å²	119	147.6 Å²	147.6	80%	0.804	79%	0.785	S	S	*	*			trans	-165.5	99.4	159.5	-99.7	0	0	0	0	108.3
307	P	33.2	Very low	37	Very low	126 Å²	126	151 Å²	151	82%	0.818	79%	0.793	S	S	*	*			trans	-86.4	124.8	169.3	32.5	-28.3	0	0	0	109.8
308	S	31.4	Very low	36.8	Very low	118 Å²	118	149.8 Å²	149.8	83%	0.825	79%	0.794	S	S	*	*			trans	-121.6	93.5	176.2	-5.6	0	0	0	0	110.5
309	S	31.1	Very low	36.4	Very low	105 Å²	105	146 Å²	146	73%	0.734	79%	0.787	S	S	*	*			trans	-156.9	89.4	172.4	60.8	0	0	0	0	112.4
310	L	36.2	Very low	36.2	Very low	159 Å²	159	145.2 Å²	145.2	83%	0.832	80%	0.795	S	S	*	*			trans	179.8	91.8	154.2	-102.4	136	0	0	0	106.7
311	T	39.6	Very low	36.1	Very low	110 Å²	110	146.2 Å²	146.2	68%	0.675	80%	0.804	S	S	*	*				44.6	100.4	96.7	59.3	0	0	0	0	112.9
312	Q	36.1	Very low	36.6	Very low	173 Å²	173	141.6 Å²	141.6	81%	0.808	80%	0.801	S	S	*	*				87.1	140.2	76.6	-172.3	-179.8	23.5	0	0	112.2
313	Q	37.4	Very low	36.8	Very low	178 Å²	178	137.8 Å²	137.8	83%	0.832	79%	0.786	S	S	*	*			trans	80.7	137.2	-171.9	-54.6	-178.5	0.1	0	0	113.9
314	C	35.1	Very low	37.3	Very low	126 Å²	126	135.6 Å²	135.6	85%	0.851	79%	0.785	S	S	*	*			cis	-150.2	166.2	-7.8	-109.3	0	0	0	0	110.1
315	A	32.9	Very low	37.9	Very low	93 Å²	93	128.9 Å²	128.9	77%	0.769	78%	0.775	S	S	*	*			trans	-103.3	171.7	179.8	0	0	0	0	0	113
316	S	38.8	Very low	38.7	Very low	98 Å²	98	129.4 Å²	129.4	69%	0.685	77%	0.772	S	S	*	*			trans	97.3	156	161.9	76.8	0	0	0	0	119.5
317	H	42.7	Very low	39	Very low	164 Å²	164	128.8 Å²	128.8	76%	0.759	77%	0.767	S	S	*	*			trans	77.3	107.4	-172.7	-50.9	-76.3	0	0	0	114.1
318	L	39.4	Very low	39.8	Very low	158 Å²	158	130.8 Å²	130.8	83%	0.827	77%	0.769	S	S	*	*			cis	54	134.2	48.2	-57.2	165.6	0	0	0	112.4
319	S	37.4	Very low	40.2	Very low	95 Å²	95	132.2 Å²	132.2	66%	0.664	77%	0.768	S	S	*	*			cis	-173.6	-176.3	-13.9	-91.3	0	0	0	0	106.1
320	V	43.6	Very low	41.1	Very low	138 Å²	138	133 Å²	133	84%	0.836	77%	0.773	S	S	*	*			trans	76.3	139.7	164.7	-174	0	0	0	0	114.7
321	D	41.5	Very low	41.3	Very low	137 Å²	137	134.9 Å²	134.9	73%	0.733	78%	0.777	S	S	*	*			cis	-173.6	168.4	-31.8	-134.4	-39.4	0	0	0	108.4
322	V	45.7	Very low	41.7	Very low	132 Å²	132	139 Å²	139	80%	0.8	79%	0.789	S	S	*	*			trans	61.9	144	151.6	166.9	0	0	0	0	119.8
323	A	42.5	Very low	41.8	Very low	71 Å²	71	140.1 Å²	140.1	59%	0.587	79%	0.794	S	S	*	*			cis	-172.9	163.5	-27	0	0	0	0	0	109.2
324	T	44.1	Very low	42.2	Very low	134 Å²	134	136.5 Å²	136.5	82%	0.822	80%	0.795	S	S	*	*			trans	65.4	133.6	153.3	-48.3	0	0	0	0	116.2
325	S	44.3	Very low	42.5	Very low	100 Å²	100	136 Å²	136	70%	0.699	79%	0.793	S	S	*	*			cis	-159.8	-179.8	19.7	12.6	0	0	0	0	107.4
326	Q	49.3	Very low	43.2	Very low	183 Å²	183	136.6 Å²	136.6	86%	0.855	79%	0.791	S	S	*	*			cis	-155	176.1	3.1	-123.8	173.3	-24.4	0	0	107.6
327	P	37.1	Very low	44.3	Very low	107 Å²	107	137.2 Å²	137.2	70%	0.695	79%	0.793	S	S	*	*			trans	-97.3	156.9	-171.6	38.3	-33.8	0	0	0	114.6
328	I	48.8	Very low	44.8	Very low	168 Å²	168	135.3 Å²	135.3	86%	0.862	80%	0.795	S	S	*	*			trans	-139.5	125.5	156.1	-62.8	-176.2	0	0	0	108.3
329	D	40.9	Very low	45.3	Very low	148 Å²	148	133.8 Å²	133.8	79%	0.791	79%	0.792	S	S	*	*			trans	-72.1	142.5	173.1	-58.3	-72.8	0	0	0	111.9
330	S	48.9	Very low	46.1	Very low	120 Å²	120	135.2 Å²	135.2	84%	0.839	80%	0.799	S	S	*	*			trans	-156.2	117.2	151.8	-90.1	0	0	0	0	108.8
331	E	41.7	Very low	46.3	Very low	200 Å²	200	133.1 Å²	133.1	94%	0.935	80%	0.796	S	S	*	*			trans	-67.9	126.4	173.4	-61.1	169.8	102.3	0	0	109.9
332	E	46.9	Very low	46.7	Very low	195 Å²	195	135.2 Å²	135.2	91%	0.911	80%	0.802	S	S	*	*			trans	-140.8	133.9	154.9	-138.5	176.7	175.2	0	0	112.4	A334	E332-A334 PolarHBondContact O-N 2.81Å
333	Q	39.3	Very low	46.8	Very low	197 Å²	197	133.4 Å²	133.4	92%	0.921	79%	0.792	S	S	*	*			trans	-97.6	76.2	-150.5	-168.4	175.5	11.5	0	0	110.9	S335	Q333-S335 PolarHBondContact O-N 3.46Å
334	A	44.9	Very low	47.4	Very low	102 Å²	102	135 Å²	135	84%	0.843	80%	0.796	S	S	*	*			trans	-77.4	108	-178.8	0	0	0	0	0	112.3	E332	E332-A334 PolarHBondContact O-N 2.81Å
335	S	42.9	Very low	48	Very low	116 Å²	116	134.1 Å²	134.1	81%	0.811	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-68.1	129.8	177	41.9	0	0	0	0	112.4	Q333	Q333-S335 PolarHBondContact O-N 3.46Å
336	S	47.5	Very low	48.6	Very low	106 Å²	106	136.6 Å²	136.6	74%	0.741	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-71.5	140.7	172	49.4	0	0	0	0	111.3
337	P	61.7	Low	49.1	Very low	111 Å²	111	132.6 Å²	132.6	72%	0.721	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-68.8	148.2	174.1	29.2	-34.2	0	0	0	110.7	V339	P337-V339 PolarHBondContact O-N 3.2Å
338	P	51.5	Low	50.1	Low	123 Å²	123	130.6 Å²	130.6	80%	0.799	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-70.3	128.6	-178.7	29	-33.9	0	0	0	110.8	P340	P338-P340 WeakPolarHBondContact O-CD 2.97Å
339	V	51.7	Low	50.5	Low	127 Å²	127	126.4 Å²	126.4	77%	0.77	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-69.7	120.5	171	178.1	0	0	0	0	108.7	P337 A341	P337-V339 PolarHBondContact O-N 3.2Å; V339-A341 VanDerWaalsContact C-N 3.32Å; V339-A341 PolarHBondContact O-N 3.42Å
340	P	53.3	Low	51.3	Low	124 Å²	124	127.5 Å²	127.5	81%	0.805	75%	0.75	S	S	*	*			trans	-76.1	88.8	173.4	25	-20.9	0	0	0	109	P338 E342	P338-P340 WeakPolarHBondContact O-CD 2.97Å; P340-E342 VanDerWaalsContact C-N 3.26Å; P340-E342 PolarHBondContact O-N 2.73Å; P340-E342 VanDerWaalsContact O-N 3.12Å
341	A	47	Very low	51.9	Low	94 Å²	94	130 Å²	130	78%	0.777	75%	0.746	S	S	*	*			trans	-84.8	61.3	178.2	0	0	0	0	0	111.4	V339	V339-A341 VanDerWaalsContact C-N 3.32Å; V339-A341 PolarHBondContact O-N 3.42Å
342	E	50.5	Low	52.6	Low	182 Å²	182	124.2 Å²	124.2	85%	0.85	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-87.9	118.4	169.5	-130.7	-179.9	-175.1	0	0	109.9	P340	P340-E342 VanDerWaalsContact C-N 3.26Å; P340-E342 PolarHBondContact O-N 2.73Å; P340-E342 VanDerWaalsContact O-N 3.12Å
343	P	49	Very low	53	Low	93 Å²	93	116.5 Å²	116.5	60%	0.604	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-68.9	144.3	177	28.9	-33.5	0	0	0	109.8
344	P	55.1	Low	53.7	Low	104 Å²	104	111.1 Å²	111.1	68%	0.675	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-58.2	149.8	179.3	25.8	-35.2	0	0	0	110.8	L346	P344-L346 PolarHBondContact O-N 2.89Å
345	P	55.9	Low	54.2	Low	117 Å²	117	112.9 Å²	112.9	76%	0.76	66%	0.663	S	S	*	*			trans	-54.4	108.1	-172	20.2	-32.9	0	0	0	111	L347	P345-L347 PolarHBondContact O-N 3.12Å
346	L	57.8	Low	55.2	Low	151 Å²	151	113.2 Å²	113.2	79%	0.791	66%	0.655	S	S	*	*			trans	-65.7	111.6	-177.3	-70.5	173.3	0	0	0	108.7	P344	P344-L346 PolarHBondContact O-N 2.89Å
347	L	59.5	Low	56.5	Low	99 Å²	99	119.6 Å²	119.6	52%	0.518	66%	0.662	S	S	.	*			trans	-44	140.2	162.7	-74.3	171	0	0	0	109.1	P345 P349 T370	P345-L347 PolarHBondContact O-N 3.12Å; L347-P349 WeakPolarHBondContact O-CD 3.35Å; L347-T370 HydrophobicContact CD2-CG2 3.82Å
348	P	57.4	Low	57.4	Low	66 Å²	66	116 Å²	116	43%	0.429	64%	0.638	S	S	.	*			trans	-49.8	123.4	178.5	20	-32.3	0	0	0	108.8	K350 L352 L353	P348-K350 PolarHBondContact O-N 3.16Å; P348-L352 HydrophobicContact CB-CB 4.32Å; P348-L352 HydrophobicContact CB-CD1 4.01Å; P348-L353 HydrophobicContact CG-CD2 4.41Å; P348-L353 HydrophobicContact CG-CG 4.44Å
349	P	57.2	Low	59.3	Low	79 Å²	79	111.6 Å²	111.6	51%	0.513	61%	0.61	S	S	.	*			trans	-48.6	142.3	-173.5	-32	34.5	0	0	0	110.8	L347 K351 L352	L347-P349 WeakPolarHBondContact O-CD 3.35Å; P349-K351 CarbonylContact O-C 3.56Å; P349-K351 PolarHBondContact O-N 3.4Å; P349-L352 WeakPolarHBondContact O-CB 3.16Å; P349-L352 PolarHBondContact O-N 3.29Å
350	K	58.7	Low	61.1	Low	172 Å²	172	111.5 Å²	111.5	75%	0.748	61%	0.605	S	S	*	*	H	α-helix	trans	-47.6	-29.9	-176.2	-67.5	-178.8	179.4	177.3	0	113.3	P348 L353 S354	P348-K350 PolarHBondContact O-N 3.16Å; K350-L353 PolarHBondContact O-N 2.65Å; K350-S354 PolarHBondContact O-N 2.67Å; K350-S354 PolarHBondContact O-OG 3.49Å
351	K	59.7	Low	62.9	Low	172 Å²	172	108.3 Å²	108.3	75%	0.748	58%	0.577	S	S	*	*	H	α-helix	trans	-58.5	-43.5	172.1	-61.6	-173.9	178.9	-177.5	0	114	P349 S354 M355	P349-K351 CarbonylContact O-C 3.56Å; P349-K351 PolarHBondContact O-N 3.4Å; K351-S354 WeakPolarHBondContact CA-OG 2.97Å; K351-S354 PolarHBondContact O-N 2.71Å; K351-S354 PolarHBondContact O-OG 2.9Å; K351-M355 WeakPolarHBondContact O-CG 3.3Å; K351-M355 PolarHBondContact O-N 2.83Å; K351-M355 VanDerWaalsContact O-N 3.15Å
352	L	57.9	Low	65.1	Low	78 Å²	78	106 Å²	106	41%	0.408	55%	0.55	S	S	.	*	H	α-helix	trans	-64.1	-42.5	177.5	-63.1	-173.1	0	0	0	111.9	P348 P349 S354 M355 L356	P348-L352 HydrophobicContact CB-CB 4.32Å; P348-L352 HydrophobicContact CB-CD1 4.01Å; P349-L352 WeakPolarHBondContact O-CB 3.16Å; P349-L352 PolarHBondContact O-N 3.29Å; L352-S354 VanDerWaalsContact C-N 3.28Å; L352-S354 PolarHBondContact O-N 2.81Å; L352-M355 HydrophobicContact CD2-CE 3.57Å; L352-M355 WeakPolarHBondContact O-CB 3.41Å; L352-M355 PolarHBondContact O-N 2.88Å; L352-L356 PolarHBondContact O-N 3.2Å
353	L	54.7	Low	67.1	Low	33 Å²	33	99.9 Å²	99.9	17%	0.173	52%	0.522	C	S	.	.	H	α-helix	trans	-63.3	-34.8	176.8	-67.7	172.4	0	0	0	111.9	P348 K350 M355 L356 Q363	P348-L353 HydrophobicContact CG-CD2 4.41Å; P348-L353 HydrophobicContact CG-CG 4.44Å; K350-L353 PolarHBondContact O-N 2.65Å; L353-M355 VanDerWaalsContact C-N 3.35Å; L353-L356 HydrophobicContact CD2-CD1 4.45Å; L353-L356 PolarHBondContact O-N 3.36Å; L353-Q363 HydrophobicContact CD1-CG 4.12Å
354	S	53.9	Low	69.2	Low	84 Å²	84	99.2 Å²	99.2	59%	0.587	51%	0.51	S	S	*	.	H	α-helix	trans	-68.8	-27.2	171	53.4	0	0	0	0	114.2	K350 K351 L352 L356	K350-S354 PolarHBondContact O-N 2.67Å; K350-S354 PolarHBondContact O-OG 3.49Å; K351-S354 WeakPolarHBondContact CA-OG 2.97Å; K351-S354 PolarHBondContact O-N 2.71Å; K351-S354 PolarHBondContact O-OG 2.9Å; L352-S354 VanDerWaalsContact C-N 3.28Å; L352-S354 PolarHBondContact O-N 2.81Å; S354-L356 VanDerWaalsContact C-N 3.34Å
355	M	56.4	Low	71.1	Confident	140 Å²	140	94.5 Å²	94.5	69%	0.69	48%	0.479	S	S	*	.	H	α-helix	trans	-70.4	-32.2	173.1	-58.9	-166.4	-39.8	0	0	112.2	K351 L352 L353 R357	K351-M355 WeakPolarHBondContact O-CG 3.3Å; K351-M355 PolarHBondContact O-N 2.83Å; K351-M355 VanDerWaalsContact O-N 3.15Å; L352-M355 HydrophobicContact CD2-CE 3.57Å; L352-M355 WeakPolarHBondContact O-CB 3.41Å; L352-M355 PolarHBondContact O-N 2.88Å; L353-M355 VanDerWaalsContact C-N 3.35Å; M355-R357 PolarHBondContact O-N 3.46Å; M355-R357 VanDerWaalsContact O-N 3.15Å
356	L	62	Low	72.9	Confident	122 Å²	122	92.4 Å²	92.4	64%	0.639	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	5.7	-179.2	-69.5	170.3	0	0	0	114.2	L352 L353 S354 V358	L352-L356 PolarHBondContact O-N 3.2Å; L353-L356 HydrophobicContact CD2-CD1 4.45Å; L353-L356 PolarHBondContact O-N 3.36Å; S354-L356 VanDerWaalsContact C-N 3.34Å; L356-V358 HydrophobicContact CB-CG2 3.72Å; L356-V358 PolarHBondContact O-N 2.9Å; L356-V358 VanDerWaalsContact O-N 3.11Å
357	R	75.7	Confident	74.5	Confident	240 Å²	240	92 Å²	92	91%	0.906	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	28.8	-176.3	-60.8	-178.1	177.7	164.3	0	113.8	M355	M355-R357 PolarHBondContact O-N 3.46Å; M355-R357 VanDerWaalsContact O-N 3.15Å
358	V	81.4	Confident	76.2	Confident	35 Å²	35	88.1 Å²	88.1	21%	0.212	43%	0.429	C	S	.	.			trans	-71.4	136.3	176.9	175.8	0	0	0	0	109.1	L356 E362 Q363 L366	L356-V358 HydrophobicContact CB-CG2 3.72Å; L356-V358 PolarHBondContact O-N 2.9Å; L356-V358 VanDerWaalsContact O-N 3.11Å; V358-E362 HydrophobicContact CG1-CB 3.65Å; V358-E362 HydrophobicContact CG1-CG 3.66Å; V358-Q363 HydrophobicContact CG1-CB 4.29Å; V358-L366 HydrophobicContact CG1-CD1 4.21Å
359	S	89.9	Confident	78	Confident	31 Å²	31	88.5 Å²	88.5	22%	0.217	42%	0.424	C	S	.	.			trans	-70.2	157.8	177.5	71.1	0	0	0	0	111.3	R361 E362 Q363 E545	S359-R361 PolarHBondContact O-N 3.23Å; S359-E362 PolarHBondContact O-N 3.31Å; S359-E362 VanDerWaalsContact O-N 3.14Å; S359-E362 WeakPolarHBondContact OG-CB 3.3Å; S359-E362 PolarHBondContact OG-N 3.3Å; S359-Q363 PolarHBondContact O-N 3.21Å; S359-E545 WeakPolarHBondContact CB-OE1 3.41Å; S359-E545 VanDerWaalsContact CB-OE2 3.24Å; S359-E545 WeakPolarHBondContact CB-OE2 3.38Å; S359-E545 PolarHBondContact OG-OE1 2.84Å; S359-E545 PolarHBondContact OG-OE2 2.86Å
360	L	89.8	Confident	79.7	Confident	125 Å²	125	88 Å²	88	65%	0.654	42%	0.42	S	S	*	.	H	α-helix	trans	-56	-40.4	175.5	-179.9	64.3	0	0	0	111.5	Q363 E364	L360-Q363 PolarHBondContact O-N 3.37Å; L360-E364 WeakPolarHBondContact O-CG 3.49Å; L360-E364 PolarHBondContact O-N 3.04Å
361	R	92	Very high	81.4	Confident	58 Å²	58	81.5 Å²	81.5	22%	0.219	39%	0.392	C	S	.	.	H	α-helix	trans	-67.2	-39.6	178.3	-179.2	62.3	71.3	-176.6	14	112.2	S359 E364 V365 L465 N522 S523 E545	S359-R361 PolarHBondContact O-N 3.23Å; R361-E364 IonicContact CZ-OE2 3.63Å; R361-E364 IonicContact NE-OE2 3.3Å; R361-E364 IonicContact NH1-OE2 3.56Å; R361-E364 PolarHBondContact NH1-OE2 3Å; R361-E364 PolarHBondContact O-N 3.15Å; R361-V365 WeakPolarHBondContact O-CG2 3.43Å; R361-V365 PolarHBondContact O-N 3.39Å; R361-L465 HydrophobicContact CG-CD1 3.86Å; R361-N522 PolarHBondContact NH1-O 3.12Å; R361-N522 PolarHBondContact NH2-O 3.32Å; R361-S523 PolarHBondContact NH1-OG 3.11Å; R361-E545 HydrophobicContact CB-CB 4.48Å; R361-E545 HydrophobicContact CG-CB 4.22Å
362	E	93	Very high	83	Confident	46 Å²	46	74.4 Å²	74.4	22%	0.215	36%	0.363	C	S	.	.	H	α-helix	trans	-68.8	-37.1	176.2	-173.8	168.6	-136.7	0	0	111.3	V358 S359 V365 L366 L465 K467	V358-E362 HydrophobicContact CG1-CB 3.65Å; V358-E362 HydrophobicContact CG1-CG 3.66Å; S359-E362 PolarHBondContact O-N 3.31Å; S359-E362 VanDerWaalsContact O-N 3.14Å; S359-E362 WeakPolarHBondContact OG-CB 3.3Å; S359-E362 PolarHBondContact OG-N 3.3Å; E362-V365 PolarHBondContact O-N 3Å; E362-L366 HydrophobicContact CG-CD1 4.19Å; E362-L366 HydrophobicContact CG-CG 4.49Å; E362-L366 WeakPolarHBondContact O-CB 3.44Å; E362-L366 VanDerWaalsContact O-CG 3.23Å; E362-L366 WeakPolarHBondContact O-CG 3.48Å; E362-L366 PolarHBondContact O-N 2.94Å; E362-L465 HydrophobicContact CB-CD2 3.66Å; E362-L465 HydrophobicContact CG-CD2 3.66Å; E362-K467 WeakPolarHBondContact OE1-CE 3.48Å; E362-K467 IonicContact OE1-NZ 3.04Å; E362-K467 PolarHBondContact OE1-NZ 2.96Å; E362-K467 IonicContact OE2-NZ 3.46Å; E362-K467 PolarHBondContact OE2-NZ 2.84Å
363	Q	92.6	Very high	84.6	Confident	53 Å²	53	77.4 Å²	77.4	25%	0.248	38%	0.375	C	S	.	.	H	α-helix	trans	-62	-43.4	170.7	177.8	170.2	47.6	0	0	112.5	L353 V358 S359 L360 R367	L353-Q363 HydrophobicContact CD1-CG 4.12Å; V358-Q363 HydrophobicContact CG1-CB 4.29Å; S359-Q363 PolarHBondContact O-N 3.21Å; L360-Q363 PolarHBondContact O-N 3.37Å; Q363-R367 WeakPolarHBondContact O-CB 3.35Å; Q363-R367 PolarHBondContact O-N 2.96Å
364	E	92.9	Very high	86.3	Confident	78 Å²	78	77.9 Å²	77.9	36%	0.364	38%	0.381	S	S	.	.	H	α-helix	trans	-59.2	-47.3	172.9	-73.9	173.8	174.2	0	0	111.8	L360 R361 R367 L368	L360-E364 WeakPolarHBondContact O-CG 3.49Å; L360-E364 PolarHBondContact O-N 3.04Å; R361-E364 IonicContact CZ-OE2 3.63Å; R361-E364 IonicContact NE-OE2 3.3Å; R361-E364 IonicContact NH1-OE2 3.56Å; R361-E364 PolarHBondContact NH1-OE2 3Å; R361-E364 PolarHBondContact O-N 3.15Å; E364-R367 PolarHBondContact O-N 3.27Å; E364-L368 WeakPolarHBondContact O-CB 3.18Å; E364-L368 PolarHBondContact O-N 2.86Å
365	V	93.9	Very high	87.6	Confident	5 Å²	5	77 Å²	77	3%	0.03	37%	0.368	C	S	.	.	H	α-helix	trans	-67.2	-40.6	-179.9	168.1	0	0	0	0	111.9	R361 E362 L368 K369 V463 L465	R361-V365 WeakPolarHBondContact O-CG2 3.43Å; R361-V365 PolarHBondContact O-N 3.39Å; E362-V365 PolarHBondContact O-N 3Å; V365-L368 PolarHBondContact O-N 3.26Å; V365-K369 HydrophobicContact CG1-CD 4.08Å; V365-K369 HydrophobicContact CG1-CG 4.33Å; V365-K369 WeakPolarHBondContact O-CB 3.29Å; V365-K369 VanDerWaalsContact O-CG 3.29Å; V365-K369 WeakPolarHBondContact O-CG 3.46Å; V365-K369 PolarHBondContact O-N 2.71Å; V365-V463 HydrophobicContact CG1-CG1 3.84Å; V365-V463 HydrophobicContact CG2-CG1 4.42Å; V365-L465 HydrophobicContact CG1-CB 4.13Å; V365-L465 HydrophobicContact CG2-CB 4.4Å; V365-L465 HydrophobicContact CG2-CD1 4.34Å
366	L	93.5	Very high	89.1	Confident	73 Å²	73	76.2 Å²	76.2	38%	0.382	36%	0.362	S	S	.	.	H	α-helix	trans	-61.7	-46.6	175.6	-74.9	169.9	0	0	0	110.6	V358 E362 L368 K369 T370	V358-L366 HydrophobicContact CG1-CD1 4.21Å; E362-L366 HydrophobicContact CG-CD1 4.19Å; E362-L366 HydrophobicContact CG-CG 4.49Å; E362-L366 WeakPolarHBondContact O-CB 3.44Å; E362-L366 VanDerWaalsContact O-CG 3.23Å; E362-L366 WeakPolarHBondContact O-CG 3.48Å; E362-L366 PolarHBondContact O-N 2.94Å; L366-L368 PolarHBondContact O-N 3.14Å; L366-K369 WeakPolarHBondContact O-CB 3.39Å; L366-K369 PolarHBondContact O-N 2.88Å; L366-T370 PolarHBondContact O-N 3.41Å; L366-T370 PolarHBondContact O-OG1 3.37Å
367	R	93	Very high	90.4	Very high	143 Å²	143	71.9 Å²	71.9	54%	0.54	35%	0.347	S	S	.	.	H	α-helix	trans	-57.5	-50.5	174.5	179.6	-177.8	169.8	-177.9	-2.6	111.6	Q363 E364 K369 T370 E371	Q363-R367 WeakPolarHBondContact O-CB 3.35Å; Q363-R367 PolarHBondContact O-N 2.96Å; E364-R367 PolarHBondContact O-N 3.27Å; R367-K369 VanDerWaalsContact C-N 3.31Å; R367-K369 PolarHBondContact O-N 2.8Å; R367-T370 PolarHBondContact O-N 2.82Å; R367-E371 IonicContact CZ-OE1 3.46Å; R367-E371 VanDerWaalsContact CZ-OE1 3.26Å; R367-E371 IonicContact NE-OE1 3.28Å; R367-E371 PolarHBondContact NE-OE1 3.3Å; R367-E371 IonicContact NH2-OE1 2.85Å; R367-E371 PolarHBondContact NH2-OE1 2.86Å; R367-E371 WeakPolarHBondContact O-CG 3.46Å; R367-E371 PolarHBondContact O-N 2.83Å
368	L	94.5	Very high	91.2	Very high	17 Å²	17	63 Å²	63	9%	0.089	32%	0.316	C	S	.	.	H	α-helix	trans	-63.7	-36.7	-179.5	-175.4	62.8	0	0	0	111.9	E364 V365 L366 E371 V372 R457 M458 V463 V549	E364-L368 WeakPolarHBondContact O-CB 3.18Å; E364-L368 PolarHBondContact O-N 2.86Å; V365-L368 PolarHBondContact O-N 3.26Å; L366-L368 PolarHBondContact O-N 3.14Å; L368-E371 PolarHBondContact O-N 3.37Å; L368-V372 HydrophobicContact CD1-CG2 4.43Å; L368-V372 HydrophobicContact CG-CG2 4.47Å; L368-V372 WeakPolarHBondContact O-CB 3.43Å; L368-V372 VanDerWaalsContact O-CG2 3.29Å; L368-V372 WeakPolarHBondContact O-CG2 3.41Å; L368-V372 PolarHBondContact O-N 3.42Å; L368-R457 HydrophobicContact CD1-CG 4.15Å; L368-M458 HydrophobicContact CD1-CE 4.01Å; L368-M458 HydrophobicContact CD2-CE 4.28Å; L368-M458 HydrophobicContact CG-CE 4.48Å; L368-V463 HydrophobicContact CD2-CG1 4.17Å; L368-V463 HydrophobicContact CD2-CG2 4.06Å; L368-V463 HydrophobicContact CG-CG2 4.1Å; L368-V549 HydrophobicContact CD2-CG2 4Å
369	K	94.6	Very high	91.9	Very high	75 Å²	75	67.6 Å²	67.6	33%	0.326	33%	0.334	S	S	.	.	H	α-helix	trans	-60.3	-46.6	172.4	-79.7	176.3	173.8	-175.2	0	111.6	V365 L366 R367 E371 V372 Q373 V463	V365-K369 HydrophobicContact CG1-CD 4.08Å; V365-K369 HydrophobicContact CG1-CG 4.33Å; V365-K369 WeakPolarHBondContact O-CB 3.29Å; V365-K369 VanDerWaalsContact O-CG 3.29Å; V365-K369 WeakPolarHBondContact O-CG 3.46Å; V365-K369 PolarHBondContact O-N 2.71Å; L366-K369 WeakPolarHBondContact O-CB 3.39Å; L366-K369 PolarHBondContact O-N 2.88Å; R367-K369 VanDerWaalsContact C-N 3.31Å; R367-K369 PolarHBondContact O-N 2.8Å; K369-E371 VanDerWaalsContact C-N 3.34Å; K369-V372 PolarHBondContact O-N 2.92Å; K369-Q373 VanDerWaalsContact O-CB 3.32Å; K369-Q373 WeakPolarHBondContact O-CB 3.29Å; K369-Q373 VanDerWaalsContact O-CG 3.26Å; K369-Q373 WeakPolarHBondContact O-CG 3.39Å; K369-Q373 PolarHBondContact O-N 2.94Å; K369-V463 WeakPolarHBondContact CE-O 3.43Å; K369-V463 HydrophobicContact CG-CB 3.91Å; K369-V463 HydrophobicContact CG-CG2 4.44Å
