A0A096N8X1_PAPAN Loading...

Leucine rich repeat containing 43

AlphaFold DB , UniProt , Accession A0A096N8X1, Species PAPAN (Papio anubis, Olive baboon), Gene LRRC43, Length 654 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.3	Very low	27.4	Very low	248 Å²	248	162 Å²	162	100%	1.222	87%	0.866	S	S	*	*				0	80.4	0	-83.6	173.6	-174.2	0	0	105.4
2	E	24.9	Very low	27.5	Very low	191 Å²	191	164.4 Å²	164.4	89%	0.893	87%	0.868	S	S	*	*			trans	-116.8	129.2	-178.3	-74.6	168.2	132.5	0	0	105.5
3	A	26.3	Very low	27.5	Very low	97 Å²	97	158.9 Å²	158.9	80%	0.802	86%	0.86	S	S	*	*			trans	-104	97.6	164.4	0	0	0	0	0	106.9	Y5	A3-Y5 PolarHBondContact O-N 3.11Å
4	S	24.2	Very low	27.4	Very low	103 Å²	103	164.6 Å²	164.6	72%	0.72	86%	0.864	S	S	*	*			trans	-67.7	114.5	175.7	176.7	0	0	0	0	109.9	K6	S4-K6 PolarHBondContact O-N 2.72Å
5	Y	28.9	Very low	27.6	Very low	228 Å²	228	162.7 Å²	162.7	89%	0.894	87%	0.865	S	S	*	*			trans	-72.2	113.2	159.6	-81.3	-91	0	0	0	108	A3	A3-Y5 PolarHBondContact O-N 3.11Å
6	K	26	Very low	28	Very low	187 Å²	187	156.9 Å²	156.9	81%	0.813	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-77.3	120.3	169.9	-94.8	-179.4	174.1	178.8	0	108.4	S4 E8	S4-K6 PolarHBondContact O-N 2.72Å; K6-E8 PolarHBondContact O-N 3.02Å
7	S	26.5	Very low	28	Very low	115 Å²	115	155.5 Å²	155.5	80%	0.804	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-56.7	118.6	161.1	50	0	0	0	0	110.4
8	E	27.4	Very low	28.3	Very low	195 Å²	195	157.4 Å²	157.4	91%	0.911	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-79.6	128.3	163.5	-76.4	-176	157.3	0	0	109	K6	K6-E8 PolarHBondContact O-N 3.02Å
9	S	27.2	Very low	28.9	Very low	112 Å²	112	160.5 Å²	160.5	78%	0.783	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-69.1	124	-177.8	48	0	0	0	0	111.5	S11	S9-S11 PolarHBondContact O-N 3.16Å; S9-S11 VanDerWaalsContact O-N 3.16Å
10	E	27.3	Very low	29.5	Very low	197 Å²	197	158.7 Å²	158.7	92%	0.921	85%	0.85	S	S	*	*			trans	-55.4	111.7	162	-70.1	174.1	145.8	0	0	109.7
11	S	28	Very low	30.4	Very low	109 Å²	109	153.2 Å²	153.2	76%	0.762	83%	0.832	S	S	*	*			trans	-85.2	112.4	163.9	58.4	0	0	0	0	108.4	S9 A13	S9-S11 PolarHBondContact O-N 3.16Å; S9-S11 VanDerWaalsContact O-N 3.16Å; S11-A13 PolarHBondContact O-N 2.8Å
12	E	29	Very low	31.7	Very low	191 Å²	191	142.4 Å²	142.4	89%	0.893	78%	0.78	S	S	*	*			trans	-50.1	106.9	172.4	-68.7	-176.1	146.7	0	0	111.2
13	A	27.3	Very low	34.7	Very low	93 Å²	93	134.9 Å²	134.9	77%	0.769	75%	0.754	S	S	*	*			trans	-88	126.5	169.5	0	0	0	0	0	109.3	S11	S11-A13 PolarHBondContact O-N 2.8Å
14	W	26.3	Very low	38	Very low	239 Å²	239	131.7 Å²	131.7	91%	0.905	72%	0.724	S	S	*	*			trans	-61.5	137.9	177.1	-73.3	53.7	0	0	0	111.1	G16	W14-G16 PolarHBondContact O-N 2.76Å
15	P	31.1	Very low	41.4	Very low	136 Å²	136	126.8 Å²	126.8	88%	0.883	69%	0.69	S	S	*	*	S	Bend	trans	-79.8	108.5	178.4	30.1	-29.3	0	0	0	109.4