370	T	93.4	Very high	92.1	Very high	68 Å²	68	66.9 Å²	66.9	42%	0.417	33%	0.327	S	S	.	.	H	α-helix	trans	-65	-37.9	176.9	-51.8	0	0	0	0	112	L347 L366 R367 Q373 S374	L347-T370 HydrophobicContact CD2-CG2 3.82Å; L366-T370 PolarHBondContact O-N 3.41Å; L366-T370 PolarHBondContact O-OG1 3.37Å; R367-T370 PolarHBondContact O-N 2.82Å; T370-Q373 PolarHBondContact O-N 3.18Å; T370-S374 WeakPolarHBondContact O-CB 3.39Å; T370-S374 PolarHBondContact O-N 3Å
371	E	94.3	Very high	92.3	Very high	35 Å²	35	65.3 Å²	65.3	16%	0.164	32%	0.323	C	S	.	.	H	α-helix	trans	-65.1	-41.7	174.4	-68.4	176.5	-174.8	0	0	111.9	R367 L368 K369 S374 R457	R367-E371 IonicContact CZ-OE1 3.46Å; R367-E371 VanDerWaalsContact CZ-OE1 3.26Å; R367-E371 IonicContact NE-OE1 3.28Å; R367-E371 PolarHBondContact NE-OE1 3.3Å; R367-E371 IonicContact NH2-OE1 2.85Å; R367-E371 PolarHBondContact NH2-OE1 2.86Å; R367-E371 WeakPolarHBondContact O-CG 3.46Å; R367-E371 PolarHBondContact O-N 2.83Å; L368-E371 PolarHBondContact O-N 3.37Å; K369-E371 VanDerWaalsContact C-N 3.34Å; E371-S374 WeakPolarHBondContact O-CB 3.45Å; E371-S374 PolarHBondContact O-N 2.92Å; E371-R457 HydrophobicContact CB-CB 4.21Å; E371-R457 HydrophobicContact CB-CG 3.8Å; E371-R457 IonicContact OE2-NH1 2.73Å; E371-R457 PolarHBondContact OE2-NH1 2.86Å
372	V	94.1	Very high	92.3	Very high	23 Å²	23	62.7 Å²	62.7	14%	0.139	31%	0.313	C	S	.	.	H	α-helix	trans	-67.4	-34.4	175.8	169.7	0	0	0	0	112.7	L368 K369 S374 R457 M458 V463	L368-V372 HydrophobicContact CD1-CG2 4.43Å; L368-V372 HydrophobicContact CG-CG2 4.47Å; L368-V372 WeakPolarHBondContact O-CB 3.43Å; L368-V372 VanDerWaalsContact O-CG2 3.29Å; L368-V372 WeakPolarHBondContact O-CG2 3.41Å; L368-V372 PolarHBondContact O-N 3.42Å; K369-V372 PolarHBondContact O-N 2.92Å; V372-S374 VanDerWaalsContact C-N 3.33Å; V372-R457 WeakPolarHBondContact CA-O 3.18Å; V372-R457 HydrophobicContact CG2-CG 3.83Å; V372-M458 HydrophobicContact CG2-CB 4.34Å; V372-M458 HydrophobicContact CG2-CE 4.3Å; V372-V463 HydrophobicContact CG2-CG2 4.29Å
373	Q	90.8	Very high	92.2	Very high	142 Å²	142	61.3 Å²	61.3	66%	0.664	31%	0.309	S	S	*	.	H	α-helix	trans	-84	-6.2	178.2	-70.2	174.4	-34.6	0	0	113.2	K369 T370 H375	K369-Q373 VanDerWaalsContact O-CB 3.32Å; K369-Q373 WeakPolarHBondContact O-CB 3.29Å; K369-Q373 VanDerWaalsContact O-CG 3.26Å; K369-Q373 WeakPolarHBondContact O-CG 3.39Å; K369-Q373 PolarHBondContact O-N 2.94Å; T370-Q373 PolarHBondContact O-N 3.18Å; Q373-H375 PolarHBondContact O-N 3.41Å
374	S	90.5	Very high	92.1	Very high	42 Å²	42	58.9 Å²	58.9	29%	0.294	30%	0.298	S	S	.	.			trans	-71.8	131.2	-178.7	-161.9	0	0	0	0	111.2	T370 E371 V372 H376	T370-S374 WeakPolarHBondContact O-CB 3.39Å; T370-S374 PolarHBondContact O-N 3Å; E371-S374 WeakPolarHBondContact O-CB 3.45Å; E371-S374 PolarHBondContact O-N 2.92Å; V372-S374 VanDerWaalsContact C-N 3.33Å; S374-H376 VanDerWaalsContact C-N 3.26Å; S374-H376 PolarHBondContact OG-N 2.75Å
375	H	81.6	Confident	92	Very high	67 Å²	67	56.1 Å²	56.1	31%	0.31	29%	0.288	S	S	.	.	S	Bend	trans	-69.6	-28.7	170.7	-55.7	112.6	0	0	0	111.6	D16 R42 Q373	D16-H375 IonicContact OD2-CE1 3.44Å; D16-H375 IonicContact OD2-ND1 3.68Å; R42-H375 PolarHBondContact NE-CE1 3.45Å; R42-H375 PolarHBondContact NE-NE2 3.15Å; R42-H375 PolarHBondContact NH2-CE1 3.02Å; Q373-H375 PolarHBondContact O-N 3.41Å
376	H	87	Confident	91.8	Very high	123 Å²	123	57 Å²	57	57%	0.569	29%	0.292	S	S	*	.	S	Bend	trans	-85	148.3	-177.5	-49	-57.3	0	0	0	112.4	S374	S374-H376 VanDerWaalsContact C-N 3.26Å; S374-H376 PolarHBondContact OG-N 2.75Å
377	G	89.2	Confident	91.8	Very high	31 Å²	31	53.7 Å²	53.7	32%	0.32	28%	0.275	S	S	.	.			trans	-72.8	133.6	174.1	0	0	0	0	0	112.5	K379 L455	G377-K379 PolarHBondContact O-N 3.38Å; G377-L455 CarbonylContact C-O 3.53Å; G377-L455 WeakPolarHBondContact CA-O 3.04Å
378	L	94	Very high	91.6	Very high	52 Å²	52	50.9 Å²	50.9	27%	0.272	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	112.9	169.6	-177.2	71.5	0	0	0	109.4	I380 L455	L378-I380 HydrophobicContact CD2-CG2 3.95Å; L378-I380 HydrophobicContact CG-CG2 3.97Å; L378-L455 WeakPolarHBondContact CB-O 3.49Å; L378-L455 PolarHBondContact N-O 2.76Å; L378-L455 PolarHBondContact O-N 3.21Å
379	K	94.8	Very high	91.5	Very high	132 Å²	132	52 Å²	52	57%	0.574	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	121.4	170.2	-72.3	164.9	168.7	-89.4	0	109.7	G377 E452 V454	G377-K379 PolarHBondContact O-N 3.38Å; K379-E452 HydrophobicContact CB-CG 4.26Å; K379-E452 WeakPolarHBondContact CD-OE2 3.4Å; K379-E452 HydrophobicContact CG-CG 4.23Å; K379-E452 IonicContact NZ-OE1 2.69Å; K379-E452 PolarHBondContact NZ-OE1 3.2Å; K379-E452 IonicContact NZ-OE2 2.69Å; K379-E452 PolarHBondContact NZ-OE2 3.41Å; K379-V454 HydrophobicContact CG-CG2 4.14Å
380	I	94.6	Very high	91.5	Very high	16 Å²	16	48.9 Å²	48.9	8%	0.082	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	154.6	171.3	63.5	173.1	0	0	0	109.9	L378 L382 F416 V417 V453 L455	L378-I380 HydrophobicContact CD2-CG2 3.95Å; L378-I380 HydrophobicContact CG-CG2 3.97Å; I380-L382 HydrophobicContact CD1-CD1 3.74Å; I380-L382 HydrophobicContact CD1-CD2 4.34Å; I380-L382 HydrophobicContact CD1-CG 3.92Å; I380-L382 HydrophobicContact CG1-CD1 4.42Å; I380-L382 HydrophobicContact CG1-CG 4.24Å; I380-F416 HydrophobicContact CD1-CB 4.12Å; I380-V417 HydrophobicContact CD1-CG1 4.16Å; I380-V453 HydrophobicContact CG1-CB 3.97Å; I380-V453 HydrophobicContact CG1-CG1 4.48Å; I380-V453 PolarHBondContact N-O 3.34Å; I380-V453 PolarHBondContact O-N 2.82Å; I380-L455 HydrophobicContact CD1-CD1 3.63Å; I380-L455 HydrophobicContact CD1-CG 4.29Å; I380-L455 HydrophobicContact CG1-CD1 4.44Å
381	T	93.8	Very high	91.5	Very high	93 Å²	93	45.7 Å²	45.7	57%	0.571	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	117	176.2	-51.8	0	0	0	0	109.8	K450 C451	T381-K450 HydrophobicContact CG2-CB 3.73Å; T381-K450 HydrophobicContact CG2-CD 4.07Å; T381-K450 HydrophobicContact CG2-CG 4.19Å; T381-C451 WeakPolarHBondContact CA-O 3.3Å
382	L	92.6	Very high	91.6	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147.2	177.5	-64.3	-179.9	0	0	0	110.2	I380 E386 I387 I390 L413 F416 C451 V453	I380-L382 HydrophobicContact CD1-CD1 3.74Å; I380-L382 HydrophobicContact CD1-CD2 4.34Å; I380-L382 HydrophobicContact CD1-CG 3.92Å; I380-L382 HydrophobicContact CG1-CD1 4.42Å; I380-L382 HydrophobicContact CG1-CG 4.24Å; L382-E386 HydrophobicContact CB-CB 4.34Å; L382-E386 HydrophobicContact CD2-CB 4.47Å; L382-I387 HydrophobicContact CB-CD1 4.4Å; L382-I387 HydrophobicContact CB-CG1 3.98Å; L382-I387 HydrophobicContact CD1-CG1 4.32Å; L382-I390 HydrophobicContact CD1-CD1 3.91Å; L382-L413 HydrophobicContact CD1-CD2 4.31Å; L382-L413 HydrophobicContact CD2-CD2 3.98Å; L382-F416 HydrophobicContact CD2-CD2 4.37Å; L382-C451 PolarHBondContact N-O 3.28Å; L382-C451 PolarHBondContact O-N 3.34Å; L382-V453 HydrophobicContact CB-CG2 4.15Å; L382-V453 HydrophobicContact CD1-CG2 4.26Å; L382-V453 HydrophobicContact CG-CG2 4.42Å
383	S	91	Very high	91.6	Very high	18 Å²	18	43.8 Å²	43.8	13%	0.126	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	155.9	167.7	57.8	0	0	0	0	111.9	A385 E386 I387 R449	S383-A385 PolarHBondContact O-N 2.69Å; S383-E386 WeakPolarHBondContact CB-OE2 3.46Å; S383-E386 PolarHBondContact N-OE2 2.93Å; S383-E386 PolarHBondContact O-N 3.06Å; S383-E386 VanDerWaalsContact O-N 3.09Å; S383-E386 WeakPolarHBondContact OG-CB 3.49Å; S383-E386 VanDerWaalsContact OG-CD 3.28Å; S383-E386 VanDerWaalsContact OG-CG 3.24Å; S383-E386 WeakPolarHBondContact OG-CG 3.27Å; S383-E386 PolarHBondContact OG-N 3.22Å; S383-E386 VanDerWaalsContact OG-N 3.12Å; S383-E386 PolarHBondContact OG-OE2 3.18Å; S383-I387 WeakPolarHBondContact O-CG1 3.25Å; S383-I387 PolarHBondContact O-N 2.96Å; S383-R449 CarbonylContact C-O 3.48Å; S383-R449 VanDerWaalsContact CA-O 3.28Å; S383-R449 WeakPolarHBondContact CA-O 3.42Å
384	I	90.6	Very high	91.7	Very high	1 Å²	1	40 Å²	40	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-56.6	-37.6	171.5	-63	-64.5	0	0	0	110.9	I387 L388 F440 I441 L447 R449 C451	I384-I387 HydrophobicContact CD1-CD1 4.45Å; I384-I387 PolarHBondContact O-N 3.21Å; I384-L388 HydrophobicContact CG2-CD1 4.34Å; I384-L388 WeakPolarHBondContact O-CG 3.45Å; I384-L388 PolarHBondContact O-N 3.05Å; I384-F440 HydrophobicContact CD1-CD1 4.42Å; I384-F440 HydrophobicContact CD1-CE1 3.74Å; I384-I441 HydrophobicContact CG2-CG2 3.85Å; I384-L447 HydrophobicContact CG2-CD2 4.1Å; I384-L447 PolarHBondContact N-O 2.81Å; I384-R449 HydrophobicContact CG1-CB 4.25Å; I384-R449 PolarHBondContact N-O 3.47Å; I384-C451 VanDerWaalsContact CD1-SG 3.58Å
385	A	89.3	Confident	91.8	Very high	21 Å²	21	38.1 Å²	38.1	17%	0.174	20%	0.203	C	C	.	.	H	α-helix	trans	-58.7	-48.5	172.2	0	0	0	0	0	112.6	S383 I387 L388 H389 L447	S383-A385 PolarHBondContact O-N 2.69Å; A385-I387 VanDerWaalsContact C-N 3.33Å; A385-I387 PolarHBondContact O-N 3Å; A385-L388 PolarHBondContact O-N 3.34Å; A385-H389 PolarHBondContact O-CD2 3.25Å; A385-H389 PolarHBondContact O-N 3.32Å; A385-L447 HydrophobicContact CB-CB 4.4Å; A385-L447 PolarHBondContact N-O 3.49Å
386	E	91.1	Very high	92.1	Very high	23 Å²	23	38.6 Å²	38.6	11%	0.107	22%	0.218	C	C	.	.	H	α-helix	trans	-61.5	-39	176.1	-79.4	162.4	137.5	0	0	112.3	L382 S383 L388 H389 L413	L382-E386 HydrophobicContact CB-CB 4.34Å; L382-E386 HydrophobicContact CD2-CB 4.47Å; S383-E386 WeakPolarHBondContact CB-OE2 3.46Å; S383-E386 PolarHBondContact N-OE2 2.93Å; S383-E386 PolarHBondContact O-N 3.06Å; S383-E386 VanDerWaalsContact O-N 3.09Å; S383-E386 WeakPolarHBondContact OG-CB 3.49Å; S383-E386 VanDerWaalsContact OG-CD 3.28Å; S383-E386 VanDerWaalsContact OG-CG 3.24Å; S383-E386 WeakPolarHBondContact OG-CG 3.27Å; S383-E386 PolarHBondContact OG-N 3.22Å; S383-E386 VanDerWaalsContact OG-N 3.12Å; S383-E386 PolarHBondContact OG-OE2 3.18Å; E386-L388 PolarHBondContact O-N 3.22Å; E386-H389 PolarHBondContact O-N 2.81Å; E386-L413 HydrophobicContact CB-CD2 4.03Å; E386-L413 HydrophobicContact CG-CD2 4.42Å
387	I	92	Very high	92.2	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-39.9	176.4	-65.4	167.7	0	0	0	111.3	L382 S383 I384 A385 H389 I390 F392 V426 L437 I441 C451 V453	L382-I387 HydrophobicContact CB-CD1 4.4Å; L382-I387 HydrophobicContact CB-CG1 3.98Å; L382-I387 HydrophobicContact CD1-CG1 4.32Å; S383-I387 WeakPolarHBondContact O-CG1 3.25Å; S383-I387 PolarHBondContact O-N 2.96Å; I384-I387 HydrophobicContact CD1-CD1 4.45Å; I384-I387 PolarHBondContact O-N 3.21Å; A385-I387 VanDerWaalsContact C-N 3.33Å; A385-I387 PolarHBondContact O-N 3Å; I387-H389 PolarHBondContact O-N 3.4Å; I387-I390 PolarHBondContact O-N 3.11Å; I387-I390 VanDerWaalsContact O-N 3.1Å; I387-F392 HydrophobicContact CG2-CE2 4.01Å; I387-F392 HydrophobicContact CG2-CZ 4.48Å; I387-V426 HydrophobicContact CD1-CG1 4.41Å; I387-L437 HydrophobicContact CG2-CD1 4.28Å; I387-I441 HydrophobicContact CG2-CD1 4.07Å; I387-C451 HydrophobicContact CD1-CB 4.34Å; I387-V453 HydrophobicContact CD1-CG2 3.7Å; I387-V453 HydrophobicContact CG1-CG2 4.2Å
388	L	90.1	Very high	92.3	Very high	84 Å²	84	36.5 Å²	36.5	44%	0.44	21%	0.21	S	C	.	.	H	α-helix	trans	-64.6	-23	176.2	-78.7	167.7	0	0	0	113.8	I384 A385 E386 I390 I441 L447	I384-L388 HydrophobicContact CG2-CD1 4.34Å; I384-L388 WeakPolarHBondContact O-CG 3.45Å; I384-L388 PolarHBondContact O-N 3.05Å; A385-L388 PolarHBondContact O-N 3.34Å; E386-L388 PolarHBondContact O-N 3.22Å; L388-I390 VanDerWaalsContact C-N 3.33Å; L388-I441 HydrophobicContact CD1-CG2 4.32Å; L388-I441 HydrophobicContact CD2-CD1 4.08Å; L388-I441 HydrophobicContact CD2-CG2 4.14Å; L388-I441 HydrophobicContact CG-CD1 4.41Å; L388-I441 HydrophobicContact CG-CG2 4.31Å; L388-L447 HydrophobicContact CD1-CD2 3.78Å
389	H	91.8	Very high	92.4	Very high	41 Å²	41	34 Å²	34	19%	0.19	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-1.5	175.2	-70.9	-61.5	0	0	0	113.8	A385 E386 I387 W404 Q405 S410 L413	A385-H389 PolarHBondContact O-CD2 3.25Å; A385-H389 PolarHBondContact O-N 3.32Å; E386-H389 PolarHBondContact O-N 2.81Å; I387-H389 PolarHBondContact O-N 3.4Å; H389-W404 CarbonylContact O-C 3.57Å; H389-W404 WeakPolarHBondContact O-CA 3.43Å; H389-W404 WeakPolarHBondContact O-CB 3.24Å; H389-Q405 HydrophobicContact CB-CB 4.19Å; H389-Q405 PolarHBondContact CE1-OE1 3.4Å; H389-Q405 PolarHBondContact ND1-OE1 2.97Å; H389-Q405 PolarHBondContact O-N 3.45Å; H389-S410 WeakPolarHBondContact CB-OG 3.38Å; H389-L413 HydrophobicContact CB-CD1 4.1Å
390	I	94.2	Very high	92.5	Very high	9 Å²	9	28.1 Å²	28.1	5%	0.046	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	133	175.2	-60.9	169	0	0	0	110	L382 I387 L388 F392 I401 L413 V417	L382-I390 HydrophobicContact CD1-CD1 3.91Å; I387-I390 PolarHBondContact O-N 3.11Å; I387-I390 VanDerWaalsContact O-N 3.1Å; L388-I390 VanDerWaalsContact C-N 3.33Å; I390-F392 HydrophobicContact CB-CD2 4.19Å; I390-F392 HydrophobicContact CB-CE2 3.58Å; I390-F392 HydrophobicContact CB-CZ 3.95Å; I390-F392 HydrophobicContact CD1-CZ 4.21Å; I390-F392 HydrophobicContact CG2-CD1 4.37Å; I390-F392 HydrophobicContact CG2-CD2 3.97Å; I390-F392 HydrophobicContact CG2-CE1 4Å; I390-F392 HydrophobicContact CG2-CE2 3.56Å; I390-F392 HydrophobicContact CG2-CG 4.37Å; I390-F392 HydrophobicContact CG2-CZ 3.58Å; I390-F392 WeakPolarHBondContact O-CD2 3.45Å; I390-F392 PolarHBondContact O-N 2.83Å; I390-I401 HydrophobicContact CG2-CB 4.31Å; I390-I401 HydrophobicContact CG2-CD1 3.96Å; I390-I401 HydrophobicContact CG2-CG1 3.81Å; I390-I401 HydrophobicContact CG2-CG2 3.83Å; I390-L413 HydrophobicContact CD1-CD2 3.96Å; I390-L413 HydrophobicContact CG1-CD1 3.81Å; I390-L413 HydrophobicContact CG1-CD2 4.15Å; I390-V417 HydrophobicContact CD1-CG1 4.14Å
391	A	94.5	Very high	92.6	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	109.1	171.5	0	0	0	0	0	110.6	C402 G403 M566 F572	A391-C402 VanDerWaalsContact CB-SG 3.51Å; A391-C402 PolarHBondContact O-N 3.44Å; A391-C402 PolarHBondContact O-SG 2.83Å; A391-C402 VanDerWaalsContact O-SG 3.36Å; A391-G403 PolarHBondContact N-O 3.04Å; A391-M566 HydrophobicContact CB-CE 4.01Å; A391-M566 HydrophobicContact CB-SD 4.18Å; A391-F572 HydrophobicContact CB-CB 3.66Å; A391-F572 HydrophobicContact CB-CD1 3.69Å; A391-F572 HydrophobicContact CB-CD2 4.33Å; A391-F572 HydrophobicContact CB-CE1 4.37Å; A391-F572 HydrophobicContact CB-CG 3.66Å
392	F	95.5	Very high	92.6	Very high	13 Å²	13	23 Å²	23	6%	0.057	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	139.9	173.7	-67.6	-79.6	0	0	0	111.3	I387 I390 L399 W400 I401 L423 L437	I387-F392 HydrophobicContact CG2-CE2 4.01Å; I387-F392 HydrophobicContact CG2-CZ 4.48Å; I390-F392 HydrophobicContact CB-CD2 4.19Å; I390-F392 HydrophobicContact CB-CE2 3.58Å; I390-F392 HydrophobicContact CB-CZ 3.95Å; I390-F392 HydrophobicContact CD1-CZ 4.21Å; I390-F392 HydrophobicContact CG2-CD1 4.37Å; I390-F392 HydrophobicContact CG2-CD2 3.97Å; I390-F392 HydrophobicContact CG2-CE1 4Å; I390-F392 HydrophobicContact CG2-CE2 3.56Å; I390-F392 HydrophobicContact CG2-CG 4.37Å; I390-F392 HydrophobicContact CG2-CZ 3.58Å; I390-F392 WeakPolarHBondContact O-CD2 3.45Å; I390-F392 PolarHBondContact O-N 2.83Å; F392-L399 HydrophobicContact CB-CD1 3.95Å; F392-L399 HydrophobicContact CB-CD2 3.83Å; F392-L399 HydrophobicContact CB-CG 3.79Å; F392-L399 HydrophobicContact CD1-CD2 3.86Å; F392-L399 HydrophobicContact CD1-CG 3.98Å; F392-L399 HydrophobicContact CG-CD2 3.95Å; F392-L399 HydrophobicContact CG-CG 4.23Å; F392-W400 CarbonylContact C-O 3.51Å; F392-W400 WeakPolarHBondContact CA-O 3.36Å; F392-I401 HydrophobicContact CD1-CG1 4.04Å; F392-I401 HydrophobicContact CE1-CD1 4.14Å; F392-I401 HydrophobicContact CE1-CG1 3.66Å; F392-I401 HydrophobicContact CZ-CG1 4.42Å; F392-L423 HydrophobicContact CE1-CB 4.2Å; F392-L423 HydrophobicContact CE1-CD2 4.17Å; F392-L437 HydrophobicContact CB-CD2 4.31Å; F392-L437 HydrophobicContact CD1-CD2 4.33Å; F392-L437 HydrophobicContact CD2-CD2 3.38Å; F392-L437 HydrophobicContact CE2-CD2 3.62Å; F392-L437 HydrophobicContact CG-CD2 3.76Å; F392-L437 HydrophobicContact CZ-CD2 4.21Å
393	V	95.1	Very high	92.7	Very high	6 Å²	6	23 Å²	23	4%	0.036	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	136.3	177.1	-71	0	0	0	0	111.8	V395 W400 C402 L559 Q562 M563 M566	V393-V395 HydrophobicContact CG2-CG2 4.38Å; V393-V395 PolarHBondContact O-N 3.36Å; V393-W400 HydrophobicContact CG2-CB 4.3Å; V393-W400 WeakPolarHBondContact CG2-O 3.48Å; V393-W400 PolarHBondContact N-O 2.81Å; V393-W400 PolarHBondContact O-N 3.05Å; V393-C402 HydrophobicContact CG1-CB 4.39Å; V393-C402 HydrophobicContact CG2-CB 3.8Å; V393-L559 HydrophobicContact CG2-CD2 3.56Å; V393-Q562 HydrophobicContact CB-CB 3.67Å; V393-Q562 HydrophobicContact CB-CG 4.48Å; V393-Q562 HydrophobicContact CG1-CB 3.67Å; V393-Q562 HydrophobicContact CG2-CB 4.42Å; V393-M563 HydrophobicContact CG1-CB 4.43Å; V393-M566 HydrophobicContact CG1-CG 4.5Å; V393-M566 HydrophobicContact CG1-SD 3.71Å
394	D	93.4	Very high	92.9	Very high	61 Å²	61	22.4 Å²	22.4	33%	0.326	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	117.5	173.9	-173	-33.9	0	0	0	110	G397 F398 Q562	D394-G397 PolarHBondContact OD1-N 3.36Å; D394-F398 WeakPolarHBondContact CA-O 3.26Å; D394-Q562 WeakPolarHBondContact O-CG 3.32Å; D394-Q562 PolarHBondContact O-NE2 3.11Å
395	V	91.8	Very high	92.8	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.018	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	120.1	175.4	169.3	0	0	0	0	109	V393 G397 F398 W400 F555 L558 L559 Q562	V393-V395 HydrophobicContact CG2-CG2 4.38Å; V393-V395 PolarHBondContact O-N 3.36Å; V395-G397 VanDerWaalsContact C-N 3.26Å; V395-G397 PolarHBondContact O-N 2.84Å; V395-F398 PolarHBondContact N-O 3Å; V395-F398 PolarHBondContact O-N 3.37Å; V395-W400 HydrophobicContact CB-CG 4.47Å; V395-W400 PolarHBondContact O-NE1 2.91Å; V395-F555 HydrophobicContact CG1-CD2 4.37Å; V395-F555 HydrophobicContact CG1-CE2 4.18Å; V395-L558 HydrophobicContact CB-CD2 4.49Å; V395-L558 HydrophobicContact CB-CG 4.4Å; V395-L558 HydrophobicContact CG1-CD2 3.48Å; V395-L558 VanDerWaalsContact CG1-CD2 3.48Å; V395-L558 HydrophobicContact CG1-CG 3.75Å; V395-L558 HydrophobicContact CG2-CD2 4.44Å; V395-L558 HydrophobicContact CG2-CG 3.84Å; V395-L559 HydrophobicContact CG2-CD2 4.13Å; V395-Q562 HydrophobicContact CG2-CG 3.97Å
396	A	86.8	Confident	92.5	Very high	77 Å²	77	28.8 Å²	28.8	64%	0.636	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	31.3	-179.5	0	0	0	0	0	114.7	F398	A396-F398 VanDerWaalsContact C-N 3.34Å
397	G	89	Confident	91.8	Very high	41 Å²	41	29.4 Å²	29.4	42%	0.423	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	14.3	179.5	0	0	0	0	0	114.1	D394 V395	D394-G397 PolarHBondContact OD1-N 3.36Å; V395-G397 VanDerWaalsContact C-N 3.26Å; V395-G397 PolarHBondContact O-N 2.84Å
398	F	93.3	Very high	90.7	Very high	69 Å²	69	37.1 Å²	37.1	30%	0.303	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	153.8	174.4	-53.4	-54.5	0	0	0	110.2	D394 V395 A396 W400 R422 D432	D394-F398 WeakPolarHBondContact CA-O 3.26Å; V395-F398 PolarHBondContact N-O 3Å; V395-F398 PolarHBondContact O-N 3.37Å; A396-F398 VanDerWaalsContact C-N 3.34Å; F398-W400 HydrophobicContact CB-CZ2 4.44Å; F398-W400 HydrophobicContact CD2-CZ2 4.33Å; F398-W400 PolarHBondContact O-NE1 3.37Å; F398-R422 HydrophobicContact CB-CG 4.42Å; F398-R422 VanDerWaalsContact CE1-CZ 3.5Å; F398-D432 CarbonylContact C-O 3.47Å
399	L	95.4	Very high	89.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	122.3	-179.6	-160	70	0	0	0	111.5	F392 L423 I431 D432 D434 L437	F392-L399 HydrophobicContact CB-CD1 3.95Å; F392-L399 HydrophobicContact CB-CD2 3.83Å; F392-L399 HydrophobicContact CB-CG 3.79Å; F392-L399 HydrophobicContact CD1-CD2 3.86Å; F392-L399 HydrophobicContact CD1-CG 3.98Å; F392-L399 HydrophobicContact CG-CD2 3.95Å; F392-L399 HydrophobicContact CG-CG 4.23Å; L399-L423 HydrophobicContact CB-CB 4.34Å; L399-L423 HydrophobicContact CD2-CD2 3.82Å; L399-L423 PolarHBondContact O-N 3.35Å; L399-I431 HydrophobicContact CD2-CG2 4.12Å; L399-D432 PolarHBondContact N-O 2.98Å; L399-D434 HydrophobicContact CD1-CB 4.03Å; L399-L437 HydrophobicContact CD2-CB 4.17Å; L399-L437 HydrophobicContact CD2-CD2 3.74Å
400	W	96.2	Very high	88.1	Confident	9 Å²	9	35.7 Å²	35.7	3%	0.034	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	144.2	-173.7	-55.9	80	0	0	0	112.3	F392 V393 V395 F398 C402 G420 D421 R422 P459 M460 F555 L559	F392-W400 CarbonylContact C-O 3.51Å; F392-W400 WeakPolarHBondContact CA-O 3.36Å; V393-W400 HydrophobicContact CG2-CB 4.3Å; V393-W400 WeakPolarHBondContact CG2-O 3.48Å; V393-W400 PolarHBondContact N-O 2.81Å; V393-W400 PolarHBondContact O-N 3.05Å; V395-W400 HydrophobicContact CB-CG 4.47Å; V395-W400 PolarHBondContact O-NE1 2.91Å; F398-W400 HydrophobicContact CB-CZ2 4.44Å; F398-W400 HydrophobicContact CD2-CZ2 4.33Å; F398-W400 PolarHBondContact O-NE1 3.37Å; W400-C402 PolarHBondContact O-N 2.9Å; W400-G420 VanDerWaalsContact CE3-O 3.3Å; W400-G420 WeakPolarHBondContact CZ3-O 3.41Å; W400-D421 CarbonylContact C-O 3.59Å; W400-D421 WeakPolarHBondContact CA-O 3.42Å; W400-R422 HydrophobicContact CD2-CB 4.25Å; W400-R422 HydrophobicContact CE3-CB 3.84Å; W400-R422 HydrophobicContact CH2-CB 4.37Å; W400-R422 HydrophobicContact CZ3-CB 3.93Å; W400-P459 HydrophobicContact CH2-CB 4.33Å; W400-P459 HydrophobicContact CH2-CG 4.15Å; W400-P459 HydrophobicContact CZ3-CB 4.34Å; W400-P459 HydrophobicContact CZ3-CG 3.89Å; W400-M460 HydrophobicContact CH2-CE 4.04Å; W400-M460 HydrophobicContact CH2-CG 4.1Å; W400-M460 HydrophobicContact CZ3-CG 4.41Å; W400-F555 AromaticContact CD2-CE2 3.93Å; W400-F555 HydrophobicContact CD2-CE2 3.93Å; W400-F555 AromaticContact CD2-CZ 3.78Å; W400-F555 HydrophobicContact CD2-CZ 3.78Å; W400-F555 AromaticContact CE2-CE2 3.97Å; W400-F555 HydrophobicContact CE3-CE2 4.04Å; W400-F555 AromaticContact CE3-CZ 3.49Å; W400-F555 HydrophobicContact CE3-CZ 3.49Å; W400-F555 VanDerWaalsContact CE3-CZ 3.49Å; W400-F555 HydrophobicContact CG-CE2 4.5Å; W400-F555 HydrophobicContact CG-CZ 4.39Å; W400-F555 HydrophobicContact CH2-CE2 4.19Å; W400-F555 HydrophobicContact CH2-CZ 4.21Å; W400-F555 HydrophobicContact CZ2-CE2 4.12Å; W400-F555 HydrophobicContact CZ2-CZ 4.49Å; W400-F555 HydrophobicContact CZ3-CE2 4.14Å; W400-F555 AromaticContact CZ3-CZ 3.7Å; W400-F555 HydrophobicContact CZ3-CZ 3.7Å; W400-L559 HydrophobicContact CB-CD2 3.81Å; W400-L559 HydrophobicContact CG-CD2 4.32Å
401	I	96.4	Very high	86.9	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	117.7	172.2	-62.1	-175.4	0	0	0	109	I390 F392 W404 V417 G420 D421 L455	I390-I401 HydrophobicContact CG2-CB 4.31Å; I390-I401 HydrophobicContact CG2-CD1 3.96Å; I390-I401 HydrophobicContact CG2-CG1 3.81Å; I390-I401 HydrophobicContact CG2-CG2 3.83Å; F392-I401 HydrophobicContact CD1-CG1 4.04Å; F392-I401 HydrophobicContact CE1-CD1 4.14Å; F392-I401 HydrophobicContact CE1-CG1 3.66Å; F392-I401 HydrophobicContact CZ-CG1 4.42Å; I401-W404 HydrophobicContact CG2-CE3 4.25Å; I401-W404 HydrophobicContact CG2-CZ3 4.47Å; I401-V417 HydrophobicContact CD1-CB 3.83Å; I401-V417 HydrophobicContact CD1-CG1 3.83Å; I401-G420 PolarHBondContact O-N 3.41Å; I401-D421 HydrophobicContact CB-CB 4.3Å; I401-D421 HydrophobicContact CD1-CB 4.01Å; I401-D421 HydrophobicContact CG1-CB 4.32Å; I401-D421 PolarHBondContact N-O 2.93Å; I401-L455 HydrophobicContact CD1-CD1 4.11Å; I401-L455 HydrophobicContact CD1-CD2 4.23Å
402	C	95.3	Very high	86.2	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.007	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-11.8	176.5	69.6	0	0	0	0	113.7	A391 V393 W400 M528 L559 M563	A391-C402 VanDerWaalsContact CB-SG 3.51Å; A391-C402 PolarHBondContact O-N 3.44Å; A391-C402 PolarHBondContact O-SG 2.83Å; A391-C402 VanDerWaalsContact O-SG 3.36Å; V393-C402 HydrophobicContact CG1-CB 4.39Å; V393-C402 HydrophobicContact CG2-CB 3.8Å; W400-C402 PolarHBondContact O-N 2.9Å; C402-M528 HydrophobicContact CB-CE 4.21Å; C402-M528 WeakPolarHBondContact O-CE 3.14Å; C402-L559 HydrophobicContact CB-CB 4.45Å; C402-M563 HydrophobicContact CB-CB 4.47Å; C402-M563 HydrophobicContact CB-SD 4.25Å
403	G	94.4	Very high	85.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.5	-177.3	178.4	0	0	0	0	0	111.6	A391 F572	A391-G403 PolarHBondContact N-O 3.04Å; G403-F572 WeakPolarHBondContact CA-O 3.36Å
404	W	93.5	Very high	85.1	Confident	6 Å²	6	48.7 Å²	48.7	2%	0.023	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	155.8	176.6	53.9	92.2	0	0	0	110.1	H389 I401 L413 V417 I419 P525 F572 V574	H389-W404 CarbonylContact O-C 3.57Å; H389-W404 WeakPolarHBondContact O-CA 3.43Å; H389-W404 WeakPolarHBondContact O-CB 3.24Å; I401-W404 HydrophobicContact CG2-CE3 4.25Å; I401-W404 HydrophobicContact CG2-CZ3 4.47Å; W404-L413 HydrophobicContact CB-CD1 4Å; W404-L413 HydrophobicContact CG-CB 4.4Å; W404-L413 HydrophobicContact CG-CD1 4.47Å; W404-V417 HydrophobicContact CD2-CG2 4.08Å; W404-V417 HydrophobicContact CE3-CG2 3.75Å; W404-V417 WeakPolarHBondContact CH2-O 3.42Å; W404-V417 HydrophobicContact CZ3-CG2 4.05Å; W404-I419 HydrophobicContact CH2-CG1 4.26Å; W404-I419 HydrophobicContact CZ3-CG1 3.85Å; W404-P525 HydrophobicContact CH2-CB 4.36Å; W404-P525 HydrophobicContact CH2-CG 4.2Å; W404-P525 HydrophobicContact CZ2-CG 3.96Å; W404-F572 PolarHBondContact N-O 2.94Å; W404-V574 HydrophobicContact CD2-CG2 3.65Å; W404-V574 HydrophobicContact CE3-CG2 3.89Å; W404-V574 HydrophobicContact CG-CG2 4.11Å; W404-V574 HydrophobicContact CH2-CG1 4.49Å; W404-V574 HydrophobicContact CH2-CG2 4.29Å; W404-V574 HydrophobicContact CZ2-CB 4.49Å; W404-V574 HydrophobicContact CZ2-CG1 3.79Å; W404-V574 HydrophobicContact CZ2-CG2 4.07Å; W404-V574 HydrophobicContact CZ3-CG2 4.19Å
405	Q	90.4	Very high	84.7	Confident	58 Å²	58	49.7 Å²	49.7	27%	0.271	29%	0.294	S	S	.	.			trans	-70.3	140.6	173.1	-167.8	173.7	-10.4	0	0	109.8	H389 S410 D571	H389-Q405 HydrophobicContact CB-CB 4.19Å; H389-Q405 PolarHBondContact CE1-OE1 3.4Å; H389-Q405 PolarHBondContact ND1-OE1 2.97Å; H389-Q405 PolarHBondContact O-N 3.45Å; Q405-S410 WeakPolarHBondContact O-CB 3.38Å; Q405-S410 PolarHBondContact O-OG 2.9Å; Q405-D571 WeakPolarHBondContact CA-O 3.32Å
406	T	82.6	Confident	84.5	Confident	99 Å²	99	53.5 Å²	53.5	61%	0.607	31%	0.31	S	S	*	.			trans	-100.7	25.2	-177.4	49.7	0	0	0	0	113.4	V574	T406-V574 HydrophobicContact CG2-CG1 4.34Å
407	S	75.6	Confident	84.8	Confident	35 Å²	35	49.9 Å²	49.9	25%	0.245	28%	0.28	C	S	.	.	S	Bend	trans	-65.7	163.6	176.4	59.3	0	0	0	0	111.9	V409 S410 G411	S407-V409 PolarHBondContact O-N 3.24Å; S407-S410 WeakPolarHBondContact O-CA 3.34Å; S407-S410 WeakPolarHBondContact O-CB 3.34Å; S407-S410 PolarHBondContact O-N 3.39Å; S407-S410 PolarHBondContact OG-OG 2.73Å; S407-S410 VanDerWaalsContact OG-OG 3.12Å; S407-G411 PolarHBondContact O-N 3.49Å
408	D	68.5	Low	85.1	Confident	166 Å²	166	49.1 Å²	49.1	89%	0.888	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-55.7	-37.4	-176.4	-57.5	-52.8	0	0	0	113	S410 G411	D408-S410 VanDerWaalsContact C-N 3.28Å; D408-S410 PolarHBondContact O-N 3.37Å; D408-G411 PolarHBondContact O-N 2.88Å
409	V	62.7	Low	85.3	Confident	94 Å²	94	46 Å²	46	57%	0.57	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-61.1	-37.8	174.7	-175.1	0	0	0	0	111.5	S407	S407-V409 PolarHBondContact O-N 3.24Å
410	S	64.5	Low	85.3	Confident	2 Å²	2	46 Å²	46	1%	0.014	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-88	-1	-172.8	-55.5	0	0	0	0	114.4	H389 Q405 S407 D408 K412 L413	H389-S410 WeakPolarHBondContact CB-OG 3.38Å; Q405-S410 WeakPolarHBondContact O-CB 3.38Å; Q405-S410 PolarHBondContact O-OG 2.9Å; S407-S410 WeakPolarHBondContact O-CA 3.34Å; S407-S410 WeakPolarHBondContact O-CB 3.34Å; S407-S410 PolarHBondContact O-N 3.39Å; S407-S410 PolarHBondContact OG-OG 2.73Å; S407-S410 VanDerWaalsContact OG-OG 3.12Å; D408-S410 VanDerWaalsContact C-N 3.28Å; D408-S410 PolarHBondContact O-N 3.37Å; S410-K412 PolarHBondContact O-N 2.92Å; S410-L413 WeakPolarHBondContact O-CB 3.49Å; S410-L413 PolarHBondContact O-N 3.34Å
411	G	70	Confident	85.4	Confident	53 Å²	53	45.5 Å²	45.5	55%	0.546	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-54.5	-27.8	-177.4	0	0	0	0	0	114.5	S407 D408	S407-G411 PolarHBondContact O-N 3.49Å; D408-G411 PolarHBondContact O-N 2.88Å
412	K	79.5	Confident	85.3	Confident	134 Å²	134	47.3 Å²	47.3	58%	0.583	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-71.4	-29.7	175.6	-65.4	176.9	-173.1	166.6	0	114.1	S410 R414 S415 F416	S410-K412 PolarHBondContact O-N 2.92Å; K412-R414 PolarHBondContact O-N 2.83Å; K412-S415 PolarHBondContact O-N 2.71Å; K412-S415 PolarHBondContact O-OG 3.34Å; K412-F416 HydrophobicContact CB-CD2 4.44Å; K412-F416 HydrophobicContact CB-CE2 4.13Å; K412-F416 WeakPolarHBondContact O-CD2 3.4Å
413	L	85.5	Confident	85.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-57.2	-37.8	-176.7	-71.4	-178.7	0	0	0	111.8	L382 E386 H389 I390 W404 S410 S415 F416 V417	L382-L413 HydrophobicContact CD1-CD2 4.31Å; L382-L413 HydrophobicContact CD2-CD2 3.98Å; E386-L413 HydrophobicContact CB-CD2 4.03Å; E386-L413 HydrophobicContact CG-CD2 4.42Å; H389-L413 HydrophobicContact CB-CD1 4.1Å; I390-L413 HydrophobicContact CD1-CD2 3.96Å; I390-L413 HydrophobicContact CG1-CD1 3.81Å; I390-L413 HydrophobicContact CG1-CD2 4.15Å; W404-L413 HydrophobicContact CB-CD1 4Å; W404-L413 HydrophobicContact CG-CB 4.4Å; W404-L413 HydrophobicContact CG-CD1 4.47Å; S410-L413 WeakPolarHBondContact O-CB 3.49Å; S410-L413 PolarHBondContact O-N 3.34Å; L413-S415 PolarHBondContact O-N 3.03Å; L413-S415 VanDerWaalsContact O-N 3.09Å; L413-F416 PolarHBondContact O-N 2.97Å; L413-V417 HydrophobicContact CB-CG2 4.23Å; L413-V417 WeakPolarHBondContact O-CG2 3.28Å; L413-V417 PolarHBondContact O-N 3.4Å
414	R	82.5	Confident	85.4	Confident	113 Å²	113	49.6 Å²	49.6	43%	0.426	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-56.2	-26.7	178.2	-176.8	-179.5	179	152.8	10	114.3	K412 R524	K412-R414 PolarHBondContact O-N 2.83Å; R414-R524 VanDerWaalsContact NH2-CG 3.27Å
415	S	84.4	Confident	85.5	Confident	83 Å²	83	49.9 Å²	49.9	58%	0.58	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-88.2	-9.1	175.6	45.1	0	0	0	0	114.3	K412 L413	K412-S415 PolarHBondContact O-N 2.71Å; K412-S415 PolarHBondContact O-OG 3.34Å; L413-S415 PolarHBondContact O-N 3.03Å; L413-S415 VanDerWaalsContact O-N 3.09Å
416	F	88.2	Confident	85.7	Confident	82 Å²	82	47.1 Å²	47.1	36%	0.36	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-31.9	-172.4	-62.1	-56.2	0	0	0	114.3	I380 L382 K412 L413 R457	I380-F416 HydrophobicContact CD1-CB 4.12Å; L382-F416 HydrophobicContact CD2-CD2 4.37Å; K412-F416 HydrophobicContact CB-CD2 4.44Å; K412-F416 HydrophobicContact CB-CE2 4.13Å; K412-F416 WeakPolarHBondContact O-CD2 3.4Å; L413-F416 PolarHBondContact O-N 2.97Å; F416-R457 PolarHBondContact O-NH2 2.83Å
417	V	93.9	Very high	86.2	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.006	25%	0.246	C	C	.	.			trans	-123	145.8	-176	-53.5	0	0	0	0	112.2	I380 I390 I401 W404 L413 L455	I380-V417 HydrophobicContact CD1-CG1 4.16Å; I390-V417 HydrophobicContact CD1-CG1 4.14Å; I401-V417 HydrophobicContact CD1-CB 3.83Å; I401-V417 HydrophobicContact CD1-CG1 3.83Å; W404-V417 HydrophobicContact CD2-CG2 4.08Å; W404-V417 HydrophobicContact CE3-CG2 3.75Å; W404-V417 WeakPolarHBondContact CH2-O 3.42Å; W404-V417 HydrophobicContact CZ3-CG2 4.05Å; L413-V417 HydrophobicContact CB-CG2 4.23Å; L413-V417 WeakPolarHBondContact O-CG2 3.28Å; L413-V417 PolarHBondContact O-N 3.4Å; V417-L455 HydrophobicContact CG1-CD1 3.92Å
418	H	95.3	Very high	87	Confident	26 Å²	26	45.9 Å²	45.9	12%	0.12	26%	0.262	C	S	.	.			trans	-123.5	154.7	178.3	-58.2	63.1	0	0	0	110	G420 D421 R457 M458 E520	H418-G420 PolarHBondContact O-N 3.49Å; H418-D421 PolarHBondContact N-OD2 3Å; H418-D421 IonicContact ND1-OD2 2.72Å; H418-D421 WeakPolarHBondContact O-CB 3.29Å; H418-D421 PolarHBondContact O-N 2.88Å; H418-D421 VanDerWaalsContact O-N 3.15Å; H418-R457 VanDerWaalsContact CE1-CZ 3.44Å; H418-R457 PolarHBondContact CE1-NH1 2.95Å; H418-R457 PolarHBondContact ND1-NE 2.86Å; H418-R457 PolarHBondContact ND1-NH2 3.32Å; H418-M458 HydrophobicContact CB-CE 3.75Å; H418-M458 HydrophobicContact CB-CG 3.81Å; H418-M458 HydrophobicContact CB-SD 3.56Å; H418-M458 VanDerWaalsContact CB-SD 3.56Å; H418-E520 IonicContact CD2-OE1 3.35Å; H418-E520 PolarHBondContact CD2-OE1 3.41Å; H418-E520 VanDerWaalsContact CD2-OE1 3.23Å; H418-E520 IonicContact CD2-OE2 3.58Å; H418-E520 IonicContact CG-OE1 3.15Å
419	I	96.1	Very high	88.1	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.01	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	125	173.7	-62.1	177	0	0	0	107.8	W404 T519 P525 M528 Q551 L559	W404-I419 HydrophobicContact CH2-CG1 4.26Å; W404-I419 HydrophobicContact CZ3-CG1 3.85Å; I419-T519 HydrophobicContact CG2-CG2 4.46Å; I419-P525 HydrophobicContact CD1-CB 4.26Å; I419-M528 HydrophobicContact CD1-CG 4.44Å; I419-M528 HydrophobicContact CG2-CE 4.07Å; I419-M528 HydrophobicContact CG2-SD 3.92Å; I419-Q551 PolarHBondContact O-NE2 3.14Å; I419-L559 HydrophobicContact CG2-CD1 4.46Å
420	G	96.3	Very high	89.6	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.9	3.1	-176.1	0	0	0	0	0	115	W400 I401 H418 M458	W400-G420 VanDerWaalsContact CE3-O 3.3Å; W400-G420 WeakPolarHBondContact CZ3-O 3.41Å; I401-G420 PolarHBondContact O-N 3.41Å; H418-G420 PolarHBondContact O-N 3.49Å; G420-M458 WeakPolarHBondContact O-CA 3.45Å
421	D	97	Very high	90.9	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-61.3	136.6	164.8	-80.7	-10.6	0	0	0	110.1	W400 I401 H418 L455 R457 M458	W400-D421 CarbonylContact C-O 3.59Å; W400-D421 WeakPolarHBondContact CA-O 3.42Å; I401-D421 HydrophobicContact CB-CB 4.3Å; I401-D421 HydrophobicContact CD1-CB 4.01Å; I401-D421 HydrophobicContact CG1-CB 4.32Å; I401-D421 PolarHBondContact N-O 2.93Å; H418-D421 PolarHBondContact N-OD2 3Å; H418-D421 IonicContact ND1-OD2 2.72Å; H418-D421 WeakPolarHBondContact O-CB 3.29Å; H418-D421 PolarHBondContact O-N 2.88Å; H418-D421 VanDerWaalsContact O-N 3.15Å; D421-L455 HydrophobicContact CB-CD1 4.38Å; D421-R457 VanDerWaalsContact CG-NE 3.32Å; D421-R457 VanDerWaalsContact OD1-CA 3.29Å; D421-R457 WeakPolarHBondContact OD1-CA 3.33Å; D421-R457 WeakPolarHBondContact OD1-CD 3.41Å; D421-R457 IonicContact OD1-CZ 3.26Å; D421-R457 IonicContact OD1-NE 2.92Å; D421-R457 PolarHBondContact OD1-NE 2.93Å; D421-R457 IonicContact OD2-CZ 3.42Å; D421-R457 IonicContact OD2-NE 2.76Å; D421-R457 PolarHBondContact OD2-NE 2.89Å; D421-R457 IonicContact OD2-NH2 2.7Å; D421-R457 PolarHBondContact OD2-NH2 3.3Å; D421-M458 WeakPolarHBondContact OD1-CG 3.49Å; D421-M458 PolarHBondContact OD1-N 3.35Å
422	R	95.9	Very high	91.8	Very high	38 Å²	38	42.7 Å²	42.7	14%	0.143	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128.4	175.9	168.9	176	166.9	-165	-5	109.5	F398 W400 L455 K456 P459	F398-R422 HydrophobicContact CB-CG 4.42Å; F398-R422 VanDerWaalsContact CE1-CZ 3.5Å; W400-R422 HydrophobicContact CD2-CB 4.25Å; W400-R422 HydrophobicContact CE3-CB 3.84Å; W400-R422 HydrophobicContact CH2-CB 4.37Å; W400-R422 HydrophobicContact CZ3-CB 3.93Å; R422-L455 CarbonylContact O-C 3.54Å; R422-L455 VanDerWaalsContact O-CA 3.29Å; R422-L455 WeakPolarHBondContact O-CA 3.41Å; R422-K456 HydrophobicContact CB-CB 4.35Å; R422-K456 PolarHBondContact N-O 3.43Å; R422-K456 PolarHBondContact O-N 3.42Å; R422-P459 HydrophobicContact CB-CG 4.12Å
423	L	96.7	Very high	92.3	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	135.9	167.2	-174.7	64.1	0	0	0	109.6	F392 L399 V426 I431 L437 V453 L455	F392-L423 HydrophobicContact CE1-CB 4.2Å; F392-L423 HydrophobicContact CE1-CD2 4.17Å; L399-L423 HydrophobicContact CB-CB 4.34Å; L399-L423 HydrophobicContact CD2-CD2 3.82Å; L399-L423 PolarHBondContact O-N 3.35Å; L423-V426 HydrophobicContact CD1-CG2 3.91Å; L423-V426 HydrophobicContact CD2-CG2 4.1Å; L423-V426 HydrophobicContact CG-CG2 4.5Å; L423-I431 HydrophobicContact CD2-CB 3.84Å; L423-I431 HydrophobicContact CD2-CG1 4.43Å; L423-I431 HydrophobicContact CD2-CG2 3.67Å; L423-I431 HydrophobicContact CG-CB 4.35Å; L423-L437 HydrophobicContact CD2-CD1 4.23Å; L423-L437 HydrophobicContact CD2-CD2 4.38Å; L423-V453 HydrophobicContact CD1-CG1 3.51Å; L423-L455 HydrophobicContact CB-CD2 4.36Å; L423-L455 HydrophobicContact CD1-CD2 3.78Å
424	V	95.5	Very high	92.4	Very high	49 Å²	49	40.4 Å²	40.4	30%	0.297	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	-49.5	176.6	-177.5	0	0	0	0	110.1	P430 I431 V454 K456	V424-P430 WeakPolarHBondContact O-CA 3.45Å; V424-I431 PolarHBondContact O-N 2.66Å; V424-V454 HydrophobicContact CB-CB 4.33Å; V424-V454 HydrophobicContact CB-CG1 4.12Å; V424-V454 WeakPolarHBondContact CB-O 3.24Å; V424-V454 HydrophobicContact CG1-CG1 4.49Å; V424-V454 PolarHBondContact N-O 2.92Å; V424-K456 HydrophobicContact CG2-CB 4.1Å
425	A	95.2	Very high	92.7	Very high	11 Å²	11	38.3 Å²	38.3	9%	0.091	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	159.5	-178.4	0	0	0	0	0	112.7	L429 V454	A425-L429 CarbonylContact C-O 3.51Å; A425-L429 WeakPolarHBondContact CA-O 3.24Å; A425-L429 VanDerWaalsContact CB-O 3.26Å; A425-L429 WeakPolarHBondContact CB-O 3.38Å; A425-V454 HydrophobicContact CB-CB 4.1Å; A425-V454 HydrophobicContact CB-CG2 4.08Å; A425-V454 PolarHBondContact N-O 2.99Å; A425-V454 PolarHBondContact O-N 2.99Å
426	V	94.6	Very high	93	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.006	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	126.2	169.6	-172	0	0	0	0	109.3	I387 L423 G428 L429 I431 L437 F440 C451 E452 V453	I387-V426 HydrophobicContact CD1-CG1 4.41Å; L423-V426 HydrophobicContact CD1-CG2 3.91Å; L423-V426 HydrophobicContact CD2-CG2 4.1Å; L423-V426 HydrophobicContact CG-CG2 4.5Å; V426-G428 PolarHBondContact O-N 3.17Å; V426-L429 PolarHBondContact N-O 3.11Å; V426-L429 WeakPolarHBondContact O-CB 3.42Å; V426-L429 PolarHBondContact O-N 3.01Å; V426-I431 HydrophobicContact CB-CG1 4.39Å; V426-I431 HydrophobicContact CG2-CG1 4.1Å; V426-L437 HydrophobicContact CG2-CD1 4.27Å; V426-F440 HydrophobicContact CB-CE1 4.25Å; V426-F440 HydrophobicContact CB-CZ 4.28Å; V426-F440 HydrophobicContact CG1-CD1 4.07Å; V426-F440 HydrophobicContact CG1-CE1 3.4Å; V426-F440 VanDerWaalsContact CG1-CE1 3.4Å; V426-F440 HydrophobicContact CG1-CE2 4.29Å; V426-F440 HydrophobicContact CG1-CZ 3.53Å; V426-C451 HydrophobicContact CG1-CB 3.91Å; V426-E452 CarbonylContact C-O 3.51Å; V426-E452 WeakPolarHBondContact CA-O 3.49Å; V426-V453 HydrophobicContact CG1-CG2 4.3Å; V426-V453 HydrophobicContact CG2-CG2 4.49Å