16	G	33.9	Very low	44.4	Very low	69 Å²	69	116.1 Å²	116.1	71%	0.711	65%	0.648	S	S	*	*			trans	145.4	42.2	169.7	0	0	0	0	0	117	W14	W14-G16 PolarHBondContact O-N 2.76Å
17	T	28.1	Very low	47.7	Very low	133 Å²	133	108.5 Å²	108.5	82%	0.816	62%	0.62	S	S	*	*			trans	-151.8	81.4	157.3	-26	0	0	0	0	109.7	R19	T17-R19 PolarHBondContact O-N 2.58Å; T17-R19 VanDerWaalsContact O-N 3.07Å
18	Q	32.2	Very low	50.9	Low	190 Å²	190	103.4 Å²	103.4	89%	0.888	59%	0.585	S	S	*	*			trans	-57.2	114.1	160.8	-76.6	176.8	-3.5	0	0	106.8
19	R	40.3	Very low	54.1	Low	216 Å²	216	94.6 Å²	94.6	82%	0.815	55%	0.545	S	S	*	.			trans	-60.2	134.7	165.9	-76.6	-177.9	-177.9	175.5	2.8	106.5	T17 G21	T17-R19 PolarHBondContact O-N 2.58Å; T17-R19 VanDerWaalsContact O-N 3.07Å; R19-G21 PolarHBondContact O-N 3.44Å
20	P	40.2	Very low	57.1	Low	124 Å²	124	94.9 Å²	94.9	81%	0.805	53%	0.529	S	S	*	.			trans	-60.6	115.5	175.6	23.6	-29.5	0	0	0	107.7
21	G	50	Low	60.2	Low	44 Å²	44	88.6 Å²	88.6	45%	0.454	50%	0.499	S	S	.	.			trans	-54.9	144	178	0	0	0	0	0	110.5	R19 G23	R19-G21 PolarHBondContact O-N 3.44Å; G21-G23 VanDerWaalsContact C-N 3.28Å; G21-G23 PolarHBondContact O-N 2.83Å
22	T	61.6	Low	63.2	Low	21 Å²	21	86.8 Å²	86.8	13%	0.129	48%	0.479	C	S	.	.			trans	-68.5	90.9	170.9	43.7	0	0	0	0	108.4	T24 A28 E31 K134	T22-T24 PolarHBondContact O-N 2.86Å; T22-A28 HydrophobicContact CG2-CB 4.38Å; T22-E31 WeakPolarHBondContact CG2-OE2 3.22Å; T22-K134 PolarHBondContact OG1-O 2.81Å
23	G	87.6	Confident	66.2	Low	34 Å²	34	79 Å²	79	35%	0.351	44%	0.443	S	S	.	.			trans	-61.5	-15.1	-171.8	0	0	0	0	0	115.3	G21 T137 L138	G21-G23 VanDerWaalsContact C-N 3.28Å; G21-G23 PolarHBondContact O-N 2.83Å; G23-T137 PolarHBondContact O-OG1 2.9Å; G23-L138 WeakPolarHBondContact O-CB 3.49Å; G23-L138 PolarHBondContact O-N 2.78Å
24	T	94.7	Very high	69.1	Low	29 Å²	29	83.3 Å²	83.3	18%	0.178	44%	0.44	C	S	.	.	B	Isolated β-bridge	trans	-135.3	154.6	178.8	81	0	0	0	0	113.6	T22 S26 A27 A28 L138 D140	T22-T24 PolarHBondContact O-N 2.86Å; T24-S26 VanDerWaalsContact C-N 3.3Å; T24-S26 PolarHBondContact O-N 3.37Å; T24-A27 WeakPolarHBondContact O-CB 3.25Å; T24-A27 PolarHBondContact O-N 3.17Å; T24-A27 VanDerWaalsContact O-N 3.15Å; T24-A27 WeakPolarHBondContact OG1-CB 3.45Å; T24-A27 PolarHBondContact OG1-N 3.44Å; T24-A28 PolarHBondContact O-N 2.82Å; T24-L138 VanDerWaalsContact CA-O 3.29Å; T24-L138 WeakPolarHBondContact CA-O 3.38Å; T24-L138 HydrophobicContact CG2-CB 4.46Å; T24-L138 HydrophobicContact CG2-CD2 4.28Å; T24-D140 WeakPolarHBondContact CB-OD2 3.3Å; T24-D140 HydrophobicContact CG2-CB 4.07Å; T24-D140 VanDerWaalsContact OG1-CG 3.3Å; T24-D140 PolarHBondContact OG1-OD1 3.28Å; T24-D140 PolarHBondContact OG1-OD2 3.13Å