427	D	92.6	Very high	93.2	Very high	51 Å²	51	34.5 Å²	34.5	27%	0.273	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	40.8	-171.6	-71.9	-12.8	0	0	0	113	L429 F440 R449 C451 E452	D427-L429 PolarHBondContact O-N 3.5Å; D427-F440 HydrophobicContact CB-CE2 4.19Å; D427-F440 HydrophobicContact CB-CZ 4.13Å; D427-R449 IonicContact OD2-CZ 3.5Å; D427-R449 IonicContact OD2-NE 3.49Å; D427-R449 PolarHBondContact OD2-NE 2.94Å; D427-R449 IonicContact OD2-NH2 2.69Å; D427-R449 PolarHBondContact OD2-NH2 2.94Å; D427-C451 WeakPolarHBondContact OD1-CA 2.89Å; D427-C451 VanDerWaalsContact OD1-CB 3.3Å; D427-C451 WeakPolarHBondContact OD1-CB 3.45Å; D427-C451 PolarHBondContact OD2-SG 2.73Å; D427-E452 PolarHBondContact N-O 3.46Å; D427-E452 PolarHBondContact OD1-N 3.34Å
428	G	91.7	Very high	93	Very high	56 Å²	56	41 Å²	41	58%	0.577	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.9	-7.4	-177.7	0	0	0	0	0	115.5	V426	V426-G428 PolarHBondContact O-N 3.17Å
429	L	92.2	Very high	92.6	Very high	89 Å²	89	42.7 Å²	42.7	47%	0.466	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	123.5	174.5	-61.3	172.3	0	0	0	109.7	A425 V426 D427 F440	A425-L429 CarbonylContact C-O 3.51Å; A425-L429 WeakPolarHBondContact CA-O 3.24Å; A425-L429 VanDerWaalsContact CB-O 3.26Å; A425-L429 WeakPolarHBondContact CB-O 3.38Å; V426-L429 PolarHBondContact N-O 3.11Å; V426-L429 WeakPolarHBondContact O-CB 3.42Å; V426-L429 PolarHBondContact O-N 3.01Å; D427-L429 PolarHBondContact O-N 3.5Å; L429-F440 HydrophobicContact CD1-CD2 3.85Å; L429-F440 HydrophobicContact CD1-CE2 4.01Å
430	P	93.7	Very high	92.2	Very high	87 Å²	87	43.1 Å²	43.1	57%	0.565	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65	140.2	175	27.7	-33.9	0	0	0	110.7	V424	V424-P430 WeakPolarHBondContact O-CA 3.45Å
431	I	93.4	Very high	91.8	Very high	6 Å²	6	44.3 Å²	44.3	3%	0.031	26%	0.258	C	S	.	.			trans	-132.3	105.3	-178.2	-56.8	-67.3	0	0	0	109.2	L399 L423 V424 V426 Q436 L437	L399-I431 HydrophobicContact CD2-CG2 4.12Å; L423-I431 HydrophobicContact CD2-CB 3.84Å; L423-I431 HydrophobicContact CD2-CG1 4.43Å; L423-I431 HydrophobicContact CD2-CG2 3.67Å; L423-I431 HydrophobicContact CG-CB 4.35Å; V424-I431 PolarHBondContact O-N 2.66Å; V426-I431 HydrophobicContact CB-CG1 4.39Å; V426-I431 HydrophobicContact CG2-CG1 4.1Å; I431-Q436 HydrophobicContact CD1-CB 4Å; I431-Q436 HydrophobicContact CG2-CB 4.25Å; I431-L437 HydrophobicContact CG2-CB 3.9Å
432	D	87.8	Confident	91.2	Very high	67 Å²	67	47.6 Å²	47.6	36%	0.358	28%	0.281	S	S	.	.			trans	-99.3	-22.9	-179.3	-62.6	-53.7	0	0	0	112.7	F398 L399	F398-D432 CarbonylContact C-O 3.47Å; L399-D432 PolarHBondContact N-O 2.98Å
433	C	89.2	Confident	90.3	Very high	38 Å²	38	51.2 Å²	51.2	26%	0.257	30%	0.303	S	S	.	.	S	Bend	trans	-137.8	158.5	-177.4	77.2	0	0	0	0	114.9	A435 Q436 L437	C433-A435 PolarHBondContact O-N 3.14Å; C433-Q436 PolarHBondContact O-N 3.09Å; C433-Q436 VanDerWaalsContact O-N 3.15Å; C433-L437 PolarHBondContact O-N 3.48Å
434	D	89.4	Confident	89	Confident	48 Å²	48	56.5 Å²	56.5	26%	0.257	32%	0.323	S	S	.	.	H	α-helix	trans	-59.5	-31.4	-178.8	176.9	68.1	0	0	0	112.7	L399 L437 R438	L399-D434 HydrophobicContact CD1-CB 4.03Å; D434-L437 PolarHBondContact O-N 3.22Å; D434-R438 VanDerWaalsContact CG-NH2 3.32Å; D434-R438 WeakPolarHBondContact O-CG 3.2Å; D434-R438 PolarHBondContact O-N 3.05Å; D434-R438 IonicContact OD1-CZ 2.71Å; D434-R438 IonicContact OD1-NE 3.54Å; D434-R438 PolarHBondContact OD1-NE 3.15Å; D434-R438 IonicContact OD1-NH2 2.77Å; D434-R438 PolarHBondContact OD1-NH2 3.38Å; D434-R438 IonicContact OD2-CZ 3.16Å; D434-R438 VanDerWaalsContact OD2-CZ 3.28Å; D434-R438 IonicContact OD2-NE 2.64Å; D434-R438 PolarHBondContact OD2-NE 3.15Å; D434-R438 IonicContact OD2-NH2 2.78Å; D434-R438 PolarHBondContact OD2-NH2 3.28Å
435	A	88.9	Confident	87.7	Confident	68 Å²	68	63 Å²	63	56%	0.562	35%	0.348	S	S	*	.	H	α-helix	trans	-67.4	-39.1	177.4	0	0	0	0	0	112.8	C433 S439	C433-A435 PolarHBondContact O-N 3.14Å; A435-S439 WeakPolarHBondContact O-CB 3.23Å; A435-S439 PolarHBondContact O-N 2.96Å
436	Q	90.5	Very high	87	Confident	81 Å²	81	65.2 Å²	65.2	38%	0.379	37%	0.366	S	S	.	.	H	α-helix	trans	-65.1	-43.9	173.9	-73.5	167.8	-16.6	0	0	110.7	I431 C433 R438 S439 F440	I431-Q436 HydrophobicContact CD1-CB 4Å; I431-Q436 HydrophobicContact CG2-CB 4.25Å; C433-Q436 PolarHBondContact O-N 3.09Å; C433-Q436 VanDerWaalsContact O-N 3.15Å; Q436-R438 PolarHBondContact O-N 3.34Å; Q436-S439 WeakPolarHBondContact O-CB 3.35Å; Q436-S439 PolarHBondContact O-N 3.32Å; Q436-F440 PolarHBondContact O-N 3.11Å
437	L	91.4	Very high	86.5	Confident	5 Å²	5	69.6 Å²	69.6	3%	0.026	39%	0.389	C	S	.	.	H	α-helix	trans	-61.7	-45.1	177.3	-173.9	59.7	0	0	0	112.1	I387 F392 L399 L423 V426 I431 C433 D434 S439 F440 I441	I387-L437 HydrophobicContact CG2-CD1 4.28Å; F392-L437 HydrophobicContact CB-CD2 4.31Å; F392-L437 HydrophobicContact CD1-CD2 4.33Å; F392-L437 HydrophobicContact CD2-CD2 3.38Å; F392-L437 HydrophobicContact CE2-CD2 3.62Å; F392-L437 HydrophobicContact CG-CD2 3.76Å; F392-L437 HydrophobicContact CZ-CD2 4.21Å; L399-L437 HydrophobicContact CD2-CB 4.17Å; L399-L437 HydrophobicContact CD2-CD2 3.74Å; L423-L437 HydrophobicContact CD2-CD1 4.23Å; L423-L437 HydrophobicContact CD2-CD2 4.38Å; V426-L437 HydrophobicContact CG2-CD1 4.27Å; I431-L437 HydrophobicContact CG2-CB 3.9Å; C433-L437 PolarHBondContact O-N 3.48Å; D434-L437 PolarHBondContact O-N 3.22Å; L437-S439 VanDerWaalsContact C-N 3.34Å; L437-S439 PolarHBondContact O-N 2.95Å; L437-F440 PolarHBondContact O-N 3.31Å; L437-I441 HydrophobicContact CD1-CD1 4.25Å; L437-I441 HydrophobicContact CG-CD1 4.03Å; L437-I441 WeakPolarHBondContact O-CG1 3.49Å; L437-I441 PolarHBondContact O-N 2.95Å
438	R	89	Confident	86.1	Confident	136 Å²	136	74.1 Å²	74.1	51%	0.513	41%	0.413	S	S	.	.	H	α-helix	trans	-62	-41	175.4	-72.6	-179.1	-162.3	-68.7	-22.2	112.1	D434 Q436 I441 S442	D434-R438 VanDerWaalsContact CG-NH2 3.32Å; D434-R438 WeakPolarHBondContact O-CG 3.2Å; D434-R438 PolarHBondContact O-N 3.05Å; D434-R438 IonicContact OD1-CZ 2.71Å; D434-R438 IonicContact OD1-NE 3.54Å; D434-R438 PolarHBondContact OD1-NE 3.15Å; D434-R438 IonicContact OD1-NH2 2.77Å; D434-R438 PolarHBondContact OD1-NH2 3.38Å; D434-R438 IonicContact OD2-CZ 3.16Å; D434-R438 VanDerWaalsContact OD2-CZ 3.28Å; D434-R438 IonicContact OD2-NE 2.64Å; D434-R438 PolarHBondContact OD2-NE 3.15Å; D434-R438 IonicContact OD2-NH2 2.78Å; D434-R438 PolarHBondContact OD2-NH2 3.28Å; Q436-R438 PolarHBondContact O-N 3.34Å; R438-I441 PolarHBondContact O-N 3.15Å; R438-S442 VanDerWaalsContact O-CB 3.29Å; R438-S442 WeakPolarHBondContact O-CB 3.29Å; R438-S442 PolarHBondContact O-N 3.06Å; R438-S442 PolarHBondContact O-OG 3.34Å
439	S	87.9	Confident	86	Confident	62 Å²	62	76 Å²	76	43%	0.434	40%	0.402	S	S	.	.	H	α-helix	trans	-61.8	-46.6	175.7	-175.5	0	0	0	0	111.5	A435 Q436 L437 I441 S442 N443	A435-S439 WeakPolarHBondContact O-CB 3.23Å; A435-S439 PolarHBondContact O-N 2.96Å; Q436-S439 WeakPolarHBondContact O-CB 3.35Å; Q436-S439 PolarHBondContact O-N 3.32Å; L437-S439 VanDerWaalsContact C-N 3.34Å; L437-S439 PolarHBondContact O-N 2.95Å; S439-I441 PolarHBondContact O-N 2.84Å; S439-S442 PolarHBondContact O-N 3.06Å; S439-N443 WeakPolarHBondContact O-CB 3.38Å; S439-N443 PolarHBondContact O-N 2.83Å; S439-N443 PolarHBondContact O-ND2 3.42Å; S439-N443 PolarHBondContact OG-ND2 2.83Å
440	F	87.5	Confident	85.9	Confident	12 Å²	12	79.3 Å²	79.3	5%	0.053	41%	0.413	C	S	.	.	H	α-helix	trans	-55.7	-50.1	175	177.1	-92.1	0	0	0	112.2	I384 V426 D427 L429 Q436 L437 N443 R444	I384-F440 HydrophobicContact CD1-CD1 4.42Å; I384-F440 HydrophobicContact CD1-CE1 3.74Å; V426-F440 HydrophobicContact CB-CE1 4.25Å; V426-F440 HydrophobicContact CB-CZ 4.28Å; V426-F440 HydrophobicContact CG1-CD1 4.07Å; V426-F440 HydrophobicContact CG1-CE1 3.4Å; V426-F440 VanDerWaalsContact CG1-CE1 3.4Å; V426-F440 HydrophobicContact CG1-CE2 4.29Å; V426-F440 HydrophobicContact CG1-CZ 3.53Å; D427-F440 HydrophobicContact CB-CE2 4.19Å; D427-F440 HydrophobicContact CB-CZ 4.13Å; L429-F440 HydrophobicContact CD1-CD2 3.85Å; L429-F440 HydrophobicContact CD1-CE2 4.01Å; Q436-F440 PolarHBondContact O-N 3.11Å; L437-F440 PolarHBondContact O-N 3.31Å; F440-N443 PolarHBondContact O-N 2.82Å; F440-R444 HydrophobicContact CZ-CG 4.49Å; F440-R444 WeakPolarHBondContact O-CB 3.47Å; F440-R444 VanDerWaalsContact O-CG 3.29Å; F440-R444 WeakPolarHBondContact O-CG 3.26Å; F440-R444 PolarHBondContact O-N 3.09Å
441	I	88.9	Confident	85.8	Confident	25 Å²	25	75.2 Å²	75.2	13%	0.128	39%	0.387	C	S	.	.	H	α-helix	trans	-63.9	-43.9	179.3	-65.8	165.9	0	0	0	111	I384 I387 L388 L437 R438 S439 N443 R444	I384-I441 HydrophobicContact CG2-CG2 3.85Å; I387-I441 HydrophobicContact CG2-CD1 4.07Å; L388-I441 HydrophobicContact CD1-CG2 4.32Å; L388-I441 HydrophobicContact CD2-CD1 4.08Å; L388-I441 HydrophobicContact CD2-CG2 4.14Å; L388-I441 HydrophobicContact CG-CD1 4.41Å; L388-I441 HydrophobicContact CG-CG2 4.31Å; L437-I441 HydrophobicContact CD1-CD1 4.25Å; L437-I441 HydrophobicContact CG-CD1 4.03Å; L437-I441 WeakPolarHBondContact O-CG1 3.49Å; L437-I441 PolarHBondContact O-N 2.95Å; R438-I441 PolarHBondContact O-N 3.15Å; S439-I441 PolarHBondContact O-N 2.84Å; I441-N443 VanDerWaalsContact C-N 3.31Å; I441-N443 PolarHBondContact O-N 3.05Å; I441-R444 CarbonylContact O-C 3.59Å; I441-R444 PolarHBondContact O-N 3.2Å; I441-R444 VanDerWaalsContact O-N 3.11Å
442	S	84.5	Confident	85.9	Confident	69 Å²	69	78.2 Å²	78.2	48%	0.483	40%	0.4	S	S	.	.	H	α-helix	trans	-65.5	-34.2	-178	-55.2	0	0	0	0	112.3	R438 S439 R444 F445	R438-S442 VanDerWaalsContact O-CB 3.29Å; R438-S442 WeakPolarHBondContact O-CB 3.29Å; R438-S442 PolarHBondContact O-N 3.06Å; R438-S442 PolarHBondContact O-OG 3.34Å; S439-S442 PolarHBondContact O-N 3.06Å; S442-R444 VanDerWaalsContact C-N 3.26Å; S442-R444 PolarHBondContact O-N 3.36Å; S442-F445 WeakPolarHBondContact O-CE1 3.32Å; S442-F445 WeakPolarHBondContact O-CE2 3.49Å; S442-F445 WeakPolarHBondContact O-CZ 3.49Å
443	N	76.9	Confident	86.3	Confident	113 Å²	113	75.1 Å²	75.1	60%	0.604	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-6.9	177	-67.5	-24.6	0	0	0	113.6	S439 F440 I441	S439-N443 WeakPolarHBondContact O-CB 3.38Å; S439-N443 PolarHBondContact O-N 2.83Å; S439-N443 PolarHBondContact O-ND2 3.42Å; S439-N443 PolarHBondContact OG-ND2 2.83Å; F440-N443 PolarHBondContact O-N 2.82Å; I441-N443 VanDerWaalsContact C-N 3.31Å; I441-N443 PolarHBondContact O-N 3.05Å
444	R	69.2	Low	86.6	Confident	113 Å²	113	74.2 Å²	74.2	43%	0.426	38%	0.377	S	S	.	.			trans	-129.3	64.6	-172.9	-60.8	-64.1	-165.4	-159.5	1.1	110.8	F440 I441 S442 A446	F440-R444 HydrophobicContact CZ-CG 4.49Å; F440-R444 WeakPolarHBondContact O-CB 3.47Å; F440-R444 VanDerWaalsContact O-CG 3.29Å; F440-R444 WeakPolarHBondContact O-CG 3.26Å; F440-R444 PolarHBondContact O-N 3.09Å; I441-R444 CarbonylContact O-C 3.59Å; I441-R444 PolarHBondContact O-N 3.2Å; I441-R444 VanDerWaalsContact O-N 3.11Å; S442-R444 VanDerWaalsContact C-N 3.26Å; S442-R444 PolarHBondContact O-N 3.36Å; R444-A446 PolarHBondContact O-N 3.06Å
445	F	66.7	Low	86.9	Confident	186 Å²	186	72 Å²	72	82%	0.816	37%	0.365	S	S	*	.			trans	-54.5	-3.4	-173.8	-66	-79.3	0	0	0	118.5	S442 L447	S442-F445 WeakPolarHBondContact O-CE1 3.32Å; S442-F445 WeakPolarHBondContact O-CE2 3.49Å; S442-F445 WeakPolarHBondContact O-CZ 3.49Å; F445-L447 PolarHBondContact O-N 3.35Å
446	A	81.8	Confident	87.3	Confident	56 Å²	56	70.4 Å²	70.4	46%	0.463	35%	0.346	S	S	.	.			trans	-87.6	98	178.2	0	0	0	0	0	110.7	R444 D448 R449	R444-A446 PolarHBondContact O-N 3.06Å; A446-D448 VanDerWaalsContact C-N 3.26Å; A446-D448 PolarHBondContact O-N 2.83Å; A446-R449 HydrophobicContact CB-CB 3.93Å; A446-R449 WeakPolarHBondContact O-CB 3.31Å; A446-R449 PolarHBondContact O-N 3.4Å
447	L	82.9	Confident	87.6	Confident	94 Å²	94	66.9 Å²	66.9	49%	0.492	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-35.1	-178.3	-67.3	178.2	0	0	0	113.5	I384 A385 L388 F445 R449	I384-L447 HydrophobicContact CG2-CD2 4.1Å; I384-L447 PolarHBondContact N-O 2.81Å; A385-L447 HydrophobicContact CB-CB 4.4Å; A385-L447 PolarHBondContact N-O 3.49Å; L388-L447 HydrophobicContact CD1-CD2 3.78Å; F445-L447 PolarHBondContact O-N 3.35Å; L447-R449 VanDerWaalsContact C-N 3.29Å; L447-R449 PolarHBondContact O-N 2.89Å
448	D	84.8	Confident	87.8	Confident	146 Å²	146	66.7 Å²	66.7	78%	0.781	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-4.5	178.4	-56.8	-55.5	0	0	0	113.7	A446 K450	A446-D448 VanDerWaalsContact C-N 3.26Å; A446-D448 PolarHBondContact O-N 2.83Å; D448-K450 PolarHBondContact O-N 3.23Å
449	R	89.1	Confident	88	Confident	94 Å²	94	62 Å²	62	36%	0.355	32%	0.315	S	S	.	.			trans	-60.8	124.4	174.6	174.6	-177.2	166.5	130.1	-2.1	108.8	S383 I384 D427 A446 L447	S383-R449 CarbonylContact C-O 3.48Å; S383-R449 VanDerWaalsContact CA-O 3.28Å; S383-R449 WeakPolarHBondContact CA-O 3.42Å; I384-R449 HydrophobicContact CG1-CB 4.25Å; I384-R449 PolarHBondContact N-O 3.47Å; D427-R449 IonicContact OD2-CZ 3.5Å; D427-R449 IonicContact OD2-NE 3.49Å; D427-R449 PolarHBondContact OD2-NE 2.94Å; D427-R449 IonicContact OD2-NH2 2.69Å; D427-R449 PolarHBondContact OD2-NH2 2.94Å; A446-R449 HydrophobicContact CB-CB 3.93Å; A446-R449 WeakPolarHBondContact O-CB 3.31Å; A446-R449 PolarHBondContact O-N 3.4Å; L447-R449 VanDerWaalsContact C-N 3.29Å; L447-R449 PolarHBondContact O-N 2.89Å
450	K	90.6	Very high	88.3	Confident	160 Å²	160	61.9 Å²	61.9	70%	0.696	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	135.2	168	-67.8	-179.9	-175.7	175.5	0	110	T381 D448	T381-K450 HydrophobicContact CG2-CB 3.73Å; T381-K450 HydrophobicContact CG2-CD 4.07Å; T381-K450 HydrophobicContact CG2-CG 4.19Å; D448-K450 PolarHBondContact O-N 3.23Å
451	C	92	Very high	88.6	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.007	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	147.2	176.1	-71.5	0	0	0	0	110.2	T381 L382 I384 I387 V426 D427 V453	T381-C451 WeakPolarHBondContact CA-O 3.3Å; L382-C451 PolarHBondContact N-O 3.28Å; L382-C451 PolarHBondContact O-N 3.34Å; I384-C451 VanDerWaalsContact CD1-SG 3.58Å; I387-C451 HydrophobicContact CD1-CB 4.34Å; V426-C451 HydrophobicContact CG1-CB 3.91Å; D427-C451 WeakPolarHBondContact OD1-CA 2.89Å; D427-C451 VanDerWaalsContact OD1-CB 3.3Å; D427-C451 WeakPolarHBondContact OD1-CB 3.45Å; D427-C451 PolarHBondContact OD2-SG 2.73Å; C451-V453 PolarHBondContact O-N 3.05Å
452	E	94.9	Very high	89	Confident	68 Å²	68	65.6 Å²	65.6	32%	0.318	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	113.9	167.6	-170.5	-172.5	79.1	0	0	108.7	K379 V426 D427	K379-E452 HydrophobicContact CB-CG 4.26Å; K379-E452 WeakPolarHBondContact CD-OE2 3.4Å; K379-E452 HydrophobicContact CG-CG 4.23Å; K379-E452 IonicContact NZ-OE1 2.69Å; K379-E452 PolarHBondContact NZ-OE1 3.2Å; K379-E452 IonicContact NZ-OE2 2.69Å; K379-E452 PolarHBondContact NZ-OE2 3.41Å; V426-E452 CarbonylContact C-O 3.51Å; V426-E452 WeakPolarHBondContact CA-O 3.49Å; D427-E452 PolarHBondContact N-O 3.46Å; D427-E452 PolarHBondContact OD1-N 3.34Å
453	V	95.5	Very high	89.5	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.018	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	127.1	176.2	-178.6	0	0	0	0	108.3	I380 L382 I387 L423 V426 C451 L455	I380-V453 HydrophobicContact CG1-CB 3.97Å; I380-V453 HydrophobicContact CG1-CG1 4.48Å; I380-V453 PolarHBondContact N-O 3.34Å; I380-V453 PolarHBondContact O-N 2.82Å; L382-V453 HydrophobicContact CB-CG2 4.15Å; L382-V453 HydrophobicContact CD1-CG2 4.26Å; L382-V453 HydrophobicContact CG-CG2 4.42Å; I387-V453 HydrophobicContact CD1-CG2 3.7Å; I387-V453 HydrophobicContact CG1-CG2 4.2Å; L423-V453 HydrophobicContact CD1-CG1 3.51Å; V426-V453 HydrophobicContact CG1-CG2 4.3Å; V426-V453 HydrophobicContact CG2-CG2 4.49Å; C451-V453 PolarHBondContact O-N 3.05Å; V453-L455 HydrophobicContact CG1-CD2 3.77Å; V453-L455 HydrophobicContact CG1-CG 4.07Å
454	V	96.4	Very high	90.5	Very high	19 Å²	19	59 Å²	59	12%	0.115	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	116	178.8	-173.1	0	0	0	0	108.8	K379 V424 A425	K379-V454 HydrophobicContact CG-CG2 4.14Å; V424-V454 HydrophobicContact CB-CB 4.33Å; V424-V454 HydrophobicContact CB-CG1 4.12Å; V424-V454 WeakPolarHBondContact CB-O 3.24Å; V424-V454 HydrophobicContact CG1-CG1 4.49Å; V424-V454 PolarHBondContact N-O 2.92Å; A425-V454 HydrophobicContact CB-CB 4.1Å; A425-V454 HydrophobicContact CB-CG2 4.08Å; A425-V454 PolarHBondContact N-O 2.99Å; A425-V454 PolarHBondContact O-N 2.99Å
455	L	96.7	Very high	91.7	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	132.7	-179.3	-59.6	-177	0	0	0	111.5	G377 L378 I380 I401 V417 D421 R422 L423 V453	G377-L455 CarbonylContact C-O 3.53Å; G377-L455 WeakPolarHBondContact CA-O 3.04Å; L378-L455 WeakPolarHBondContact CB-O 3.49Å; L378-L455 PolarHBondContact N-O 2.76Å; L378-L455 PolarHBondContact O-N 3.21Å; I380-L455 HydrophobicContact CD1-CD1 3.63Å; I380-L455 HydrophobicContact CD1-CG 4.29Å; I380-L455 HydrophobicContact CG1-CD1 4.44Å; I401-L455 HydrophobicContact CD1-CD1 4.11Å; I401-L455 HydrophobicContact CD1-CD2 4.23Å; V417-L455 HydrophobicContact CG1-CD1 3.92Å; D421-L455 HydrophobicContact CB-CD1 4.38Å; R422-L455 CarbonylContact O-C 3.54Å; R422-L455 VanDerWaalsContact O-CA 3.29Å; R422-L455 WeakPolarHBondContact O-CA 3.41Å; L423-L455 HydrophobicContact CB-CD2 4.36Å; L423-L455 HydrophobicContact CD1-CD2 3.78Å; V453-L455 HydrophobicContact CG1-CD2 3.77Å; V453-L455 HydrophobicContact CG1-CG 4.07Å
456	K	95.9	Very high	93.1	Very high	34 Å²	34	46.2 Å²	46.2	15%	0.148	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	118.2	161.4	-159.9	173.2	177.1	162.4	0	107.1	D41 R422 V424 M458 P459	D41-K456 IonicContact OD2-NZ 3.23Å; D41-K456 PolarHBondContact OD2-NZ 2.94Å; R422-K456 HydrophobicContact CB-CB 4.35Å; R422-K456 PolarHBondContact N-O 3.43Å; R422-K456 PolarHBondContact O-N 3.42Å; V424-K456 HydrophobicContact CG2-CB 4.1Å; K456-M458 PolarHBondContact O-N 2.82Å; K456-P459 HydrophobicContact CB-CG 4.02Å; K456-P459 HydrophobicContact CD-CG 4Å; K456-P459 HydrophobicContact CG-CG 3.87Å; K456-P459 WeakPolarHBondContact O-CD 3.3Å
457	R	96.6	Very high	93.6	Very high	8 Å²	8	48.5 Å²	48.5	3%	0.03	23%	0.231	C	C	.	.			trans	-73.1	113.6	-171.1	169.9	51.3	45.8	75.9	-2.7	110.5	L368 E371 V372 F416 H418 D421	L368-R457 HydrophobicContact CD1-CG 4.15Å; E371-R457 HydrophobicContact CB-CB 4.21Å; E371-R457 HydrophobicContact CB-CG 3.8Å; E371-R457 IonicContact OE2-NH1 2.73Å; E371-R457 PolarHBondContact OE2-NH1 2.86Å; V372-R457 WeakPolarHBondContact CA-O 3.18Å; V372-R457 HydrophobicContact CG2-CG 3.83Å; F416-R457 PolarHBondContact O-NH2 2.83Å; H418-R457 VanDerWaalsContact CE1-CZ 3.44Å; H418-R457 PolarHBondContact CE1-NH1 2.95Å; H418-R457 PolarHBondContact ND1-NE 2.86Å; H418-R457 PolarHBondContact ND1-NH2 3.32Å; D421-R457 VanDerWaalsContact CG-NE 3.32Å; D421-R457 VanDerWaalsContact OD1-CA 3.29Å; D421-R457 WeakPolarHBondContact OD1-CA 3.33Å; D421-R457 WeakPolarHBondContact OD1-CD 3.41Å; D421-R457 IonicContact OD1-CZ 3.26Å; D421-R457 IonicContact OD1-NE 2.92Å; D421-R457 PolarHBondContact OD1-NE 2.93Å; D421-R457 IonicContact OD2-CZ 3.42Å; D421-R457 IonicContact OD2-NE 2.76Å; D421-R457 PolarHBondContact OD2-NE 2.89Å; D421-R457 IonicContact OD2-NH2 2.7Å; D421-R457 PolarHBondContact OD2-NH2 3.3Å
458	M	95.8	Very high	94.1	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	21%	0.211	C	C	.	.			trans	25.2	65.8	-177.8	-61.5	-178.3	-77.1	0	0	116.6	L368 V372 H418 G420 D421 K456 M460 A461 V549 Q551	L368-M458 HydrophobicContact CD1-CE 4.01Å; L368-M458 HydrophobicContact CD2-CE 4.28Å; L368-M458 HydrophobicContact CG-CE 4.48Å; V372-M458 HydrophobicContact CG2-CB 4.34Å; V372-M458 HydrophobicContact CG2-CE 4.3Å; H418-M458 HydrophobicContact CB-CE 3.75Å; H418-M458 HydrophobicContact CB-CG 3.81Å; H418-M458 HydrophobicContact CB-SD 3.56Å; H418-M458 VanDerWaalsContact CB-SD 3.56Å; G420-M458 WeakPolarHBondContact O-CA 3.45Å; D421-M458 WeakPolarHBondContact OD1-CG 3.49Å; D421-M458 PolarHBondContact OD1-N 3.35Å; K456-M458 PolarHBondContact O-N 2.82Å; M458-M460 PolarHBondContact O-N 3.4Å; M458-A461 HydrophobicContact CB-CB 3.59Å; M458-A461 HydrophobicContact CG-CB 4.49Å; M458-A461 WeakPolarHBondContact O-CB 3.42Å; M458-A461 PolarHBondContact O-N 3.4Å; M458-A461 HydrophobicContact SD-CB 4.22Å; M458-V549 HydrophobicContact CE-CG1 3.9Å; M458-V549 HydrophobicContact CE-CG2 4.44Å; M458-V549 HydrophobicContact SD-CG1 3.7Å; M458-Q551 PolarHBondContact SD-NE2 2.77Å
459	P	94	Very high	94.4	Very high	36 Å²	36	42.1 Å²	42.1	23%	0.234	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-29.2	-173.8	-26.8	28.3	0	0	0	115.9	W400 R422 K456	W400-P459 HydrophobicContact CH2-CB 4.33Å; W400-P459 HydrophobicContact CH2-CG 4.15Å; W400-P459 HydrophobicContact CZ3-CB 4.34Å; W400-P459 HydrophobicContact CZ3-CG 3.89Å; R422-P459 HydrophobicContact CB-CG 4.12Å; K456-P459 HydrophobicContact CB-CG 4.02Å; K456-P459 HydrophobicContact CD-CG 4Å; K456-P459 HydrophobicContact CG-CG 3.87Å; K456-P459 WeakPolarHBondContact O-CD 3.3Å
460	M	92.9	Very high	94.5	Very high	61 Å²	61	43 Å²	43	30%	0.3	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	3.1	-175.9	-53.9	-53.2	166.9	0	0	113.3	W400 M458 S507 P552 F555	W400-M460 HydrophobicContact CH2-CE 4.04Å; W400-M460 HydrophobicContact CH2-CG 4.1Å; W400-M460 HydrophobicContact CZ3-CG 4.41Å; M458-M460 PolarHBondContact O-N 3.4Å; M460-S507 WeakPolarHBondContact SD-CB 3.35Å; M460-S507 PolarHBondContact SD-OG 3.36Å; M460-P552 WeakPolarHBondContact O-CD 3.42Å; M460-F555 HydrophobicContact CB-CD1 4.37Å
461	A	95.7	Very high	94.3	Very high	10 Å²	10	39.2 Å²	39.2	8%	0.083	20%	0.199	C	C	.	.			trans	-89.4	156.3	-175.2	0	0	0	0	0	113.9	M458 V549 V550 Q551	M458-A461 HydrophobicContact CB-CB 3.59Å; M458-A461 HydrophobicContact CG-CB 4.49Å; M458-A461 WeakPolarHBondContact O-CB 3.42Å; M458-A461 PolarHBondContact O-N 3.4Å; M458-A461 HydrophobicContact SD-CB 4.22Å; A461-V549 HydrophobicContact CB-CG1 3.86Å; A461-V550 CarbonylContact C-O 3.51Å; A461-V550 WeakPolarHBondContact CA-O 3.14Å; A461-Q551 HydrophobicContact CB-CG 3.69Å
462	K	95.3	Very high	93.9	Very high	104 Å²	104	41.4 Å²	41.4	45%	0.452	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	138.3	161.6	-65.9	-175.9	-174	163.8	0	109.5	F464 W516 V550	K462-F464 HydrophobicContact CB-CD2 4.41Å; K462-F464 HydrophobicContact CB-CE2 3.64Å; K462-F464 HydrophobicContact CB-CZ 4.26Å; K462-W516 HydrophobicContact CB-CH2 4.28Å; K462-W516 HydrophobicContact CB-CZ3 4.47Å; K462-W516 HydrophobicContact CD-CH2 3.46Å; K462-W516 VanDerWaalsContact CD-CH2 3.46Å; K462-W516 HydrophobicContact CD-CZ2 3.59Å; K462-W516 HydrophobicContact CD-CZ3 4.42Å; K462-W516 HydrophobicContact CG-CH2 3.74Å; K462-W516 HydrophobicContact CG-CZ2 4.33Å; K462-W516 HydrophobicContact CG-CZ3 4.3Å; K462-V550 HydrophobicContact CB-CG2 4.07Å; K462-V550 PolarHBondContact N-O 3.38Å; K462-V550 WeakPolarHBondContact O-CG2 3.14Å; K462-V550 PolarHBondContact O-N 2.92Å
463	V	96.6	Very high	93.8	Very high	12 Å²	12	39.5 Å²	39.5	7%	0.073	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.2	-178.8	-169	0	0	0	0	109.1	V365 L368 K369 V372 I548 V549	V365-V463 HydrophobicContact CG1-CG1 3.84Å; V365-V463 HydrophobicContact CG2-CG1 4.42Å; L368-V463 HydrophobicContact CD2-CG1 4.17Å; L368-V463 HydrophobicContact CD2-CG2 4.06Å; L368-V463 HydrophobicContact CG-CG2 4.1Å; K369-V463 WeakPolarHBondContact CE-O 3.43Å; K369-V463 HydrophobicContact CG-CB 3.91Å; K369-V463 HydrophobicContact CG-CG2 4.44Å; V372-V463 HydrophobicContact CG2-CG2 4.29Å; V463-I548 WeakPolarHBondContact CA-O 3.44Å; V463-V549 HydrophobicContact CG1-CG2 4.37Å; V463-V549 HydrophobicContact CG2-CG2 4.38Å
464	F	96.3	Very high	93.6	Very high	31 Å²	31	42.5 Å²	42.5	14%	0.136	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	149.4	178.4	-65.2	-94.4	0	0	0	110.8	K462 F466 F500 S547 I548 V550	K462-F464 HydrophobicContact CB-CD2 4.41Å; K462-F464 HydrophobicContact CB-CE2 3.64Å; K462-F464 HydrophobicContact CB-CZ 4.26Å; F464-F466 HydrophobicContact CB-CE1 3.97Å; F464-F466 HydrophobicContact CB-CE2 4.28Å; F464-F466 HydrophobicContact CB-CZ 3.68Å; F464-F466 HydrophobicContact CG-CZ 4.35Å; F464-F500 HydrophobicContact CD1-CB 4.45Å; F464-F500 AromaticContact CD1-CD2 3.94Å; F464-F500 HydrophobicContact CD1-CD2 3.94Å; F464-F500 AromaticContact CD2-CD2 3.58Å; F464-F500 HydrophobicContact CD2-CD2 3.58Å; F464-F500 AromaticContact CD2-CE2 3.76Å; F464-F500 HydrophobicContact CD2-CE2 3.76Å; F464-F500 HydrophobicContact CE1-CB 4.15Å; F464-F500 AromaticContact CE1-CD2 3.81Å; F464-F500 HydrophobicContact CE1-CD2 3.81Å; F464-F500 HydrophobicContact CE1-CG 4.39Å; F464-F500 AromaticContact CE2-CD2 3.43Å; F464-F500 HydrophobicContact CE2-CD2 3.43Å; F464-F500 VanDerWaalsContact CE2-CD2 3.43Å; F464-F500 AromaticContact CE2-CE2 3.57Å; F464-F500 HydrophobicContact CE2-CE2 3.57Å; F464-F500 AromaticContact CG-CD2 3.83Å; F464-F500 HydrophobicContact CG-CD2 3.83Å; F464-F500 HydrophobicContact CG-CE2 4.42Å; F464-F500 AromaticContact CZ-CD2 3.55Å; F464-F500 HydrophobicContact CZ-CD2 3.55Å; F464-F500 HydrophobicContact CZ-CE2 4.11Å; F464-F500 HydrophobicContact CZ-CG 4.3Å; F464-S547 CarbonylContact O-C 3.42Å; F464-S547 VanDerWaalsContact O-CA 3.28Å; F464-S547 WeakPolarHBondContact O-CA 3.31Å; F464-I548 HydrophobicContact CB-CG1 3.89Å; F464-I548 HydrophobicContact CD2-CG1 4.48Å; F464-I548 PolarHBondContact N-O 3.22Å; F464-I548 PolarHBondContact O-N 3.37Å; F464-V550 HydrophobicContact CD2-CG2 4.05Å; F464-V550 HydrophobicContact CE2-CG2 3.73Å
465	L	95.4	Very high	93.5	Very high	28 Å²	28	41.8 Å²	41.8	15%	0.147	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	129.1	170.9	177.4	68.1	0	0	0	107.7	R361 E362 V365 E545	R361-L465 HydrophobicContact CG-CD1 3.86Å; E362-L465 HydrophobicContact CB-CD2 3.66Å; E362-L465 HydrophobicContact CG-CD2 3.66Å; V365-L465 HydrophobicContact CG1-CB 4.13Å; V365-L465 HydrophobicContact CG2-CB 4.4Å; V365-L465 HydrophobicContact CG2-CD1 4.34Å; L465-E545 HydrophobicContact CD1-CB 4.33Å
466	F	95	Very high	93.4	Very high	3 Å²	3	41.9 Å²	41.9	1%	0.013	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	126.3	174.9	-47.8	-63.4	0	0	0	109.2	F464 V475 L494 A495 A498 F500 E545 L546 I548	F464-F466 HydrophobicContact CB-CE1 3.97Å; F464-F466 HydrophobicContact CB-CE2 4.28Å; F464-F466 HydrophobicContact CB-CZ 3.68Å; F464-F466 HydrophobicContact CG-CZ 4.35Å; F466-V475 HydrophobicContact CD1-CG1 4.37Å; F466-V475 HydrophobicContact CD2-CG1 3.48Å; F466-V475 VanDerWaalsContact CD2-CG1 3.48Å; F466-V475 HydrophobicContact CE2-CG1 3.6Å; F466-V475 HydrophobicContact CG-CG1 3.87Å; F466-V475 HydrophobicContact CZ-CG1 4.13Å; F466-L494 HydrophobicContact CB-CB 4.32Å; F466-A495 HydrophobicContact CE1-CB 4.19Å; F466-A495 HydrophobicContact CZ-CB 4.35Å; F466-A498 HydrophobicContact CD1-CB 3.82Å; F466-A498 HydrophobicContact CE1-CB 3.78Å; F466-F500 HydrophobicContact CZ-CD2 4.48Å; F466-E545 WeakPolarHBondContact O-CA 3.14Å; F466-L546 HydrophobicContact CD2-CB 4.46Å; F466-L546 HydrophobicContact CD2-CD2 4.16Å; F466-L546 HydrophobicContact CD2-CG 4.47Å; F466-L546 PolarHBondContact N-O 2.89Å; F466-L546 PolarHBondContact O-N 3.39Å; F466-I548 HydrophobicContact CE2-CD1 3.64Å; F466-I548 HydrophobicContact CE2-CG1 3.7Å; F466-I548 HydrophobicContact CE2-CG2 4.15Å; F466-I548 HydrophobicContact CZ-CD1 3.79Å; F466-I548 HydrophobicContact CZ-CG1 4.06Å
467	K	93.4	Very high	93.4	Very high	104 Å²	104	41.2 Å²	41.2	45%	0.452	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	110.3	175.3	-70.2	179.2	167.5	173.9	0	108.6	E362 L494 R544 E545	E362-K467 WeakPolarHBondContact OE1-CE 3.48Å; E362-K467 IonicContact OE1-NZ 3.04Å; E362-K467 PolarHBondContact OE1-NZ 2.96Å; E362-K467 IonicContact OE2-NZ 3.46Å; E362-K467 PolarHBondContact OE2-NZ 2.84Å; K467-L494 WeakPolarHBondContact O-CD2 3.3Å; K467-R544 CarbonylContact C-O 3.52Å; K467-E545 WeakPolarHBondContact CE-OE1 3.4Å; K467-E545 HydrophobicContact CG-CG 4.36Å
468	R	93.7	Very high	93.2	Very high	16 Å²	16	44 Å²	44	6%	0.06	25%	0.246	C	C	.	.			trans	-81.2	147.6	177.1	-61.4	-174.5	174.9	132.3	-9.3	111.1	H470 E473 L494 L539 A541 G543 R544	R468-H470 WeakPolarHBondContact CB-O 3.43Å; R468-E473 WeakPolarHBondContact CA-OE2 3.17Å; R468-E473 HydrophobicContact CB-CB 4Å; R468-E473 WeakPolarHBondContact CD-O 3.44Å; R468-E473 HydrophobicContact CG-CB 3.98Å; R468-E473 PolarHBondContact NE-O 2.69Å; R468-L494 HydrophobicContact CB-CD1 4.34Å; R468-L494 HydrophobicContact CG-CD1 3.71Å; R468-L539 PolarHBondContact NH2-O 3.49Å; R468-A541 PolarHBondContact NH1-O 2.93Å; R468-A541 PolarHBondContact NH2-O 2.95Å; R468-G543 WeakPolarHBondContact CD-O 3.4Å; R468-G543 PolarHBondContact NH1-O 3.38Å; R468-R544 PolarHBondContact N-O 2.83Å
469	S	91	Very high	93.1	Very high	90 Å²	90	45 Å²	45	63%	0.629	25%	0.253	S	S	*	.	S	Bend	trans	-75.8	-37.2	174.1	-38.7	0	0	0	0	111	E473	S469-E473 VanDerWaalsContact CB-OE2 3.29Å; S469-E473 WeakPolarHBondContact CB-OE2 3.43Å; S469-E473 PolarHBondContact N-OE2 3.15Å; S469-E473 PolarHBondContact OG-OE2 2.81Å
470	H	90	Very high	93	Very high	113 Å²	113	48.2 Å²	48.2	52%	0.523	26%	0.26	S	S	.	.	S	Bend	trans	-142.7	156.7	178.2	57.5	-90.3	0	0	0	111	R468 G472 E473	R468-H470 WeakPolarHBondContact CB-O 3.43Å; H470-G472 PolarHBondContact O-N 3.46Å; H470-E473 WeakPolarHBondContact O-CB 3.43Å; H470-E473 PolarHBondContact O-N 2.69Å
471	D	86.7	Confident	92.7	Very high	81 Å²	81	54 Å²	54	43%	0.433	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	134	176.2	-72.7	-61.3	0	0	0	111	I542 G543 R544	D471-I542 HydrophobicContact CB-CG2 4.16Å; D471-G543 WeakPolarHBondContact OD1-CA 3.46Å; D471-G543 PolarHBondContact OD1-N 3.01Å; D471-R544 PolarHBondContact OD1-N 3.31Å
472	G	84.7	Confident	92.2	Very high	47 Å²	47	54.6 Å²	54.6	49%	0.485	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	-4.3	-174.5	0	0	0	0	0	115.7	H470 C474	H470-G472 PolarHBondContact O-N 3.46Å; G472-C474 PolarHBondContact O-N 2.7Å; G472-C474 VanDerWaalsContact O-N 3.14Å
473	E	91.4	Very high	92	Very high	27 Å²	27	54.3 Å²	54.3	13%	0.126	29%	0.29	C	S	.	.			trans	-54	122.3	176.2	-171.9	-175.4	164.3	0	0	110.8	R468 S469 H470 V475 L494 R497	R468-E473 WeakPolarHBondContact CA-OE2 3.17Å; R468-E473 HydrophobicContact CB-CB 4Å; R468-E473 WeakPolarHBondContact CD-O 3.44Å; R468-E473 HydrophobicContact CG-CB 3.98Å; R468-E473 PolarHBondContact NE-O 2.69Å; S469-E473 VanDerWaalsContact CB-OE2 3.29Å; S469-E473 WeakPolarHBondContact CB-OE2 3.43Å; S469-E473 PolarHBondContact N-OE2 3.15Å; S469-E473 PolarHBondContact OG-OE2 2.81Å; H470-E473 WeakPolarHBondContact O-CB 3.43Å; H470-E473 PolarHBondContact O-N 2.69Å; E473-V475 PolarHBondContact O-N 3.47Å; E473-L494 HydrophobicContact CB-CD1 4.43Å; E473-L494 HydrophobicContact CG-CD1 3.99Å; E473-L494 WeakPolarHBondContact OE1-CG 3.21Å; E473-R497 IonicContact OE1-NH2 2.64Å; E473-R497 PolarHBondContact OE1-NH2 2.94Å
474	C	91.5	Very high	92	Very high	67 Å²	67	53.8 Å²	53.8	45%	0.453	29%	0.286	S	S	.	.			trans	-69.4	121.4	-177.2	179.5	0	0	0	0	111.1	G472 G476	G472-C474 PolarHBondContact O-N 2.7Å; G472-C474 VanDerWaalsContact O-N 3.14Å; C474-G476 PolarHBondContact O-N 3.29Å; C474-G476 VanDerWaalsContact O-N 3.12Å
475	V	95	Very high	91.9	Very high	4 Å²	4	53 Å²	53	2%	0.024	28%	0.283	C	S	.	.			trans	-55.8	-30.7	179.5	-170.1	0	0	0	0	112.3	F466 E473 L477 S493 L494 A495 L546	F466-V475 HydrophobicContact CD1-CG1 4.37Å; F466-V475 HydrophobicContact CD2-CG1 3.48Å; F466-V475 VanDerWaalsContact CD2-CG1 3.48Å; F466-V475 HydrophobicContact CE2-CG1 3.6Å; F466-V475 HydrophobicContact CG-CG1 3.87Å; F466-V475 HydrophobicContact CZ-CG1 4.13Å; E473-V475 PolarHBondContact O-N 3.47Å; V475-L477 HydrophobicContact CG1-CD1 4.25Å; V475-L477 HydrophobicContact CG1-CG 4.15Å; V475-S493 WeakPolarHBondContact O-CB 3.42Å; V475-S493 PolarHBondContact O-OG 3.03Å; V475-L494 PolarHBondContact O-N 3.14Å; V475-A495 HydrophobicContact CG1-CB 4.26Å; V475-A495 WeakPolarHBondContact O-CB 3.43Å; V475-A495 PolarHBondContact O-N 2.98Å; V475-L546 HydrophobicContact CG1-CD2 4.47Å; V475-L546 HydrophobicContact CG2-CD2 3.32Å
476	G	94.6	Very high	92	Very high	3 Å²	3	51.8 Å²	51.8	3%	0.031	28%	0.276	C	S	.	.			trans	91.4	12.4	-179.8	0	0	0	0	0	115.5	C474 V489 R490	C474-G476 PolarHBondContact O-N 3.29Å; C474-G476 VanDerWaalsContact O-N 3.12Å; G476-V489 CarbonylContact O-C 3.59Å; G476-V489 WeakPolarHBondContact O-CA 3.35Å; G476-R490 PolarHBondContact O-N 2.86Å
477	L	95.5	Very high	92	Very high	20 Å²	20	56.3 Å²	56.3	11%	0.105	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	133.1	172	-59.7	178.2	0	0	0	110.4	V475 V486 V489 A495 F500 L539 I548	V475-L477 HydrophobicContact CG1-CD1 4.25Å; V475-L477 HydrophobicContact CG1-CG 4.15Å; L477-V486 HydrophobicContact CD2-CG1 4.35Å; L477-V489 HydrophobicContact CD2-CG2 3.8Å; L477-A495 HydrophobicContact CD2-CB 3.5Å; L477-A495 HydrophobicContact CG-CB 3.94Å; L477-F500 HydrophobicContact CD2-CD1 3.91Å; L477-F500 HydrophobicContact CD2-CE1 4Å; L477-F500 HydrophobicContact CD2-CG 4.38Å; L477-L539 HydrophobicContact CB-CD1 4.47Å; L477-I548 HydrophobicContact CD1-CD1 3.75Å
478	T	93.6	Very high	92	Very high	65 Å²	65	53.4 Å²	53.4	40%	0.399	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	145.2	167.5	66.5	0	0	0	0	110.7	E487 A488	T478-E487 PolarHBondContact O-N 3.15Å; T478-A488 PolarHBondContact N-O 3.2Å; T478-A488 WeakPolarHBondContact OG1-CA 2.95Å; T478-A488 WeakPolarHBondContact OG1-CB 3.42Å; T478-A488 PolarHBondContact OG1-N 3.28Å; T478-A488 PolarHBondContact OG1-O 3.04Å
479	T	93.9	Very high	92.2	Very high	24 Å²	24	53.5 Å²	53.5	15%	0.147	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	124	-170.2	56.1	0	0	0	0	111.5	K481 K483 E485 L539	T479-K481 PolarHBondContact O-N 3.23Å; T479-K483 WeakPolarHBondContact CB-O 3.23Å; T479-E485 CarbonylContact C-O 3.57Å; T479-E485 WeakPolarHBondContact CA-O 3.28Å; T479-L539 HydrophobicContact CG2-CD1 4.25Å
480	R	91.3	Very high	92.4	Very high	102 Å²	102	56.1 Å²	56.1	39%	0.385	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-64	113.3	-169.9	-167.4	173.7	-175.2	-142.6	2.6	113.4	G482 K483 E485 E487	R480-G482 PolarHBondContact O-N 3.43Å; R480-G482 VanDerWaalsContact O-N 3.12Å; R480-K483 WeakPolarHBondContact O-CB 3.23Å; R480-K483 PolarHBondContact O-N 2.97Å; R480-E485 HydrophobicContact CB-CB 4.12Å; R480-E485 HydrophobicContact CB-CG 4.31Å; R480-E485 PolarHBondContact N-O 3.19Å; R480-E485 IonicContact NH1-OE1 2.82Å; R480-E485 PolarHBondContact NH1-OE1 3.31Å; R480-E485 IonicContact NH1-OE2 3.63Å; R480-E487 WeakPolarHBondContact CA-OE2 3.43Å; R480-E487 HydrophobicContact CB-CB 4.09Å
481	K	87.3	Confident	92.6	Very high	183 Å²	183	57.9 Å²	57.9	80%	0.796	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	45.3	44.1	174.4	-59	-170.5	177.4	-170.9	0	113.4	T479 K483	T479-K481 PolarHBondContact O-N 3.23Å; K481-K483 VanDerWaalsContact C-N 3.27Å; K481-K483 PolarHBondContact O-N 3.01Å
482	G	84	Confident	93	Very high	23 Å²	23	56.2 Å²	56.2	24%	0.237	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	75.7	1.8	177.7	0	0	0	0	0	116.4	R480 G533	R480-G482 PolarHBondContact O-N 3.43Å; R480-G482 VanDerWaalsContact O-N 3.12Å; G482-G533 PolarHBondContact O-N 2.82Å
483	K	92.3	Very high	93.5	Very high	98 Å²	98	54.3 Å²	54.3	43%	0.426	28%	0.282	S	S	.	.	S	Bend	trans	-89.9	161.2	172.5	-54.9	172	-175.2	171.1	0	110.3	T479 R480 K481 E485	T479-K483 WeakPolarHBondContact CB-O 3.23Å; R480-K483 WeakPolarHBondContact O-CB 3.23Å; R480-K483 PolarHBondContact O-N 2.97Å; K481-K483 VanDerWaalsContact C-N 3.27Å; K481-K483 PolarHBondContact O-N 3.01Å; K483-E485 PolarHBondContact O-N 3.16Å
484	N	94.8	Very high	93.7	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	28%	0.279	C	S	.	.	S	Bend	trans	-78.9	16.6	-179.2	-39.1	-26.1	0	0	0	114.1	Y517 V518 V526 S527 S530 C535	N484-Y517 HydrophobicContact CB-CD1 4.23Å; N484-Y517 HydrophobicContact CB-CE1 3.65Å; N484-Y517 HydrophobicContact CB-CE2 4.35Å; N484-Y517 PolarHBondContact N-OH 3.22Å; N484-Y517 CarbonylContact O-C 3.55Å; N484-Y517 WeakPolarHBondContact O-CA 3.46Å; N484-V518 HydrophobicContact CB-CB 4.19Å; N484-V518 VanDerWaalsContact CB-O 3.3Å; N484-V518 WeakPolarHBondContact CB-O 3.45Å; N484-V518 PolarHBondContact O-N 2.69Å; N484-V526 WeakPolarHBondContact ND2-CG1 3.24Å; N484-S527 PolarHBondContact ND2-O 2.97Å; N484-S530 VanDerWaalsContact CG-OG 3.28Å; N484-S530 PolarHBondContact ND2-OG 2.96Å; N484-S530 VanDerWaalsContact ND2-OG 3.11Å; N484-S530 PolarHBondContact OD1-OG 2.83Å; N484-C535 HydrophobicContact CB-CB 3.96Å; N484-C535 WeakPolarHBondContact OD1-CB 3.42Å
485	E	95.8	Very high	93.9	Very high	15 Å²	15	50.5 Å²	50.5	7%	0.07	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-80.9	123.1	175.1	-178.4	174.3	-173.8	0	0	108.1	T479 R480 K483 Y517 T553 K557	T479-E485 CarbonylContact C-O 3.57Å; T479-E485 WeakPolarHBondContact CA-O 3.28Å; R480-E485 HydrophobicContact CB-CB 4.12Å; R480-E485 HydrophobicContact CB-CG 4.31Å; R480-E485 PolarHBondContact N-O 3.19Å; R480-E485 IonicContact NH1-OE1 2.82Å; R480-E485 PolarHBondContact NH1-OE1 3.31Å; R480-E485 IonicContact NH1-OE2 3.63Å; K483-E485 PolarHBondContact O-N 3.16Å; E485-Y517 HydrophobicContact CB-CD2 3.75Å; E485-Y517 HydrophobicContact CB-CE2 3.82Å; E485-Y517 HydrophobicContact CG-CD2 4.5Å; E485-T553 HydrophobicContact CG-CG2 4.04Å; E485-K557 IonicContact OE1-NZ 3.93Å
486	V	96.1	Very high	94	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	126.5	179	-177.6	0	0	0	0	109	L477 V489 F500 W516 V518	L477-V486 HydrophobicContact CD2-CG1 4.35Å; V486-V489 HydrophobicContact CG1-CG2 4.39Å; V486-F500 HydrophobicContact CG1-CE1 4.18Å; V486-F500 HydrophobicContact CG2-CZ 4.31Å; V486-W516 HydrophobicContact CB-CB 4.33Å; V486-W516 HydrophobicContact CG2-CB 4.1Å; V486-W516 PolarHBondContact N-O 2.89Å; V486-V518 HydrophobicContact CG2-CG2 4.07Å
487	E	95	Very high	94	Very high	99 Å²	99	62 Å²	62	46%	0.463	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-48.2	-175.7	-175.3	159.6	-132.6	0	0	111.5	T478 R480 V502	T478-E487 PolarHBondContact O-N 3.15Å; R480-E487 WeakPolarHBondContact CA-OE2 3.43Å; R480-E487 HydrophobicContact CB-CB 4.09Å; E487-V502 WeakPolarHBondContact O-CG1 3.42Å
488	A	95.2	Very high	93.9	Very high	43 Å²	43	63.1 Å²	63.1	36%	0.355	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	161.6	174.6	0	0	0	0	0	111.8	T478	T478-A488 PolarHBondContact N-O 3.2Å; T478-A488 WeakPolarHBondContact OG1-CA 2.95Å; T478-A488 WeakPolarHBondContact OG1-CB 3.42Å; T478-A488 PolarHBondContact OG1-N 3.28Å; T478-A488 PolarHBondContact OG1-O 3.04Å
489	V	96.3	Very high	93.8	Very high	17 Å²	17	62.2 Å²	62.2	10%	0.103	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	119	172.2	176.9	0	0	0	0	106.3	G476 L477 V486 E491 A495 W496 F500 V502	G476-V489 CarbonylContact O-C 3.59Å; G476-V489 WeakPolarHBondContact O-CA 3.35Å; L477-V489 HydrophobicContact CD2-CG2 3.8Å; V486-V489 HydrophobicContact CG1-CG2 4.39Å; V489-E491 PolarHBondContact O-N 3.28Å; V489-A495 HydrophobicContact CG1-CB 3.92Å; V489-W496 HydrophobicContact CG1-CB 4.16Å; V489-W496 HydrophobicContact CG1-CE3 4.24Å; V489-F500 HydrophobicContact CG2-CD1 3.59Å; V489-F500 HydrophobicContact CG2-CE1 4.01Å; V489-V502 HydrophobicContact CB-CG2 4Å; V489-V502 HydrophobicContact CG2-CG2 3.57Å