25	V	95.1	Very high	72.2	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	42%	0.421	C	S	.	.	H	α-helix	trans	-53.7	-48.1	174.5	176.4	0	0	0	0	110.8	A27 A28 V29 V131 V136 L138 V139 L143 L154	V25-A27 VanDerWaalsContact C-N 3.28Å; V25-A27 PolarHBondContact O-N 3.12Å; V25-A28 WeakPolarHBondContact O-CB 3.16Å; V25-A28 PolarHBondContact O-N 3.36Å; V25-A28 VanDerWaalsContact O-N 3.17Å; V25-V29 HydrophobicContact CG1-CG2 4.45Å; V25-V29 WeakPolarHBondContact O-CG2 3.29Å; V25-V29 PolarHBondContact O-N 3.25Å; V25-V131 HydrophobicContact CG1-CG2 4.37Å; V25-V136 HydrophobicContact CG2-CG1 3.73Å; V25-L138 PolarHBondContact N-O 2.89Å; V25-V139 HydrophobicContact CG2-CB 4.36Å; V25-V139 HydrophobicContact CG2-CG1 4.49Å; V25-V139 HydrophobicContact CG2-CG2 4.01Å; V25-L143 HydrophobicContact CG1-CD1 4.21Å; V25-L154 HydrophobicContact CG1-CD2 4.02Å; V25-L154 HydrophobicContact CG2-CD1 4Å; V25-L154 HydrophobicContact CG2-CD2 3.82Å
26	S	93.5	Very high	75	Confident	4 Å²	4	71.3 Å²	71.3	3%	0.028	38%	0.38	C	S	.	.	H	α-helix	trans	-67.1	-30.2	-177.8	-52.4	0	0	0	0	112.5	T24 R30 D140 D142 L143	T24-S26 VanDerWaalsContact C-N 3.3Å; T24-S26 PolarHBondContact O-N 3.37Å; S26-R30 WeakPolarHBondContact O-CB 3.42Å; S26-R30 VanDerWaalsContact O-CG 3.29Å; S26-R30 WeakPolarHBondContact O-CG 3.46Å; S26-R30 PolarHBondContact O-N 3.12Å; S26-R30 PolarHBondContact O-NE 3.42Å; S26-D140 VanDerWaalsContact CB-OD1 3.27Å; S26-D140 WeakPolarHBondContact CB-OD1 3.25Å; S26-D140 VanDerWaalsContact CB-OD2 3.25Å; S26-D140 WeakPolarHBondContact CB-OD2 3.49Å; S26-D140 PolarHBondContact N-OD1 3.09Å; S26-D140 VanDerWaalsContact OG-CG 3.26Å; S26-D140 PolarHBondContact OG-OD1 3.46Å; S26-D140 PolarHBondContact OG-OD2 3.19Å; S26-D142 WeakPolarHBondContact OG-CB 3.39Å; S26-L143 PolarHBondContact OG-N 3.24Å
27	A	94.6	Very high	77.6	Confident	27 Å²	27	70.2 Å²	70.2	22%	0.223	36%	0.361	C	S	.	.	H	α-helix	trans	-67.2	-44	172.6	0	0	0	0	0	111.6	T24 V25 V29 R30 E31	T24-A27 WeakPolarHBondContact O-CB 3.25Å; T24-A27 PolarHBondContact O-N 3.17Å; T24-A27 VanDerWaalsContact O-N 3.15Å; T24-A27 WeakPolarHBondContact OG1-CB 3.45Å; T24-A27 PolarHBondContact OG1-N 3.44Å; V25-A27 VanDerWaalsContact C-N 3.28Å; V25-A27 PolarHBondContact O-N 3.12Å; A27-V29 PolarHBondContact O-N 3.38Å; A27-R30 PolarHBondContact O-N 3.14Å; A27-E31 PolarHBondContact O-N 3.4Å
28	A	94.6	Very high	80.6	Confident	8 Å²	8	64.2 Å²	64.2	7%	0.066	32%	0.324	C	S	.	.	H	α-helix	trans	-61.5	-43.2	176	0	0	0	0	0	112	T22 T24 V25 E31 H32 V131 K134 V136	T22-A28 HydrophobicContact CG2-CB 4.38Å; T24-A28 PolarHBondContact O-N 2.82Å; V25-A28 WeakPolarHBondContact O-CB 3.16Å; V25-A28 PolarHBondContact O-N 3.36Å; V25-A28 VanDerWaalsContact O-N 3.17Å; A28-E31 PolarHBondContact O-N 3.12Å; A28-H32 PolarHBondContact O-N 3.42Å; A28-V131 HydrophobicContact CB-CG1 3.57Å; A28-K134 HydrophobicContact CB-CB 4.33Å; A28-V136 HydrophobicContact CB-CG2 3.8Å