490	R	96	Very high	93.9	Very high	146 Å²	146	61 Å²	61	55%	0.551	31%	0.308	S	S	*	.			trans	-67.4	129.6	178.1	-176.1	175.1	65.5	-176.5	1.3	109.9	G476 S493 W496	G476-R490 PolarHBondContact O-N 2.86Å; R490-S493 WeakPolarHBondContact O-CB 3.31Å; R490-S493 PolarHBondContact O-N 2.97Å; R490-S493 PolarHBondContact O-OG 3.39Å; R490-W496 WeakPolarHBondContact O-CB 3.34Å
491	E	94.9	Very high	94	Very high	149 Å²	149	61.5 Å²	61.5	70%	0.696	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	150.5	176.3	-62.1	-175.9	176.2	0	0	111.8	V489 S493 W496	V489-E491 PolarHBondContact O-N 3.28Å; E491-S493 PolarHBondContact O-N 3.12Å; E491-W496 HydrophobicContact CB-CD2 4.46Å; E491-W496 HydrophobicContact CG-CD2 4.37Å; E491-W496 HydrophobicContact CG-CE3 4.21Å; E491-W496 HydrophobicContact CG-CH2 4.14Å; E491-W496 HydrophobicContact CG-CZ2 4.32Å; E491-W496 HydrophobicContact CG-CZ3 4.09Å
492	G	93.6	Very high	94.3	Very high	47 Å²	47	54.5 Å²	54.5	49%	0.485	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	-9.5	-176.3	0	0	0	0	0	116.2	W496 R497	G492-W496 VanDerWaalsContact N-CD1 3.34Å; G492-R497 PolarHBondContact O-NE 2.76Å
493	S	95.8	Very high	94.8	Very high	7 Å²	7	59.3 Å²	59.3	5%	0.049	30%	0.297	C	S	.	.	S	Bend	trans	-67.7	170.7	179.6	71.7	0	0	0	0	114	V475 R490 E491 A495 W496 R497	V475-S493 WeakPolarHBondContact O-CB 3.42Å; V475-S493 PolarHBondContact O-OG 3.03Å; R490-S493 WeakPolarHBondContact O-CB 3.31Å; R490-S493 PolarHBondContact O-N 2.97Å; R490-S493 PolarHBondContact O-OG 3.39Å; E491-S493 PolarHBondContact O-N 3.12Å; S493-A495 VanDerWaalsContact C-N 3.31Å; S493-A495 PolarHBondContact O-N 2.81Å; S493-W496 PolarHBondContact O-N 2.81Å; S493-W496 PolarHBondContact OG-N 3.34Å; S493-R497 WeakPolarHBondContact O-CB 3.39Å; S493-R497 WeakPolarHBondContact O-CG 3.44Å; S493-R497 PolarHBondContact O-N 2.84Å
494	L	95.3	Very high	94.9	Very high	13 Å²	13	55.7 Å²	55.7	7%	0.068	28%	0.283	C	S	.	.	H	α-helix	trans	-56	-43.3	174.1	-71.1	168.3	0	0	0	112.7	F466 K467 R468 E473 V475 R497 A498	F466-L494 HydrophobicContact CB-CB 4.32Å; K467-L494 WeakPolarHBondContact O-CD2 3.3Å; R468-L494 HydrophobicContact CB-CD1 4.34Å; R468-L494 HydrophobicContact CG-CD1 3.71Å; E473-L494 HydrophobicContact CB-CD1 4.43Å; E473-L494 HydrophobicContact CG-CD1 3.99Å; E473-L494 WeakPolarHBondContact OE1-CG 3.21Å; V475-L494 PolarHBondContact O-N 3.14Å; L494-R497 VanDerWaalsContact CD2-NH2 3.28Å; L494-A498 VanDerWaalsContact O-CB 3.24Å; L494-A498 WeakPolarHBondContact O-CB 3.38Å; L494-A498 PolarHBondContact O-N 3.44Å
495	A	96.6	Very high	94.8	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61.8	-47	174.8	0	0	0	0	0	111.8	F466 V475 L477 V489 S493 R497 A498 G499 F500	F466-A495 HydrophobicContact CE1-CB 4.19Å; F466-A495 HydrophobicContact CZ-CB 4.35Å; V475-A495 HydrophobicContact CG1-CB 4.26Å; V475-A495 WeakPolarHBondContact O-CB 3.43Å; V475-A495 PolarHBondContact O-N 2.98Å; L477-A495 HydrophobicContact CD2-CB 3.5Å; L477-A495 HydrophobicContact CG-CB 3.94Å; V489-A495 HydrophobicContact CG1-CB 3.92Å; S493-A495 VanDerWaalsContact C-N 3.31Å; S493-A495 PolarHBondContact O-N 2.81Å; A495-R497 PolarHBondContact O-N 3.03Å; A495-A498 PolarHBondContact O-N 3.34Å; A495-G499 PolarHBondContact O-N 2.86Å; A495-F500 HydrophobicContact CB-CB 4.09Å; A495-F500 WeakPolarHBondContact O-CB 3.36Å; A495-F500 PolarHBondContact O-N 3.34Å
496	W	95.9	Very high	94.5	Very high	90 Å²	90	60.5 Å²	60.5	34%	0.341	31%	0.308	S	S	.	.	H	α-helix	trans	-60.6	-46.8	179.2	-178.1	-93.3	0	0	0	112.6	V489 R490 E491 G492 S493 A498 G499 R501	V489-W496 HydrophobicContact CG1-CB 4.16Å; V489-W496 HydrophobicContact CG1-CE3 4.24Å; R490-W496 WeakPolarHBondContact O-CB 3.34Å; E491-W496 HydrophobicContact CB-CD2 4.46Å; E491-W496 HydrophobicContact CG-CD2 4.37Å; E491-W496 HydrophobicContact CG-CE3 4.21Å; E491-W496 HydrophobicContact CG-CH2 4.14Å; E491-W496 HydrophobicContact CG-CZ2 4.32Å; E491-W496 HydrophobicContact CG-CZ3 4.09Å; G492-W496 VanDerWaalsContact N-CD1 3.34Å; S493-W496 PolarHBondContact O-N 2.81Å; S493-W496 PolarHBondContact OG-N 3.34Å; W496-A498 VanDerWaalsContact C-N 3.34Å; W496-G499 PolarHBondContact O-N 3.18Å; W496-G499 VanDerWaalsContact O-N 3.12Å; W496-R501 PolarHBondContact O-NH1 2.9Å
497	R	94.5	Very high	93.9	Very high	158 Å²	158	62.9 Å²	62.9	60%	0.596	33%	0.325	S	S	*	.	H	α-helix	trans	-65.4	-33.3	178.1	-69.4	-174.5	-63.4	-156.1	1	112.5	E473 G492 S493 L494 A495 G499	E473-R497 IonicContact OE1-NH2 2.64Å; E473-R497 PolarHBondContact OE1-NH2 2.94Å; G492-R497 PolarHBondContact O-NE 2.76Å; S493-R497 WeakPolarHBondContact O-CB 3.39Å; S493-R497 WeakPolarHBondContact O-CG 3.44Å; S493-R497 PolarHBondContact O-N 2.84Å; L494-R497 VanDerWaalsContact CD2-NH2 3.28Å; A495-R497 PolarHBondContact O-N 3.03Å; R497-G499 PolarHBondContact O-N 2.55Å
498	A	93	Very high	93.4	Very high	45 Å²	45	61 Å²	61	37%	0.372	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	9.3	173.2	0	0	0	0	0	114	F466 L494 A495 W496 F500	F466-A498 HydrophobicContact CD1-CB 3.82Å; F466-A498 HydrophobicContact CE1-CB 3.78Å; L494-A498 VanDerWaalsContact O-CB 3.24Å; L494-A498 WeakPolarHBondContact O-CB 3.38Å; L494-A498 PolarHBondContact O-N 3.44Å; A495-A498 PolarHBondContact O-N 3.34Å; W496-A498 VanDerWaalsContact C-N 3.34Å; A498-F500 VanDerWaalsContact C-N 3.28Å; A498-F500 PolarHBondContact O-N 2.7Å
499	G	92.4	Very high	93	Very high	45 Å²	45	62.2 Å²	62.2	46%	0.464	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	9.5	179.8	0	0	0	0	0	114.7	A495 W496 R497	A495-G499 PolarHBondContact O-N 2.86Å; W496-G499 PolarHBondContact O-N 3.18Å; W496-G499 VanDerWaalsContact O-N 3.12Å; R497-G499 PolarHBondContact O-N 2.55Å
500	F	95.1	Very high	92.4	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.341	C	S	.	.			trans	-68.1	135	175.7	-162.6	-74.9	0	0	0	109.9	F464 F466 L477 V486 V489 A495 A498 W516 I548 V550	F464-F500 HydrophobicContact CD1-CB 4.45Å; F464-F500 AromaticContact CD1-CD2 3.94Å; F464-F500 HydrophobicContact CD1-CD2 3.94Å; F464-F500 AromaticContact CD2-CD2 3.58Å; F464-F500 HydrophobicContact CD2-CD2 3.58Å; F464-F500 AromaticContact CD2-CE2 3.76Å; F464-F500 HydrophobicContact CD2-CE2 3.76Å; F464-F500 HydrophobicContact CE1-CB 4.15Å; F464-F500 AromaticContact CE1-CD2 3.81Å; F464-F500 HydrophobicContact CE1-CD2 3.81Å; F464-F500 HydrophobicContact CE1-CG 4.39Å; F464-F500 AromaticContact CE2-CD2 3.43Å; F464-F500 HydrophobicContact CE2-CD2 3.43Å; F464-F500 VanDerWaalsContact CE2-CD2 3.43Å; F464-F500 AromaticContact CE2-CE2 3.57Å; F464-F500 HydrophobicContact CE2-CE2 3.57Å; F464-F500 AromaticContact CG-CD2 3.83Å; F464-F500 HydrophobicContact CG-CD2 3.83Å; F464-F500 HydrophobicContact CG-CE2 4.42Å; F464-F500 AromaticContact CZ-CD2 3.55Å; F464-F500 HydrophobicContact CZ-CD2 3.55Å; F464-F500 HydrophobicContact CZ-CE2 4.11Å; F464-F500 HydrophobicContact CZ-CG 4.3Å; F466-F500 HydrophobicContact CZ-CD2 4.48Å; L477-F500 HydrophobicContact CD2-CD1 3.91Å; L477-F500 HydrophobicContact CD2-CE1 4Å; L477-F500 HydrophobicContact CD2-CG 4.38Å; V486-F500 HydrophobicContact CG1-CE1 4.18Å; V486-F500 HydrophobicContact CG2-CZ 4.31Å; V489-F500 HydrophobicContact CG2-CD1 3.59Å; V489-F500 HydrophobicContact CG2-CE1 4.01Å; A495-F500 HydrophobicContact CB-CB 4.09Å; A495-F500 WeakPolarHBondContact O-CB 3.36Å; A495-F500 PolarHBondContact O-N 3.34Å; A498-F500 VanDerWaalsContact C-N 3.28Å; A498-F500 PolarHBondContact O-N 2.7Å; F500-W516 HydrophobicContact CE1-CB 4.45Å; F500-W516 AromaticContact CE1-CD1 3.76Å; F500-W516 HydrophobicContact CE1-CG 4.29Å; F500-W516 HydrophobicContact CZ-CB 3.85Å; F500-W516 AromaticContact CZ-CD1 3.65Å; F500-W516 AromaticContact CZ-CG 3.77Å; F500-W516 HydrophobicContact CZ-CG 3.77Å; F500-I548 HydrophobicContact CD2-CD1 4.45Å; F500-I548 HydrophobicContact CE2-CD1 3.99Å; F500-V550 HydrophobicContact CE2-CB 4.48Å; F500-V550 HydrophobicContact CE2-CG1 3.9Å; F500-V550 HydrophobicContact CE2-CG2 3.87Å; F500-V550 HydrophobicContact CZ-CG1 4.08Å; F500-V550 HydrophobicContact CZ-CG2 4.32Å
501	R	94.4	Very high	92	Very high	111 Å²	111	66.3 Å²	66.3	42%	0.419	36%	0.355	S	S	.	.			trans	-130.4	146.7	175.7	-60.6	-63.3	177.5	-98.8	5.9	109	W496 K503 W516	W496-R501 PolarHBondContact O-NH1 2.9Å; R501-K503 PolarHBondContact O-N 3.2Å; R501-W516 PolarHBondContact O-NE1 3.31Å; R501-W516 VanDerWaalsContact O-NE1 3.17Å
502	V	94.3	Very high	91.8	Very high	37 Å²	37	64.4 Å²	64.4	22%	0.224	35%	0.348	C	S	.	.	S	Bend	trans	-61.1	-45.1	-174.8	179	0	0	0	0	111.7	E487 V489 T515 W516	E487-V502 WeakPolarHBondContact O-CG1 3.42Å; V489-V502 HydrophobicContact CB-CG2 4Å; V489-V502 HydrophobicContact CG2-CG2 3.57Å; V502-T515 HydrophobicContact CG1-CG2 4.22Å; V502-T515 WeakPolarHBondContact O-CA 3.25Å; V502-W516 PolarHBondContact O-N 3.26Å
503	K	94	Very high	91.8	Very high	124 Å²	124	68.3 Å²	68.3	54%	0.539	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	153.8	-176.5	-62.1	-170.4	175.3	-173.7	0	112	R501 E513 T514	R501-K503 PolarHBondContact O-N 3.2Å; K503-E513 HydrophobicContact CD-CB 4.47Å; K503-E513 WeakPolarHBondContact CD-OE1 3.15Å; K503-E513 VanDerWaalsContact CD-OE2 3.27Å; K503-E513 WeakPolarHBondContact CD-OE2 3.32Å; K503-E513 WeakPolarHBondContact CE-OE2 3.43Å; K503-E513 IonicContact NZ-OE1 3.4Å; K503-E513 IonicContact NZ-OE2 2.69Å; K503-E513 PolarHBondContact NZ-OE2 3.26Å; K503-T514 CarbonylContact C-O 3.59Å; K503-T514 WeakPolarHBondContact CA-O 3.18Å
504	T	94.1	Very high	91.8	Very high	22 Å²	22	68.9 Å²	68.9	14%	0.135	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	163.2	167.4	-173.8	0	0	0	0	109.2	E513 T514 W516 P552	T504-E513 CarbonylContact O-C 3.58Å; T504-E513 WeakPolarHBondContact O-CA 3.48Å; T504-T514 HydrophobicContact CG2-CG2 3.55Å; T504-T514 PolarHBondContact N-O 3.26Å; T504-T514 PolarHBondContact O-N 3.36Å; T504-W516 HydrophobicContact CG2-CD2 3.99Å; T504-W516 HydrophobicContact CG2-CE3 4.29Å; T504-W516 HydrophobicContact CG2-CH2 3.86Å; T504-W516 HydrophobicContact CG2-CZ2 3.54Å; T504-W516 HydrophobicContact CG2-CZ3 4.24Å; T504-W516 WeakPolarHBondContact OG1-CZ2 3.38Å; T504-P552 HydrophobicContact CG2-CG 4.46Å
505	I	92.5	Very high	91.8	Very high	110 Å²	110	70 Å²	70	56%	0.564	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.3	140.5	166.4	-62	166.9	0	0	0	108.7	P510	I505-P510 HydrophobicContact CG2-CB 4.43Å; I505-P510 VanDerWaalsContact CG2-O 3.27Å; I505-P510 WeakPolarHBondContact CG2-O 3.36Å
506	S	89.6	Confident	91.8	Very high	6 Å²	6	70.4 Å²	70.4	4%	0.042	37%	0.366	C	S	.	.			trans	-70.7	134.1	173.4	160.9	0	0	0	0	111.4	I508 N509 M512 D554	S506-I508 PolarHBondContact O-N 3.2Å; S506-I508 PolarHBondContact OG-N 3.16Å; S506-I508 VanDerWaalsContact OG-N 3.11Å; S506-N509 VanDerWaalsContact CB-O 3.31Å; S506-N509 WeakPolarHBondContact CB-O 3.22Å; S506-N509 PolarHBondContact OG-N 3.11Å; S506-M512 WeakPolarHBondContact CB-O 3.27Å; S506-M512 PolarHBondContact N-O 2.76Å; S506-D554 WeakPolarHBondContact CB-OD2 3.2Å; S506-D554 PolarHBondContact OG-OD2 3.46Å
507	S	82.7	Confident	91.9	Very high	51 Å²	51	66.5 Å²	66.5	36%	0.357	35%	0.351	S	S	.	.	S	Bend	trans	-72.5	-11.4	174.7	-65.4	0	0	0	0	114.1	M460	M460-S507 WeakPolarHBondContact SD-CB 3.35Å; M460-S507 PolarHBondContact SD-OG 3.36Å
508	I	85.2	Confident	92	Very high	61 Å²	61	59 Å²	59	31%	0.313	32%	0.322	S	S	.	.	S	Bend	trans	-105.1	-41.3	-177.6	-62	166.3	0	0	0	110.2	S506 F555 L558	S506-I508 PolarHBondContact O-N 3.2Å; S506-I508 PolarHBondContact OG-N 3.16Å; S506-I508 VanDerWaalsContact OG-N 3.11Å; I508-F555 HydrophobicContact CD1-CB 4.23Å; I508-L558 HydrophobicContact CD1-CB 4.27Å; I508-L558 HydrophobicContact CD1-CD2 3.63Å
509	N	86.5	Confident	92.1	Very high	68 Å²	68	56.9 Å²	56.9	36%	0.364	31%	0.305	S	S	.	.			trans	-125	91.4	179.3	-58.8	-39.1	0	0	0	108.2	S506 D511 M512	S506-N509 VanDerWaalsContact CB-O 3.31Å; S506-N509 WeakPolarHBondContact CB-O 3.22Å; S506-N509 PolarHBondContact OG-N 3.11Å; N509-D511 PolarHBondContact O-N 3.03Å; N509-M512 HydrophobicContact CB-CB 4.16Å; N509-M512 HydrophobicContact CB-CE 3.89Å; N509-M512 HydrophobicContact CB-CG 3.82Å; N509-M512 HydrophobicContact CB-SD 3.68Å; N509-M512 PolarHBondContact ND2-SD 3.38Å; N509-M512 VanDerWaalsContact ND2-SD 3.42Å; N509-M512 PolarHBondContact O-N 2.89Å
510	P	84.2	Confident	92.3	Very high	91 Å²	91	55 Å²	55	59%	0.591	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-20.6	-172.8	24.5	-34.5	0	0	0	113.9	I505 M512	I505-P510 HydrophobicContact CG2-CB 4.43Å; I505-P510 VanDerWaalsContact CG2-O 3.27Å; I505-P510 WeakPolarHBondContact CG2-O 3.36Å; P510-M512 PolarHBondContact O-N 2.73Å
511	D	88	Confident	92.3	Very high	158 Å²	158	55.2 Å²	55.2	85%	0.845	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-2.7	175.6	-46.1	-56.2	0	0	0	113.7	N509	N509-D511 PolarHBondContact O-N 3.03Å
512	M	90.4	Very high	92.3	Very high	109 Å²	109	51.6 Å²	51.6	54%	0.537	27%	0.274	S	S	.	.	S	Bend	trans	-116.7	136.4	-175.7	-58.4	-176.3	-164.8	0	0	112.5	S506 N509 P510	S506-M512 WeakPolarHBondContact CB-O 3.27Å; S506-M512 PolarHBondContact N-O 2.76Å; N509-M512 HydrophobicContact CB-CB 4.16Å; N509-M512 HydrophobicContact CB-CE 3.89Å; N509-M512 HydrophobicContact CB-CG 3.82Å; N509-M512 HydrophobicContact CB-SD 3.68Å; N509-M512 PolarHBondContact ND2-SD 3.38Å; N509-M512 VanDerWaalsContact ND2-SD 3.42Å; N509-M512 PolarHBondContact O-N 2.89Å; P510-M512 PolarHBondContact O-N 2.73Å
513	E	93.2	Very high	92.1	Very high	128 Å²	128	52.4 Å²	52.4	60%	0.598	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	146.1	165.3	-63.4	-171.7	120.6	0	0	111.7	K503 T504	K503-E513 HydrophobicContact CD-CB 4.47Å; K503-E513 WeakPolarHBondContact CD-OE1 3.15Å; K503-E513 VanDerWaalsContact CD-OE2 3.27Å; K503-E513 WeakPolarHBondContact CD-OE2 3.32Å; K503-E513 WeakPolarHBondContact CE-OE2 3.43Å; K503-E513 IonicContact NZ-OE1 3.4Å; K503-E513 IonicContact NZ-OE2 2.69Å; K503-E513 PolarHBondContact NZ-OE2 3.26Å; T504-E513 CarbonylContact O-C 3.58Å; T504-E513 WeakPolarHBondContact O-CA 3.48Å
514	T	95	Very high	92	Very high	20 Å²	20	53.6 Å²	53.6	12%	0.123	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	166	179.6	-171.2	0	0	0	0	109.7	K503 T504 P552 D554	K503-T514 CarbonylContact C-O 3.59Å; K503-T514 WeakPolarHBondContact CA-O 3.18Å; T504-T514 HydrophobicContact CG2-CG2 3.55Å; T504-T514 PolarHBondContact N-O 3.26Å; T504-T514 PolarHBondContact O-N 3.36Å; T514-P552 HydrophobicContact CG2-CB 3.88Å; T514-D554 VanDerWaalsContact CB-OD1 3.27Å; T514-D554 WeakPolarHBondContact CB-OD1 3.44Å; T514-D554 WeakPolarHBondContact CG2-OD1 3.2Å; T514-D554 PolarHBondContact OG1-OD1 3.33Å
515	T	96.2	Very high	92	Very high	35 Å²	35	52.8 Å²	52.8	22%	0.215	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	167.8	175.1	59.3	0	0	0	0	111.5	V502 T553	V502-T515 HydrophobicContact CG1-CG2 4.22Å; V502-T515 WeakPolarHBondContact O-CA 3.25Å; T515-T553 VanDerWaalsContact O-CB 3.22Å; T515-T553 WeakPolarHBondContact O-CB 3.35Å; T515-T553 PolarHBondContact O-N 2.85Å; T515-T553 PolarHBondContact O-OG1 2.88Å; T515-T553 WeakPolarHBondContact OG1-CB 3.42Å; T515-T553 PolarHBondContact OG1-OG1 3.44Å
516	W	96.9	Very high	92	Very high	10 Å²	10	47.5 Å²	47.5	4%	0.038	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	146.7	169.5	-68.2	105	0	0	0	112.9	K462 V486 F500 R501 V502 T504 V550 P552 T553	K462-W516 HydrophobicContact CB-CH2 4.28Å; K462-W516 HydrophobicContact CB-CZ3 4.47Å; K462-W516 HydrophobicContact CD-CH2 3.46Å; K462-W516 VanDerWaalsContact CD-CH2 3.46Å; K462-W516 HydrophobicContact CD-CZ2 3.59Å; K462-W516 HydrophobicContact CD-CZ3 4.42Å; K462-W516 HydrophobicContact CG-CH2 3.74Å; K462-W516 HydrophobicContact CG-CZ2 4.33Å; K462-W516 HydrophobicContact CG-CZ3 4.3Å; V486-W516 HydrophobicContact CB-CB 4.33Å; V486-W516 HydrophobicContact CG2-CB 4.1Å; V486-W516 PolarHBondContact N-O 2.89Å; F500-W516 HydrophobicContact CE1-CB 4.45Å; F500-W516 AromaticContact CE1-CD1 3.76Å; F500-W516 HydrophobicContact CE1-CG 4.29Å; F500-W516 HydrophobicContact CZ-CB 3.85Å; F500-W516 AromaticContact CZ-CD1 3.65Å; F500-W516 AromaticContact CZ-CG 3.77Å; F500-W516 HydrophobicContact CZ-CG 3.77Å; R501-W516 PolarHBondContact O-NE1 3.31Å; R501-W516 VanDerWaalsContact O-NE1 3.17Å; V502-W516 PolarHBondContact O-N 3.26Å; T504-W516 HydrophobicContact CG2-CD2 3.99Å; T504-W516 HydrophobicContact CG2-CE3 4.29Å; T504-W516 HydrophobicContact CG2-CH2 3.86Å; T504-W516 HydrophobicContact CG2-CZ2 3.54Å; T504-W516 HydrophobicContact CG2-CZ3 4.24Å; T504-W516 WeakPolarHBondContact OG1-CZ2 3.38Å; W516-V550 HydrophobicContact CB-CB 4.08Å; W516-V550 HydrophobicContact CB-CG1 4.37Å; W516-V550 HydrophobicContact CB-CG2 4.44Å; W516-V550 HydrophobicContact CD2-CB 4.15Å; W516-V550 HydrophobicContact CD2-CG2 3.72Å; W516-V550 HydrophobicContact CE3-CB 3.74Å; W516-V550 HydrophobicContact CE3-CG2 3.45Å; W516-V550 VanDerWaalsContact CE3-CG2 3.45Å; W516-V550 HydrophobicContact CG-CB 4.3Å; W516-V550 HydrophobicContact CG-CG2 4.15Å; W516-V550 HydrophobicContact CZ3-CG2 4.02Å; W516-P552 HydrophobicContact CZ3-CG 4.2Å; W516-T553 PolarHBondContact O-OG1 2.78Å
517	Y	96.8	Very high	92.2	Very high	8 Å²	8	47.8 Å²	47.8	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123	171.4	-158.2	-85.9	0	0	0	109.4	N484 E485 T519 M528 V550 Q551 V556 K560	N484-Y517 HydrophobicContact CB-CD1 4.23Å; N484-Y517 HydrophobicContact CB-CE1 3.65Å; N484-Y517 HydrophobicContact CB-CE2 4.35Å; N484-Y517 PolarHBondContact N-OH 3.22Å; N484-Y517 CarbonylContact O-C 3.55Å; N484-Y517 WeakPolarHBondContact O-CA 3.46Å; E485-Y517 HydrophobicContact CB-CD2 3.75Å; E485-Y517 HydrophobicContact CB-CE2 3.82Å; E485-Y517 HydrophobicContact CG-CD2 4.5Å; Y517-T519 PolarHBondContact O-N 3.29Å; Y517-M528 PolarHBondContact OH-O 3.22Å; Y517-V550 CarbonylContact O-C 3.6Å; Y517-V550 VanDerWaalsContact O-CA 3.3Å; Y517-V550 WeakPolarHBondContact O-CA 3.21Å; Y517-Q551 WeakPolarHBondContact CB-O 3.29Å; Y517-Q551 PolarHBondContact N-O 2.69Å; Y517-Q551 PolarHBondContact O-N 2.86Å; Y517-V556 HydrophobicContact CD1-CB 4.27Å; Y517-V556 HydrophobicContact CD1-CG1 3.61Å; Y517-V556 HydrophobicContact CD1-CG2 4.3Å; Y517-V556 HydrophobicContact CD2-CG1 4.44Å; Y517-V556 HydrophobicContact CE1-CG1 3.95Å; Y517-V556 HydrophobicContact CG-CB 4.16Å; Y517-V556 HydrophobicContact CG-CG1 3.88Å; Y517-V556 HydrophobicContact CG-CG2 4.35Å; Y517-K560 VanDerWaalsContact CE2-NZ 3.35Å; Y517-K560 PolarHBondContact OH-NZ 3.06Å
518	V	97.1	Very high	92.7	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	116.1	177.8	-174.6	0	0	0	0	109	N484 V486 E520 V521 V550	N484-V518 HydrophobicContact CB-CB 4.19Å; N484-V518 VanDerWaalsContact CB-O 3.3Å; N484-V518 WeakPolarHBondContact CB-O 3.45Å; N484-V518 PolarHBondContact O-N 2.69Å; V486-V518 HydrophobicContact CG2-CG2 4.07Å; V518-E520 WeakPolarHBondContact CG1-O 3.48Å; V518-V521 HydrophobicContact CG1-CG2 3.74Å; V518-V550 HydrophobicContact CB-CG1 4.49Å; V518-V550 HydrophobicContact CG2-CG1 3.96Å
519	T	96.4	Very high	93	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-29.8	175.4	50.4	0	0	0	0	111.8	I419 Y517 P525 V526 V549 Q551 V556	I419-T519 HydrophobicContact CG2-CG2 4.46Å; Y517-T519 PolarHBondContact O-N 3.29Å; T519-P525 CarbonylContact O-C 3.59Å; T519-P525 WeakPolarHBondContact O-CA 3.16Å; T519-V526 PolarHBondContact O-N 3.5Å; T519-V549 PolarHBondContact N-O 3.39Å; T519-V549 PolarHBondContact OG1-O 3.2Å; T519-Q551 HydrophobicContact CG2-CB 4.36Å; T519-Q551 HydrophobicContact CG2-CG 4.36Å; T519-V556 HydrophobicContact CG2-CG2 4.18Å
520	E	95.8	Very high	92.8	Very high	7 Å²	7	42.6 Å²	42.6	3%	0.033	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	151	179.1	-42.8	-164.7	165.4	0	0	113.4	H418 V518 R524 I548 V549	H418-E520 IonicContact CD2-OE1 3.35Å; H418-E520 PolarHBondContact CD2-OE1 3.41Å; H418-E520 VanDerWaalsContact CD2-OE1 3.23Å; H418-E520 IonicContact CD2-OE2 3.58Å; H418-E520 IonicContact CG-OE1 3.15Å; V518-E520 WeakPolarHBondContact CG1-O 3.48Å; E520-R524 WeakPolarHBondContact CA-O 3.4Å; E520-I548 WeakPolarHBondContact O-CA 3.29Å; E520-V549 HydrophobicContact CB-CB 3.88Å; E520-V549 HydrophobicContact CB-CG2 3.92Å; E520-V549 HydrophobicContact CG-CB 4.01Å; E520-V549 HydrophobicContact CG-CG2 4.16Å; E520-V549 PolarHBondContact N-O 3.48Å; E520-V549 PolarHBondContact O-N 2.84Å
521	V	95.3	Very high	92.5	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.018	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	127.1	172.3	-177.5	0	0	0	0	108.9	V518 S523 R524 V526 R538 L539 L546 S547 I548	V518-V521 HydrophobicContact CG1-CG2 3.74Å; V521-S523 VanDerWaalsContact C-N 3.33Å; V521-S523 PolarHBondContact O-N 3.23Å; V521-R524 PolarHBondContact N-O 3.44Å; V521-R524 VanDerWaalsContact O-CB 3.3Å; V521-R524 WeakPolarHBondContact O-CB 3.24Å; V521-R524 PolarHBondContact O-N 3.33Å; V521-V526 HydrophobicContact CB-CG2 4.3Å; V521-V526 HydrophobicContact CG2-CG2 3.86Å; V521-R538 HydrophobicContact CB-CB 4.08Å; V521-R538 HydrophobicContact CG1-CB 3.93Å; V521-R538 HydrophobicContact CG2-CB 4.33Å; V521-L539 HydrophobicContact CG2-CD2 4.24Å; V521-L546 HydrophobicContact CG1-CD1 3.57Å; V521-L546 HydrophobicContact CG1-CG 4.45Å; V521-S547 CarbonylContact C-O 3.58Å; V521-S547 WeakPolarHBondContact CA-O 3.34Å; V521-I548 HydrophobicContact CG1-CG2 4.39Å; V521-I548 HydrophobicContact CG2-CG2 4.2Å
522	N	93.6	Very high	92.1	Very high	35 Å²	35	45.7 Å²	45.7	19%	0.187	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	39.3	179.9	-79.3	-15.1	0	0	0	114.8	R361 R524 L546 S547	R361-N522 PolarHBondContact NH1-O 3.12Å; R361-N522 PolarHBondContact NH2-O 3.32Å; N522-R524 PolarHBondContact O-N 3.44Å; N522-L546 WeakPolarHBondContact OD1-CA 3.17Å; N522-S547 WeakPolarHBondContact CA-OG 3.49Å; N522-S547 PolarHBondContact N-O 3.18Å; N522-S547 PolarHBondContact OD1-N 3.29Å
523	S	91.2	Very high	91.9	Very high	54 Å²	54	41.2 Å²	41.2	38%	0.378	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	31.8	-172.8	-39.7	0	0	0	0	112.6	R361 V521	R361-S523 PolarHBondContact NH1-OG 3.11Å; V521-S523 VanDerWaalsContact C-N 3.33Å; V521-S523 PolarHBondContact O-N 3.23Å
524	R	91.9	Very high	91.8	Very high	150 Å²	150	36.9 Å²	36.9	57%	0.566	18%	0.184	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-121.8	117.9	172.1	-50	-163.9	165.5	-172.1	-2.2	108.6	R414 E520 V521 N522	R414-R524 VanDerWaalsContact NH2-CG 3.27Å; E520-R524 WeakPolarHBondContact CA-O 3.4Å; V521-R524 PolarHBondContact N-O 3.44Å; V521-R524 VanDerWaalsContact O-CB 3.3Å; V521-R524 WeakPolarHBondContact O-CB 3.24Å; V521-R524 PolarHBondContact O-N 3.33Å; N522-R524 PolarHBondContact O-N 3.44Å
525	P	93.3	Very high	91.7	Very high	4 Å²	4	36 Å²	36	3%	0.026	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	144.5	174.4	27	-35.5	0	0	0	109.7	W404 I419 T519 R538 V574	W404-P525 HydrophobicContact CH2-CB 4.36Å; W404-P525 HydrophobicContact CH2-CG 4.2Å; W404-P525 HydrophobicContact CZ2-CG 3.96Å; I419-P525 HydrophobicContact CD1-CB 4.26Å; T519-P525 CarbonylContact O-C 3.59Å; T519-P525 WeakPolarHBondContact O-CA 3.16Å; P525-R538 PolarHBondContact O-NH1 2.88Å; P525-V574 HydrophobicContact CB-CB 4.48Å; P525-V574 HydrophobicContact CB-CG1 4.14Å; P525-V574 HydrophobicContact CG-CB 4.33Å; P525-V574 HydrophobicContact CG-CG1 3.48Å; P525-V574 VanDerWaalsContact CG-CG1 3.48Å
526	V	93.6	Very high	91.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.196	C	C	.	.			trans	-111.7	138.4	175.8	-168.6	0	0	0	0	107.8	N484 T519 V521 M528 E534 C535	N484-V526 WeakPolarHBondContact ND2-CG1 3.24Å; T519-V526 PolarHBondContact O-N 3.5Å; V521-V526 HydrophobicContact CB-CG2 4.3Å; V521-V526 HydrophobicContact CG2-CG2 3.86Å; V526-M528 PolarHBondContact O-N 2.86Å; V526-M528 VanDerWaalsContact O-N 3.11Å; V526-E534 HydrophobicContact CG1-CB 4.26Å; V526-E534 HydrophobicContact CG1-CG 3.98Å; V526-C535 HydrophobicContact CG1-CB 4.07Å
527	S	92.9	Very high	91.3	Very high	11 Å²	11	46.4 Å²	46.4	8%	0.077	22%	0.223	C	C	.	.			trans	-58.5	122.7	-173.3	-176.5	0	0	0	0	111.7	N484 F529 S530 E534 I573 V574	N484-S527 PolarHBondContact ND2-O 2.97Å; S527-F529 PolarHBondContact O-N 3.27Å; S527-F529 PolarHBondContact OG-N 2.92Å; S527-S530 VanDerWaalsContact O-CB 3.25Å; S527-S530 WeakPolarHBondContact O-CB 3.13Å; S527-S530 PolarHBondContact O-N 3.12Å; S527-S530 PolarHBondContact O-OG 3.41Å; S527-E534 PolarHBondContact N-OE2 2.94Å; S527-I573 WeakPolarHBondContact OG-CG2 3.48Å; S527-V574 WeakPolarHBondContact CA-O 3.33Å; S527-V574 VanDerWaalsContact CB-O 3.3Å; S527-V574 WeakPolarHBondContact CB-O 3.5Å
528	M	92.7	Very high	91.1	Very high	8 Å²	8	48.6 Å²	48.6	4%	0.039	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-25	172.5	-84.4	-161.4	-63.3	0	0	112.7	C402 I419 Y517 V526 V556 K560 M563	C402-M528 HydrophobicContact CB-CE 4.21Å; C402-M528 WeakPolarHBondContact O-CE 3.14Å; I419-M528 HydrophobicContact CD1-CG 4.44Å; I419-M528 HydrophobicContact CG2-CE 4.07Å; I419-M528 HydrophobicContact CG2-SD 3.92Å; Y517-M528 PolarHBondContact OH-O 3.22Å; V526-M528 PolarHBondContact O-N 2.86Å; V526-M528 VanDerWaalsContact O-N 3.11Å; M528-V556 HydrophobicContact CG-CG1 4.26Å; M528-V556 HydrophobicContact SD-CG1 3.82Å; M528-K560 HydrophobicContact CB-CG 4.34Å; M528-K560 WeakPolarHBondContact O-CE 3.35Å; M528-K560 PolarHBondContact O-NZ 3.42Å; M528-K560 HydrophobicContact SD-CG 4.2Å; M528-M563 HydrophobicContact CE-SD 3.9Å
529	F	91.3	Very high	90.9	Very high	51 Å²	51	49.1 Å²	49.1	22%	0.224	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	9.4	-179	-54.5	-86.2	0	0	0	113.1	S527 K531 K560 M563 K564 I573	S527-F529 PolarHBondContact O-N 3.27Å; S527-F529 PolarHBondContact OG-N 2.92Å; F529-K531 PolarHBondContact O-N 2.92Å; F529-K560 HydrophobicContact CE1-CB 4.07Å; F529-K560 HydrophobicContact CE1-CG 3.91Å; F529-K560 HydrophobicContact CZ-CB 4.2Å; F529-K560 HydrophobicContact CZ-CG 3.92Å; F529-M563 HydrophobicContact CE2-CE 3.77Å; F529-M563 HydrophobicContact CE2-SD 3.49Å; F529-M563 WeakPolarHBondContact CE2-SD 3.33Å; F529-M563 HydrophobicContact CZ-CE 4.44Å; F529-M563 HydrophobicContact CZ-CG 4.37Å; F529-M563 HydrophobicContact CZ-SD 3.77Å; F529-K564 HydrophobicContact CE1-CG 4.28Å; F529-I573 HydrophobicContact CD2-CD1 3.79Å; F529-I573 HydrophobicContact CD2-CG1 3.83Å; F529-I573 HydrophobicContact CD2-CG2 4.2Å; F529-I573 HydrophobicContact CE2-CD1 4.32Å; F529-I573 HydrophobicContact CE2-CG1 4.09Å; F529-I573 HydrophobicContact CG-CD1 4.27Å
530	S	82.3	Confident	90.6	Very high	12 Å²	12	53.3 Å²	53.3	8%	0.084	26%	0.26	C	S	.	.			trans	-56.1	128.5	179.6	62.1	0	0	0	0	111.8	N484 S527	N484-S530 VanDerWaalsContact CG-OG 3.28Å; N484-S530 PolarHBondContact ND2-OG 2.96Å; N484-S530 VanDerWaalsContact ND2-OG 3.11Å; N484-S530 PolarHBondContact OD1-OG 2.83Å; S527-S530 VanDerWaalsContact O-CB 3.25Å; S527-S530 WeakPolarHBondContact O-CB 3.13Å; S527-S530 PolarHBondContact O-N 3.12Å; S527-S530 PolarHBondContact O-OG 3.41Å
531	K	77.7	Confident	90.2	Very high	174 Å²	174	55 Å²	55	76%	0.757	28%	0.275	S	S	*	.			trans	-109.9	-14.7	170.5	-62.6	-179	-178.6	179.3	0	112.8	F529 G533	F529-K531 PolarHBondContact O-N 2.92Å; K531-G533 PolarHBondContact O-N 2.86Å
532	N	79.9	Confident	89.8	Confident	141 Å²	141	61.8 Å²	61.8	75%	0.754	31%	0.31	S	S	*	.	S	Bend	trans	-95.5	18.7	-162.5	-57.9	3.8	0	0	0	113.2	E534	N532-E534 PolarHBondContact O-N 3.32Å
533	G	87.2	Confident	89.5	Confident	14 Å²	14	61.2 Å²	61.2	14%	0.144	31%	0.312	C	S	.	.			trans	65.9	22	-177.7	0	0	0	0	0	114.5	G482 K531 C535 K536 Q537	G482-G533 PolarHBondContact O-N 2.82Å; K531-G533 PolarHBondContact O-N 2.86Å; G533-C535 VanDerWaalsContact C-N 3.32Å; G533-C535 PolarHBondContact O-N 3.42Å; G533-K536 WeakPolarHBondContact O-CA 3.39Å; G533-K536 VanDerWaalsContact O-CB 3.31Å; G533-K536 WeakPolarHBondContact O-CB 3.35Å; G533-K536 PolarHBondContact O-N 3.3Å; G533-Q537 PolarHBondContact O-N 3.42Å
534	E	91	Very high	89.6	Confident	37 Å²	37	66.8 Å²	66.8	17%	0.173	33%	0.325	C	S	.	.	H	α-helix	trans	-52.1	-47.1	-179.6	-176.5	-171.7	-170.7	0	0	112.4	V526 S527 N532 K536 Q537 R538	V526-E534 HydrophobicContact CG1-CB 4.26Å; V526-E534 HydrophobicContact CG1-CG 3.98Å; S527-E534 PolarHBondContact N-OE2 2.94Å; N532-E534 PolarHBondContact O-N 3.32Å; E534-K536 VanDerWaalsContact C-N 3.35Å; E534-K536 PolarHBondContact O-N 2.59Å; E534-Q537 PolarHBondContact O-N 3.27Å; E534-R538 WeakPolarHBondContact O-CG 3.36Å; E534-R538 PolarHBondContact O-N 2.93Å; E534-R538 IonicContact OE1-CZ 2.96Å; E534-R538 IonicContact OE1-NE 3.56Å; E534-R538 PolarHBondContact OE1-NE 3.45Å; E534-R538 IonicContact OE1-NH2 3.42Å; E534-R538 PolarHBondContact OE1-NH2 3.17Å
535	C	92.9	Very high	89.6	Confident	1 Å²	1	62 Å²	62	1%	0.007	31%	0.309	C	S	.	.	H	α-helix	trans	-57.7	-46.7	173.9	-179.8	0	0	0	0	111.5	N484 V526 G533 Q537 R538 L539	N484-C535 HydrophobicContact CB-CB 3.96Å; N484-C535 WeakPolarHBondContact OD1-CB 3.42Å; V526-C535 HydrophobicContact CG1-CB 4.07Å; G533-C535 VanDerWaalsContact C-N 3.32Å; G533-C535 PolarHBondContact O-N 3.42Å; C535-Q537 VanDerWaalsContact C-N 3.32Å; C535-Q537 PolarHBondContact O-N 2.87Å; C535-R538 PolarHBondContact O-N 3.41Å; C535-L539 WeakPolarHBondContact O-CB 3.43Å; C535-L539 VanDerWaalsContact O-CG 3.24Å; C535-L539 WeakPolarHBondContact O-CG 3.47Å; C535-L539 PolarHBondContact O-N 3.38Å
536	K	92.4	Very high	89.7	Confident	133 Å²	133	61.9 Å²	61.9	58%	0.578	31%	0.308	S	S	*	.	H	α-helix	trans	-57.1	-45.4	177.3	-173.6	-177	178.1	-176.1	0	111.3	G533 E534 L539 T540	G533-K536 WeakPolarHBondContact O-CA 3.39Å; G533-K536 VanDerWaalsContact O-CB 3.31Å; G533-K536 WeakPolarHBondContact O-CB 3.35Å; G533-K536 PolarHBondContact O-N 3.3Å; E534-K536 VanDerWaalsContact C-N 3.35Å; E534-K536 PolarHBondContact O-N 2.59Å; K536-L539 PolarHBondContact O-N 3.17Å; K536-T540 PolarHBondContact O-N 3.47Å; K536-T540 PolarHBondContact O-OG1 3.31Å; K536-T540 VanDerWaalsContact O-OG1 3.05Å
537	Q	91.7	Very high	89.8	Confident	132 Å²	132	62.1 Å²	62.1	62%	0.617	31%	0.31	S	S	*	.	H	α-helix	trans	-61.5	-45.1	176.9	-65.3	176.6	12.4	0	0	112	G533 E534 C535 T540 A541	G533-Q537 PolarHBondContact O-N 3.42Å; E534-Q537 PolarHBondContact O-N 3.27Å; C535-Q537 VanDerWaalsContact C-N 3.32Å; C535-Q537 PolarHBondContact O-N 2.87Å; Q537-T540 WeakPolarHBondContact CA-OG1 3.35Å; Q537-T540 CarbonylContact O-C 3.55Å; Q537-T540 PolarHBondContact O-N 2.99Å; Q537-T540 PolarHBondContact O-OG1 2.97Å; Q537-A541 PolarHBondContact O-N 3.04Å; Q537-A541 VanDerWaalsContact O-N 3.09Å
538	R	92.6	Very high	90	Very high	53 Å²	53	61.6 Å²	61.6	20%	0.2	31%	0.306	C	S	.	.	H	α-helix	trans	-66.4	-37.1	176.9	-67.9	-179.1	-175.8	-159.1	2.8	112.6	V521 P525 E534 C535 T540 A541 S575	V521-R538 HydrophobicContact CB-CB 4.08Å; V521-R538 HydrophobicContact CG1-CB 3.93Å; V521-R538 HydrophobicContact CG2-CB 4.33Å; P525-R538 PolarHBondContact O-NH1 2.88Å; E534-R538 WeakPolarHBondContact O-CG 3.36Å; E534-R538 PolarHBondContact O-N 2.93Å; E534-R538 IonicContact OE1-CZ 2.96Å; E534-R538 IonicContact OE1-NE 3.56Å; E534-R538 PolarHBondContact OE1-NE 3.45Å; E534-R538 IonicContact OE1-NH2 3.42Å; E534-R538 PolarHBondContact OE1-NH2 3.17Å; C535-R538 PolarHBondContact O-N 3.41Å; R538-T540 VanDerWaalsContact C-N 3.25Å; R538-T540 PolarHBondContact O-N 3.22Å; R538-A541 VanDerWaalsContact O-CB 3.26Å; R538-A541 WeakPolarHBondContact O-CB 3.49Å; R538-A541 PolarHBondContact O-N 3.49Å; R538-S575 PolarHBondContact NH1-OXT 3.08Å; R538-S575 PolarHBondContact NH2-OXT 3.12Å
539	L	93.1	Very high	90.2	Very high	12 Å²	12	61.5 Å²	61.5	6%	0.063	31%	0.306	C	S	.	.	H	α-helix	trans	-67	-24.5	173.6	-69.6	175.6	0	0	0	112.7	R468 L477 T479 V521 C535 K536 L546 I548	R468-L539 PolarHBondContact NH2-O 3.49Å; L477-L539 HydrophobicContact CB-CD1 4.47Å; T479-L539 HydrophobicContact CG2-CD1 4.25Å; V521-L539 HydrophobicContact CG2-CD2 4.24Å; C535-L539 WeakPolarHBondContact O-CB 3.43Å; C535-L539 VanDerWaalsContact O-CG 3.24Å; C535-L539 WeakPolarHBondContact O-CG 3.47Å; C535-L539 PolarHBondContact O-N 3.38Å; K536-L539 PolarHBondContact O-N 3.17Å; L539-L546 HydrophobicContact CD2-CD2 3.94Å; L539-I548 HydrophobicContact CD2-CG2 3.75Å
540	T	91	Very high	90.5	Very high	87 Å²	87	59 Å²	59	53%	0.534	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-3.3	172.6	51.4	0	0	0	0	114.4	K536 Q537 R538	K536-T540 PolarHBondContact O-N 3.47Å; K536-T540 PolarHBondContact O-OG1 3.31Å; K536-T540 VanDerWaalsContact O-OG1 3.05Å; Q537-T540 WeakPolarHBondContact CA-OG1 3.35Å; Q537-T540 CarbonylContact O-C 3.55Å; Q537-T540 PolarHBondContact O-N 2.99Å; Q537-T540 PolarHBondContact O-OG1 2.97Å; R538-T540 VanDerWaalsContact C-N 3.25Å; R538-T540 PolarHBondContact O-N 3.22Å
541	A	87.1	Confident	91.2	Very high	42 Å²	42	58.5 Å²	58.5	35%	0.347	29%	0.291	S	S	.	.			trans	-59.7	144.6	-178	0	0	0	0	0	111.9	R468 Q537 R538	R468-A541 PolarHBondContact NH1-O 2.93Å; R468-A541 PolarHBondContact NH2-O 2.95Å; Q537-A541 PolarHBondContact O-N 3.04Å; Q537-A541 VanDerWaalsContact O-N 3.09Å; R538-A541 VanDerWaalsContact O-CB 3.26Å; R538-A541 WeakPolarHBondContact O-CB 3.49Å; R538-A541 PolarHBondContact O-N 3.49Å
542	I	86.3	Confident	92.1	Very high	146 Å²	146	50.3 Å²	50.3	75%	0.749	26%	0.256	S	S	*	.	S	Bend	trans	-61.2	145.9	-179.9	-64.3	169.9	0	0	0	110.6	D471	D471-I542 HydrophobicContact CB-CG2 4.16Å
543	G	88.6	Confident	92.8	Very high	23 Å²	23	43.6 Å²	43.6	24%	0.237	22%	0.22	C	C	.	.	S	Bend	trans	138.2	142.2	-179.4	0	0	0	0	0	112	R468 D471 E545	R468-G543 WeakPolarHBondContact CD-O 3.4Å; R468-G543 PolarHBondContact NH1-O 3.38Å; D471-G543 WeakPolarHBondContact OD1-CA 3.46Å; D471-G543 PolarHBondContact OD1-N 3.01Å; G543-E545 VanDerWaalsContact C-N 3.28Å; G543-E545 PolarHBondContact O-N 3.01Å
544	R	91.9	Very high	93.2	Very high	172 Å²	172	44.4 Å²	44.4	65%	0.649	22%	0.221	S	C	*	.	S	Bend	trans	-73	-16.6	178	-65.1	-173.5	179.5	-163.4	-2.1	114.4	K467 R468 D471	K467-R544 CarbonylContact C-O 3.52Å; R468-R544 PolarHBondContact N-O 2.83Å; D471-R544 PolarHBondContact OD1-N 3.31Å
545	E	93	Very high	93.5	Very high	50 Å²	50	42.8 Å²	42.8	23%	0.234	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	134.9	-178.4	-64.3	-175.7	129.6	0	0	110.5	S359 R361 L465 F466 K467 G543	S359-E545 WeakPolarHBondContact CB-OE1 3.41Å; S359-E545 VanDerWaalsContact CB-OE2 3.24Å; S359-E545 WeakPolarHBondContact CB-OE2 3.38Å; S359-E545 PolarHBondContact OG-OE1 2.84Å; S359-E545 PolarHBondContact OG-OE2 2.86Å; R361-E545 HydrophobicContact CB-CB 4.48Å; R361-E545 HydrophobicContact CG-CB 4.22Å; L465-E545 HydrophobicContact CD1-CB 4.33Å; F466-E545 WeakPolarHBondContact O-CA 3.14Å; K467-E545 WeakPolarHBondContact CE-OE1 3.4Å; K467-E545 HydrophobicContact CG-CG 4.36Å; G543-E545 VanDerWaalsContact C-N 3.28Å; G543-E545 PolarHBondContact O-N 3.01Å
546	L	94.9	Very high	93.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	117.5	179.4	-176.3	74	0	0	0	109.4	F466 V475 V521 N522 L539 I548	F466-L546 HydrophobicContact CD2-CB 4.46Å; F466-L546 HydrophobicContact CD2-CD2 4.16Å; F466-L546 HydrophobicContact CD2-CG 4.47Å; F466-L546 PolarHBondContact N-O 2.89Å; F466-L546 PolarHBondContact O-N 3.39Å; V475-L546 HydrophobicContact CG1-CD2 4.47Å; V475-L546 HydrophobicContact CG2-CD2 3.32Å; V521-L546 HydrophobicContact CG1-CD1 3.57Å; V521-L546 HydrophobicContact CG1-CG 4.45Å; N522-L546 WeakPolarHBondContact OD1-CA 3.17Å; L539-L546 HydrophobicContact CD2-CD2 3.94Å; L546-I548 HydrophobicContact CG-CG2 4.44Å
547	S	95.5	Very high	93.7	Very high	5 Å²	5	41.6 Å²	41.6	4%	0.035	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	144.8	168.1	68.1	0	0	0	0	111.1	F464 V521 N522	F464-S547 CarbonylContact O-C 3.42Å; F464-S547 VanDerWaalsContact O-CA 3.28Å; F464-S547 WeakPolarHBondContact O-CA 3.31Å; V521-S547 CarbonylContact C-O 3.58Å; V521-S547 WeakPolarHBondContact CA-O 3.34Å; N522-S547 WeakPolarHBondContact CA-OG 3.49Å; N522-S547 PolarHBondContact N-O 3.18Å; N522-S547 PolarHBondContact OD1-N 3.29Å
548	I	96.9	Very high	93.9	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	149.8	168.8	68.4	169.1	0	0	0	110.8	V463 F464 F466 L477 F500 E520 V521 L539 L546 V550	V463-I548 WeakPolarHBondContact CA-O 3.44Å; F464-I548 HydrophobicContact CB-CG1 3.89Å; F464-I548 HydrophobicContact CD2-CG1 4.48Å; F464-I548 PolarHBondContact N-O 3.22Å; F464-I548 PolarHBondContact O-N 3.37Å; F466-I548 HydrophobicContact CE2-CD1 3.64Å; F466-I548 HydrophobicContact CE2-CG1 3.7Å; F466-I548 HydrophobicContact CE2-CG2 4.15Å; F466-I548 HydrophobicContact CZ-CD1 3.79Å; F466-I548 HydrophobicContact CZ-CG1 4.06Å; L477-I548 HydrophobicContact CD1-CD1 3.75Å; F500-I548 HydrophobicContact CD2-CD1 4.45Å; F500-I548 HydrophobicContact CE2-CD1 3.99Å; E520-I548 WeakPolarHBondContact O-CA 3.29Å; V521-I548 HydrophobicContact CG1-CG2 4.39Å; V521-I548 HydrophobicContact CG2-CG2 4.2Å; L539-I548 HydrophobicContact CD2-CG2 3.75Å; L546-I548 HydrophobicContact CG-CG2 4.44Å; I548-V550 HydrophobicContact CD1-CG1 3.83Å; I548-V550 HydrophobicContact CG1-CG1 4.4Å
549	V	97.3	Very high	94	Very high	5 Å²	5	34.2 Å²	34.2	3%	0.03	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.7	167.1	-175.4	0	0	0	0	108	L368 M458 A461 V463 T519 E520	L368-V549 HydrophobicContact CD2-CG2 4Å; M458-V549 HydrophobicContact CE-CG1 3.9Å; M458-V549 HydrophobicContact CE-CG2 4.44Å; M458-V549 HydrophobicContact SD-CG1 3.7Å; A461-V549 HydrophobicContact CB-CG1 3.86Å; V463-V549 HydrophobicContact CG1-CG2 4.37Å; V463-V549 HydrophobicContact CG2-CG2 4.38Å; T519-V549 PolarHBondContact N-O 3.39Å; T519-V549 PolarHBondContact OG1-O 3.2Å; E520-V549 HydrophobicContact CB-CB 3.88Å; E520-V549 HydrophobicContact CB-CG2 3.92Å; E520-V549 HydrophobicContact CG-CB 4.01Å; E520-V549 HydrophobicContact CG-CG2 4.16Å; E520-V549 PolarHBondContact N-O 3.48Å; E520-V549 PolarHBondContact O-N 2.84Å
550	V	97.4	Very high	94.1	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	146.1	178.2	-65.2	0	0	0	0	111.6	A461 K462 F464 F500 W516 Y517 V518 I548	A461-V550 CarbonylContact C-O 3.51Å; A461-V550 WeakPolarHBondContact CA-O 3.14Å; K462-V550 HydrophobicContact CB-CG2 4.07Å; K462-V550 PolarHBondContact N-O 3.38Å; K462-V550 WeakPolarHBondContact O-CG2 3.14Å; K462-V550 PolarHBondContact O-N 2.92Å; F464-V550 HydrophobicContact CD2-CG2 4.05Å; F464-V550 HydrophobicContact CE2-CG2 3.73Å; F500-V550 HydrophobicContact CE2-CB 4.48Å; F500-V550 HydrophobicContact CE2-CG1 3.9Å; F500-V550 HydrophobicContact CE2-CG2 3.87Å; F500-V550 HydrophobicContact CZ-CG1 4.08Å; F500-V550 HydrophobicContact CZ-CG2 4.32Å; W516-V550 HydrophobicContact CB-CB 4.08Å; W516-V550 HydrophobicContact CB-CG1 4.37Å; W516-V550 HydrophobicContact CB-CG2 4.44Å; W516-V550 HydrophobicContact CD2-CB 4.15Å; W516-V550 HydrophobicContact CD2-CG2 3.72Å; W516-V550 HydrophobicContact CE3-CB 3.74Å; W516-V550 HydrophobicContact CE3-CG2 3.45Å; W516-V550 VanDerWaalsContact CE3-CG2 3.45Å; W516-V550 HydrophobicContact CG-CB 4.3Å; W516-V550 HydrophobicContact CG-CG2 4.15Å; W516-V550 HydrophobicContact CZ3-CG2 4.02Å; Y517-V550 CarbonylContact O-C 3.6Å; Y517-V550 VanDerWaalsContact O-CA 3.3Å; Y517-V550 WeakPolarHBondContact O-CA 3.21Å; V518-V550 HydrophobicContact CB-CG1 4.49Å; V518-V550 HydrophobicContact CG2-CG1 3.96Å; I548-V550 HydrophobicContact CD1-CG1 3.83Å; I548-V550 HydrophobicContact CG1-CG1 4.4Å
551	Q	96.7	Very high	94.3	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	157.5	176.4	-71.9	170	22.8	0	0	110.5	I419 M458 A461 Y517 T519 T553 F555 V556	I419-Q551 PolarHBondContact O-NE2 3.14Å; M458-Q551 PolarHBondContact SD-NE2 2.77Å; A461-Q551 HydrophobicContact CB-CG 3.69Å; Y517-Q551 WeakPolarHBondContact CB-O 3.29Å; Y517-Q551 PolarHBondContact N-O 2.69Å; Y517-Q551 PolarHBondContact O-N 2.86Å; T519-Q551 HydrophobicContact CG2-CB 4.36Å; T519-Q551 HydrophobicContact CG2-CG 4.36Å; Q551-T553 PolarHBondContact O-N 3Å; Q551-F555 HydrophobicContact CB-CD1 4.42Å; Q551-V556 HydrophobicContact CB-CG2 3.84Å
552	P	96.6	Very high	94.6	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	133.8	177.8	-28.5	37.7	0	0	0	112.6	M460 T504 T514 W516 D554 F555 V556	M460-P552 WeakPolarHBondContact O-CD 3.42Å; T504-P552 HydrophobicContact CG2-CG 4.46Å; T514-P552 HydrophobicContact CG2-CB 3.88Å; W516-P552 HydrophobicContact CZ3-CG 4.2Å; P552-D554 VanDerWaalsContact C-N 3.31Å; P552-D554 VanDerWaalsContact CB-OD1 3.25Å; P552-D554 WeakPolarHBondContact CB-OD1 3.19Å; P552-D554 PolarHBondContact O-N 2.92Å; P552-F555 HydrophobicContact CB-CB 4.2Å; P552-F555 WeakPolarHBondContact O-CB 3.2Å; P552-F555 PolarHBondContact O-N 3.08Å; P552-V556 PolarHBondContact O-N 3.37Å
553	T	95.8	Very high	95	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	14%	0.139	C	C	.	.	H	α-helix	trans	-63.5	-35.1	-172.6	-79.9	0	0	0	0	113.1	E485 T515 W516 Q551 K557	E485-T553 HydrophobicContact CG-CG2 4.04Å; T515-T553 VanDerWaalsContact O-CB 3.22Å; T515-T553 WeakPolarHBondContact O-CB 3.35Å; T515-T553 PolarHBondContact O-N 2.85Å; T515-T553 PolarHBondContact O-OG1 2.88Å; T515-T553 WeakPolarHBondContact OG1-CB 3.42Å; T515-T553 PolarHBondContact OG1-OG1 3.44Å; W516-T553 PolarHBondContact O-OG1 2.78Å; Q551-T553 PolarHBondContact O-N 3Å; T553-K557 HydrophobicContact CG2-CD 3.89Å; T553-K557 HydrophobicContact CG2-CG 4.44Å; T553-K557 WeakPolarHBondContact O-CB 3.35Å; T553-K557 WeakPolarHBondContact O-CD 3.44Å; T553-K557 WeakPolarHBondContact O-CG 3.29Å; T553-K557 PolarHBondContact O-N 2.79Å
554	D	95	Very high	95.3	Very high	30 Å²	30	36.2 Å²	36.2	16%	0.16	15%	0.154	C	C	.	.	H	α-helix	trans	-64.7	-44.9	173	57.3	-57.5	0	0	0	112.3	S506 T514 P552 K557 L558	S506-D554 WeakPolarHBondContact CB-OD2 3.2Å; S506-D554 PolarHBondContact OG-OD2 3.46Å; T514-D554 VanDerWaalsContact CB-OD1 3.27Å; T514-D554 WeakPolarHBondContact CB-OD1 3.44Å; T514-D554 WeakPolarHBondContact CG2-OD1 3.2Å; T514-D554 PolarHBondContact OG1-OD1 3.33Å; P552-D554 VanDerWaalsContact C-N 3.31Å; P552-D554 VanDerWaalsContact CB-OD1 3.25Å; P552-D554 WeakPolarHBondContact CB-OD1 3.19Å; P552-D554 PolarHBondContact O-N 2.92Å; D554-K557 WeakPolarHBondContact O-CB 3.47Å; D554-K557 PolarHBondContact O-N 3.06Å; D554-L558 PolarHBondContact O-N 2.92Å
555	F	96.2	Very high	95.3	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.018	15%	0.153	C	C	.	.	H	α-helix	trans	-59.9	-47.9	172.8	173.7	-109.3	0	0	0	111.2	V395 W400 M460 I508 Q551 P552 K557 L558 L559	V395-F555 HydrophobicContact CG1-CD2 4.37Å; V395-F555 HydrophobicContact CG1-CE2 4.18Å; W400-F555 AromaticContact CD2-CE2 3.93Å; W400-F555 HydrophobicContact CD2-CE2 3.93Å; W400-F555 AromaticContact CD2-CZ 3.78Å; W400-F555 HydrophobicContact CD2-CZ 3.78Å; W400-F555 AromaticContact CE2-CE2 3.97Å; W400-F555 HydrophobicContact CE3-CE2 4.04Å; W400-F555 AromaticContact CE3-CZ 3.49Å; W400-F555 HydrophobicContact CE3-CZ 3.49Å; W400-F555 VanDerWaalsContact CE3-CZ 3.49Å; W400-F555 HydrophobicContact CG-CE2 4.5Å; W400-F555 HydrophobicContact CG-CZ 4.39Å; W400-F555 HydrophobicContact CH2-CE2 4.19Å; W400-F555 HydrophobicContact CH2-CZ 4.21Å; W400-F555 HydrophobicContact CZ2-CE2 4.12Å; W400-F555 HydrophobicContact CZ2-CZ 4.49Å; W400-F555 HydrophobicContact CZ3-CE2 4.14Å; W400-F555 AromaticContact CZ3-CZ 3.7Å; W400-F555 HydrophobicContact CZ3-CZ 3.7Å; M460-F555 HydrophobicContact CB-CD1 4.37Å; I508-F555 HydrophobicContact CD1-CB 4.23Å; Q551-F555 HydrophobicContact CB-CD1 4.42Å; P552-F555 HydrophobicContact CB-CB 4.2Å; P552-F555 WeakPolarHBondContact O-CB 3.2Å; P552-F555 PolarHBondContact O-N 3.08Å; F555-K557 VanDerWaalsContact C-N 3.33Å; F555-K557 PolarHBondContact O-N 3.02Å; F555-L558 WeakPolarHBondContact O-CA 3.48Å; F555-L558 WeakPolarHBondContact O-CB 3.27Å; F555-L558 PolarHBondContact O-N 2.92Å; F555-L559 HydrophobicContact CD1-CD1 4.19Å; F555-L559 HydrophobicContact CE1-CD1 3.59Å; F555-L559 HydrophobicContact CE1-CG 4.14Å; F555-L559 HydrophobicContact CE2-CD2 4.24Å; F555-L559 HydrophobicContact CE2-CG 4.29Å; F555-L559 HydrophobicContact CZ-CD1 3.8Å; F555-L559 HydrophobicContact CZ-CD2 3.99Å; F555-L559 HydrophobicContact CZ-CG 3.98Å; F555-L559 PolarHBondContact O-N 3.27Å
556	V	95.9	Very high	95.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.8	-34.1	176.4	174.9	0	0	0	0	112.2	Y517 T519 M528 Q551 P552 L558 K560	Y517-V556 HydrophobicContact CD1-CB 4.27Å; Y517-V556 HydrophobicContact CD1-CG1 3.61Å; Y517-V556 HydrophobicContact CD1-CG2 4.3Å; Y517-V556 HydrophobicContact CD2-CG1 4.44Å; Y517-V556 HydrophobicContact CE1-CG1 3.95Å; Y517-V556 HydrophobicContact CG-CB 4.16Å; Y517-V556 HydrophobicContact CG-CG1 3.88Å; Y517-V556 HydrophobicContact CG-CG2 4.35Å; T519-V556 HydrophobicContact CG2-CG2 4.18Å; M528-V556 HydrophobicContact CG-CG1 4.26Å; M528-V556 HydrophobicContact SD-CG1 3.82Å; Q551-V556 HydrophobicContact CB-CG2 3.84Å; P552-V556 PolarHBondContact O-N 3.37Å; V556-L558 VanDerWaalsContact C-N 3.29Å; V556-L558 PolarHBondContact O-N 2.91Å; V556-K560 HydrophobicContact CG1-CD 4.05Å; V556-K560 VanDerWaalsContact CG1-CE 3.47Å; V556-K560 HydrophobicContact CG1-CG 4.5Å; V556-K560 WeakPolarHBondContact O-CB 3.41Å; V556-K560 WeakPolarHBondContact O-CD 3.43Å; V556-K560 WeakPolarHBondContact O-CG 3.27Å; V556-K560 PolarHBondContact O-N 3.43Å
557	K	94.9	Very high	94.8	Very high	109 Å²	109	41.1 Å²	41.1	47%	0.474	19%	0.192	S	C	.	.	H	α-helix	trans	-62	-36.9	171.1	-79.8	162.4	-176.9	164.3	0	111.3	E485 T553 D554 F555 R561	E485-K557 IonicContact OE1-NZ 3.93Å; T553-K557 HydrophobicContact CG2-CD 3.89Å; T553-K557 HydrophobicContact CG2-CG 4.44Å; T553-K557 WeakPolarHBondContact O-CB 3.35Å; T553-K557 WeakPolarHBondContact O-CD 3.44Å; T553-K557 WeakPolarHBondContact O-CG 3.29Å; T553-K557 PolarHBondContact O-N 2.79Å; D554-K557 WeakPolarHBondContact O-CB 3.47Å; D554-K557 PolarHBondContact O-N 3.06Å; F555-K557 VanDerWaalsContact C-N 3.33Å; F555-K557 PolarHBondContact O-N 3.02Å; K557-R561 WeakPolarHBondContact O-CB 3.27Å; K557-R561 PolarHBondContact O-N 3.11Å
558	L	94.9	Very high	94.5	Very high	29 Å²	29	49.6 Å²	49.6	15%	0.152	22%	0.223	C	C	.	.	H	α-helix	trans	-71.8	-45.8	177.6	-174.1	46	0	0	0	112.1	V395 I508 D554 F555 V556 K560 R561 Q562	V395-L558 HydrophobicContact CB-CD2 4.49Å; V395-L558 HydrophobicContact CB-CG 4.4Å; V395-L558 HydrophobicContact CG1-CD2 3.48Å; V395-L558 VanDerWaalsContact CG1-CD2 3.48Å; V395-L558 HydrophobicContact CG1-CG 3.75Å; V395-L558 HydrophobicContact CG2-CD2 4.44Å; V395-L558 HydrophobicContact CG2-CG 3.84Å; I508-L558 HydrophobicContact CD1-CB 4.27Å; I508-L558 HydrophobicContact CD1-CD2 3.63Å; D554-L558 PolarHBondContact O-N 2.92Å; F555-L558 WeakPolarHBondContact O-CA 3.48Å; F555-L558 WeakPolarHBondContact O-CB 3.27Å; F555-L558 PolarHBondContact O-N 2.92Å; V556-L558 VanDerWaalsContact C-N 3.29Å; V556-L558 PolarHBondContact O-N 2.91Å; L558-K560 VanDerWaalsContact C-N 3.31Å; L558-K560 PolarHBondContact O-N 2.89Å; L558-R561 WeakPolarHBondContact O-CB 3.31Å; L558-R561 PolarHBondContact O-N 3.46Å; L558-Q562 HydrophobicContact CD1-CG 4.44Å; L558-Q562 PolarHBondContact O-N 2.66Å
559	L	95.8	Very high	94.3	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-53.2	-48.1	170.6	-67.6	-179.8	0	0	0	111.3	V393 V395 W400 C402 I419 F555 R561 Q562 M563	V393-L559 HydrophobicContact CG2-CD2 3.56Å; V395-L559 HydrophobicContact CG2-CD2 4.13Å; W400-L559 HydrophobicContact CB-CD2 3.81Å; W400-L559 HydrophobicContact CG-CD2 4.32Å; C402-L559 HydrophobicContact CB-CB 4.45Å; I419-L559 HydrophobicContact CG2-CD1 4.46Å; F555-L559 HydrophobicContact CD1-CD1 4.19Å; F555-L559 HydrophobicContact CE1-CD1 3.59Å; F555-L559 HydrophobicContact CE1-CG 4.14Å; F555-L559 HydrophobicContact CE2-CD2 4.24Å; F555-L559 HydrophobicContact CE2-CG 4.29Å; F555-L559 HydrophobicContact CZ-CD1 3.8Å; F555-L559 HydrophobicContact CZ-CD2 3.99Å; F555-L559 HydrophobicContact CZ-CG 3.98Å; F555-L559 PolarHBondContact O-N 3.27Å; L559-R561 VanDerWaalsContact C-N 3.29Å; L559-R561 PolarHBondContact O-N 3Å; L559-Q562 PolarHBondContact O-N 2.64Å; L559-M563 VanDerWaalsContact O-CB 3.24Å; L559-M563 WeakPolarHBondContact O-CB 3.4Å; L559-M563 PolarHBondContact O-N 3.22Å
560	K	95.2	Very high	94	Very high	30 Å²	30	60.8 Å²	60.8	13%	0.13	27%	0.265	C	S	.	.	H	α-helix	trans	-60.9	-34.4	176.9	-74.2	164.5	177.6	-179.9	0	113.8	Y517 M528 F529 V556 L558 K564	Y517-K560 VanDerWaalsContact CE2-NZ 3.35Å; Y517-K560 PolarHBondContact OH-NZ 3.06Å; M528-K560 HydrophobicContact CB-CG 4.34Å; M528-K560 WeakPolarHBondContact O-CE 3.35Å; M528-K560 PolarHBondContact O-NZ 3.42Å; M528-K560 HydrophobicContact SD-CG 4.2Å; F529-K560 HydrophobicContact CE1-CB 4.07Å; F529-K560 HydrophobicContact CE1-CG 3.91Å; F529-K560 HydrophobicContact CZ-CB 4.2Å; F529-K560 HydrophobicContact CZ-CG 3.92Å; V556-K560 HydrophobicContact CG1-CD 4.05Å; V556-K560 VanDerWaalsContact CG1-CE 3.47Å; V556-K560 HydrophobicContact CG1-CG 4.5Å; V556-K560 WeakPolarHBondContact O-CB 3.41Å; V556-K560 WeakPolarHBondContact O-CD 3.43Å; V556-K560 WeakPolarHBondContact O-CG 3.27Å; V556-K560 PolarHBondContact O-N 3.43Å; L558-K560 VanDerWaalsContact C-N 3.31Å; L558-K560 PolarHBondContact O-N 2.89Å; K560-K564 WeakPolarHBondContact O-CB 3.27Å; K560-K564 VanDerWaalsContact O-CG 3.27Å; K560-K564 WeakPolarHBondContact O-CG 3.46Å; K560-K564 PolarHBondContact O-N 3.05Å
561	R	94.8	Very high	93.8	Very high	144 Å²	144	63.8 Å²	63.8	54%	0.543	28%	0.281	S	S	.	.	H	α-helix	trans	-69.9	-46.2	179.4	-174	174.9	71.9	-174.1	6.2	110.6	K557 L558 L559	K557-R561 WeakPolarHBondContact O-CB 3.27Å; K557-R561 PolarHBondContact O-N 3.11Å; L558-R561 WeakPolarHBondContact O-CB 3.31Å; L558-R561 PolarHBondContact O-N 3.46Å; L559-R561 VanDerWaalsContact C-N 3.29Å; L559-R561 PolarHBondContact O-N 3Å
562	Q	93.4	Very high	93.5	Very high	50 Å²	50	65.1 Å²	65.1	23%	0.234	29%	0.287	C	S	.	.	H	α-helix	trans	-70.3	-42.2	177.2	-62.9	-68.2	42.1	0	0	112.1	V393 D394 V395 L558 L559 K564 S565	V393-Q562 HydrophobicContact CB-CB 3.67Å; V393-Q562 HydrophobicContact CB-CG 4.48Å; V393-Q562 HydrophobicContact CG1-CB 3.67Å; V393-Q562 HydrophobicContact CG2-CB 4.42Å; D394-Q562 WeakPolarHBondContact O-CG 3.32Å; D394-Q562 PolarHBondContact O-NE2 3.11Å; V395-Q562 HydrophobicContact CG2-CG 3.97Å; L558-Q562 HydrophobicContact CD1-CG 4.44Å; L558-Q562 PolarHBondContact O-N 2.66Å; L559-Q562 PolarHBondContact O-N 2.64Å; Q562-K564 PolarHBondContact O-N 3.19Å; Q562-S565 PolarHBondContact O-N 3.12Å; Q562-S565 PolarHBondContact O-OG 3.47Å
563	M	94	Very high	93.2	Very high	1 Å²	1	67.3 Å²	67.3	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-57.4	-39.8	176.8	-175.6	176.6	171.1	0	0	111.3	V393 C402 M528 F529 L559 S565 M566 Y569 F572 I573	V393-M563 HydrophobicContact CG1-CB 4.43Å; C402-M563 HydrophobicContact CB-CB 4.47Å; C402-M563 HydrophobicContact CB-SD 4.25Å; M528-M563 HydrophobicContact CE-SD 3.9Å; F529-M563 HydrophobicContact CE2-CE 3.77Å; F529-M563 HydrophobicContact CE2-SD 3.49Å; F529-M563 WeakPolarHBondContact CE2-SD 3.33Å; F529-M563 HydrophobicContact CZ-CE 4.44Å; F529-M563 HydrophobicContact CZ-CG 4.37Å; F529-M563 HydrophobicContact CZ-SD 3.77Å; L559-M563 VanDerWaalsContact O-CB 3.24Å; L559-M563 WeakPolarHBondContact O-CB 3.4Å; L559-M563 PolarHBondContact O-N 3.22Å; M563-S565 VanDerWaalsContact C-N 3.27Å; M563-S565 PolarHBondContact O-N 2.84Å; M563-M566 WeakPolarHBondContact O-CB 3.45Å; M563-M566 PolarHBondContact O-N 2.9Å; M563-M566 VanDerWaalsContact O-N 3.16Å; M563-Y569 VanDerWaalsContact CE-O 3.28Å; M563-Y569 WeakPolarHBondContact CE-O 3.45Å; M563-Y569 WeakPolarHBondContact O-CB 3.21Å; M563-F572 HydrophobicContact CE-CB 4.17Å; M563-I573 HydrophobicContact CE-CB 4.46Å; M563-I573 HydrophobicContact CE-CG1 3.61Å
564	K	94.4	Very high	92.8	Very high	127 Å²	127	67.7 Å²	67.7	55%	0.552	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-19	174.8	-79.3	176.5	174.6	-173.7	0	115.4	F529 K560 Q562 Y569	F529-K564 HydrophobicContact CE1-CG 4.28Å; K560-K564 WeakPolarHBondContact O-CB 3.27Å; K560-K564 VanDerWaalsContact O-CG 3.27Å; K560-K564 WeakPolarHBondContact O-CG 3.46Å; K560-K564 PolarHBondContact O-N 3.05Å; Q562-K564 PolarHBondContact O-N 3.19Å; K564-Y569 HydrophobicContact CG-CE2 4.37Å
565	S	91.8	Very high	91.9	Very high	89 Å²	89	70.1 Å²	70.1	62%	0.622	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-14.4	174.7	72.2	0	0	0	0	112.5	Q562 M563	Q562-S565 PolarHBondContact O-N 3.12Å; Q562-S565 PolarHBondContact O-OG 3.47Å; M563-S565 VanDerWaalsContact C-N 3.27Å; M563-S565 PolarHBondContact O-N 2.84Å
566	M	89.9	Confident	91.7	Very high	40 Å²	40	73.5 Å²	73.5	20%	0.197	34%	0.335	C	S	.	.	S	Bend	trans	-70.6	139	175.4	-56.4	175.5	76.4	0	0	111.7	A391 V393 M563 R568 Y569	A391-M566 HydrophobicContact CB-CE 4.01Å; A391-M566 HydrophobicContact CB-SD 4.18Å; V393-M566 HydrophobicContact CG1-CG 4.5Å; V393-M566 HydrophobicContact CG1-SD 3.71Å; M563-M566 WeakPolarHBondContact O-CB 3.45Å; M563-M566 PolarHBondContact O-N 2.9Å; M563-M566 VanDerWaalsContact O-N 3.16Å; M566-R568 PolarHBondContact O-N 2.86Å; M566-Y569 PolarHBondContact O-N 3.18Å
567	K	89.3	Confident	91.5	Very high	197 Å²	197	77.3 Å²	77.3	86%	0.857	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	137.5	167	-66.1	179.8	-179.4	178.4	0	109	Y569	K567-Y569 VanDerWaalsContact C-N 3.25Å; K567-Y569 PolarHBondContact O-N 3.07Å
568	R	88.5	Confident	91.3	Very high	183 Å²	183	75.6 Å²	75.6	69%	0.691	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	27.7	179.4	-58.9	178.9	61.8	164.7	-1.1	115.3	M566 R570 D571	M566-R568 PolarHBondContact O-N 2.86Å; R568-R570 PolarHBondContact O-N 2.78Å; R568-D571 IonicContact CZ-OD2 3.86Å; R568-D571 IonicContact NE-OD2 3.66Å; R568-D571 PolarHBondContact NE-OD2 2.78Å; R568-D571 IonicContact NH2-OD2 3.67Å; R568-D571 PolarHBondContact NH2-OD2 2.77Å; R568-D571 WeakPolarHBondContact O-CB 3.47Å; R568-D571 PolarHBondContact O-N 3.07Å
569	Y	92.3	Very high	91.1	Very high	58 Å²	58	78.3 Å²	78.3	23%	0.227	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-52	-25.1	-177.8	80.6	-93	0	0	0	115.8	M563 K564 M566 K567 D571 F572 I573	M563-Y569 VanDerWaalsContact CE-O 3.28Å; M563-Y569 WeakPolarHBondContact CE-O 3.45Å; M563-Y569 WeakPolarHBondContact O-CB 3.21Å; K564-Y569 HydrophobicContact CG-CE2 4.37Å; M566-Y569 PolarHBondContact O-N 3.18Å; K567-Y569 VanDerWaalsContact C-N 3.25Å; K567-Y569 PolarHBondContact O-N 3.07Å; Y569-D571 PolarHBondContact O-N 3.24Å; Y569-F572 PolarHBondContact O-N 2.91Å; Y569-I573 HydrophobicContact CD2-CD1 4.29Å; Y569-I573 HydrophobicContact CE2-CD1 4.08Å
570	R	92.1	Very high	90.8	Very high	183 Å²	183	83.2 Å²	83.2	69%	0.691	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-63	-31.7	178.3	-66.6	-174.4	-178.2	179.1	1.1	112.6	R568 F572 I573	R568-R570 PolarHBondContact O-N 2.78Å; R570-F572 PolarHBondContact O-N 3.07Å; R570-I573 HydrophobicContact CB-CD1 4.41Å; R570-I573 HydrophobicContact CG-CD1 4.41Å; R570-I573 WeakPolarHBondContact O-CB 3.33Å; R570-I573 PolarHBondContact O-N 3.26Å
571	D	91.3	Very high	90.5	Very high	62 Å²	62	86.7 Å²	86.7	33%	0.332	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-71.7	-14.9	-176.6	-55.5	4.6	0	0	0	112	Q405 R568 Y569	Q405-D571 WeakPolarHBondContact CA-O 3.32Å; R568-D571 IonicContact CZ-OD2 3.86Å; R568-D571 IonicContact NE-OD2 3.66Å; R568-D571 PolarHBondContact NE-OD2 2.78Å; R568-D571 IonicContact NH2-OD2 3.67Å; R568-D571 PolarHBondContact NH2-OD2 2.77Å; R568-D571 WeakPolarHBondContact O-CB 3.47Å; R568-D571 PolarHBondContact O-N 3.07Å; Y569-D571 PolarHBondContact O-N 3.24Å
572	F	91.7	Very high	90.2	Very high	30 Å²	30	82.6 Å²	82.6	13%	0.132	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-104.7	5.6	177.4	-55.5	-88.8	0	0	0	113.1	A391 G403 W404 M563 Y569 R570 V574	A391-F572 HydrophobicContact CB-CB 3.66Å; A391-F572 HydrophobicContact CB-CD1 3.69Å; A391-F572 HydrophobicContact CB-CD2 4.33Å; A391-F572 HydrophobicContact CB-CE1 4.37Å; A391-F572 HydrophobicContact CB-CG 3.66Å; G403-F572 WeakPolarHBondContact CA-O 3.36Å; W404-F572 PolarHBondContact N-O 2.94Å; M563-F572 HydrophobicContact CE-CB 4.17Å; Y569-F572 PolarHBondContact O-N 2.91Å; R570-F572 PolarHBondContact O-N 3.07Å; F572-V574 PolarHBondContact O-N 3.43Å
573	I	90.8	Very high	89.9	Confident	46 Å²	46	85.2 Å²	85.2	24%	0.236	40%	0.398	C	S	.	.			trans	-75.2	107.9	176.3	-63.6	176	0	0	0	108.9	S527 F529 M563 Y569 R570	S527-I573 WeakPolarHBondContact OG-CG2 3.48Å; F529-I573 HydrophobicContact CD2-CD1 3.79Å; F529-I573 HydrophobicContact CD2-CG1 3.83Å; F529-I573 HydrophobicContact CD2-CG2 4.2Å; F529-I573 HydrophobicContact CE2-CD1 4.32Å; F529-I573 HydrophobicContact CE2-CG1 4.09Å; F529-I573 HydrophobicContact CG-CD1 4.27Å; M563-I573 HydrophobicContact CE-CB 4.46Å; M563-I573 HydrophobicContact CE-CG1 3.61Å; Y569-I573 HydrophobicContact CD2-CD1 4.29Å; Y569-I573 HydrophobicContact CE2-CD1 4.08Å; R570-I573 HydrophobicContact CB-CD1 4.41Å; R570-I573 HydrophobicContact CG-CD1 4.41Å; R570-I573 WeakPolarHBondContact O-CB 3.33Å; R570-I573 PolarHBondContact O-N 3.26Å
574	V	87.5	Confident	89.6	Confident	9 Å²	9	92.2 Å²	92.2	6%	0.055	43%	0.43	C	S	.	.			trans	-78.4	143.1	174.7	-156.7	0	0	0	0	110.9	W404 T406 P525 S527 F572	W404-V574 HydrophobicContact CD2-CG2 3.65Å; W404-V574 HydrophobicContact CE3-CG2 3.89Å; W404-V574 HydrophobicContact CG-CG2 4.11Å; W404-V574 HydrophobicContact CH2-CG1 4.49Å; W404-V574 HydrophobicContact CH2-CG2 4.29Å; W404-V574 HydrophobicContact CZ2-CB 4.49Å; W404-V574 HydrophobicContact CZ2-CG1 3.79Å; W404-V574 HydrophobicContact CZ2-CG2 4.07Å; W404-V574 HydrophobicContact CZ3-CG2 4.19Å; T406-V574 HydrophobicContact CG2-CG1 4.34Å; P525-V574 HydrophobicContact CB-CB 4.48Å; P525-V574 HydrophobicContact CB-CG1 4.14Å; P525-V574 HydrophobicContact CG-CB 4.33Å; P525-V574 HydrophobicContact CG-CG1 3.48Å; P525-V574 VanDerWaalsContact CG-CG1 3.48Å; S527-V574 WeakPolarHBondContact CA-O 3.33Å; S527-V574 VanDerWaalsContact CB-O 3.3Å; S527-V574 WeakPolarHBondContact CB-O 3.5Å; F572-V574 PolarHBondContact O-N 3.43Å
575	S	75.6	Confident	89.2	Confident	82 Å²	82	89 Å²	89	57%	0.573	42%	0.419	S	S	*	.			trans	-145.3	0	171.1	62.1	0	0	0	0	110.4	R538	R538-S575 PolarHBondContact NH1-OXT 3.08Å; R538-S575 PolarHBondContact NH2-OXT 3.12Å

Retrieved 575 of 575 residues in 272.5 ms (Link to these results)

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