29	V	92.9	Very high	83.4	Confident	11 Å²	11	62.2 Å²	62.2	7%	0.067	31%	0.308	C	S	.	.	H	α-helix	trans	-62.6	-44.5	175.1	175.9	0	0	0	0	111.2	V25 A27 E31 H32 L33 L129 V131 F146	V25-V29 HydrophobicContact CG1-CG2 4.45Å; V25-V29 WeakPolarHBondContact O-CG2 3.29Å; V25-V29 PolarHBondContact O-N 3.25Å; A27-V29 PolarHBondContact O-N 3.38Å; V29-E31 VanDerWaalsContact C-N 3.32Å; V29-E31 PolarHBondContact O-N 3.05Å; V29-H32 PolarHBondContact O-N 3Å; V29-L33 HydrophobicContact CG1-CD1 4.11Å; V29-L33 HydrophobicContact CG1-CG 4.44Å; V29-L33 WeakPolarHBondContact O-CG 3.36Å; V29-L33 PolarHBondContact O-N 2.89Å; V29-L129 HydrophobicContact CG1-CD2 4.43Å; V29-L129 HydrophobicContact CG2-CD1 4.46Å; V29-V131 HydrophobicContact CG2-CG2 3.73Å; V29-F146 HydrophobicContact CG1-CZ 3.98Å
30	R	92.1	Very high	85.8	Confident	118 Å²	118	57.4 Å²	57.4	45%	0.445	30%	0.295	S	S	.	.	H	α-helix	trans	-61.7	-40	176	-77.2	-175.8	-63.7	-103.9	2.7	112.1	S26 A27 R34 D142	S26-R30 WeakPolarHBondContact O-CB 3.42Å; S26-R30 VanDerWaalsContact O-CG 3.29Å; S26-R30 WeakPolarHBondContact O-CG 3.46Å; S26-R30 PolarHBondContact O-N 3.12Å; S26-R30 PolarHBondContact O-NE 3.42Å; A27-R30 PolarHBondContact O-N 3.14Å; R30-R34 WeakPolarHBondContact O-CB 3.49Å; R30-R34 PolarHBondContact O-N 3.35Å; R30-D142 IonicContact NH1-OD2 2.86Å; R30-D142 PolarHBondContact NH1-OD2 2.94Å
31	E	92.2	Very high	88.3	Confident	64 Å²	64	54.3 Å²	54.3	30%	0.299	27%	0.269	S	S	.	.	H	α-helix	trans	-65.3	-43.9	176.7	-171.5	-175.8	154	0	0	111.5	T22 A27 A28 V29 R34 K35	T22-E31 WeakPolarHBondContact CG2-OE2 3.22Å; A27-E31 PolarHBondContact O-N 3.4Å; A28-E31 PolarHBondContact O-N 3.12Å; V29-E31 VanDerWaalsContact C-N 3.32Å; V29-E31 PolarHBondContact O-N 3.05Å; E31-R34 WeakPolarHBondContact O-CB 3.46Å; E31-R34 PolarHBondContact O-N 2.78Å; E31-K35 WeakPolarHBondContact O-CG 3.46Å; E31-K35 PolarHBondContact O-N 3.19Å; E31-K35 WeakPolarHBondContact OE1-CE 3.12Å; E31-K35 IonicContact OE1-NZ 3.3Å; E31-K35 PolarHBondContact OE1-NZ 3.05Å
32	H	90.7	Very high	90.3	Very high	72 Å²	72	52.3 Å²	52.3	33%	0.333	25%	0.248	S	C	.	.	H	α-helix	trans	-56.8	-52.4	174.5	-176.6	68	0	0	0	111.2	A28 V29 R34 K35 L36 D103	A28-H32 PolarHBondContact O-N 3.42Å; V29-H32 PolarHBondContact O-N 3Å; H32-R34 PolarHBondContact O-N 3.25Å; H32-K35 WeakPolarHBondContact O-CB 3.36Å; H32-K35 PolarHBondContact O-N 2.87Å; H32-L36 PolarHBondContact O-N 3.08Å; H32-D103 IonicContact CD2-OD1 2.69Å; H32-D103 IonicContact CE1-OD1 2.8Å; H32-D103 IonicContact CE1-OD2 2.76Å; H32-D103 PolarHBondContact CE1-OD2 2.77Å; H32-D103 IonicContact NE2-OD1 3.2Å; H32-D103 PolarHBondContact NE2-OD1 2.81Å; H32-D103 IonicContact NE2-OD2 3.42Å; H32-D103 PolarHBondContact NE2-OD2 2.74Å
33	L	90.5	Very high	91.7	Very high	27 Å²	27	51.4 Å²	51.4	14%	0.141	24%	0.242	C	C	.	.	H	α-helix	trans	-59.7	-34.1	177.4	-69.3	175.2	0	0	0	112.8	V29 L36 L106 F122 F126	V29-L33 HydrophobicContact CG1-CD1 4.11Å; V29-L33 HydrophobicContact CG1-CG 4.44Å; V29-L33 WeakPolarHBondContact O-CG 3.36Å; V29-L33 PolarHBondContact O-N 2.89Å; L33-L36 HydrophobicContact CD2-CD1 4.28Å; L33-L36 PolarHBondContact O-N 2.92Å; L33-L106 HydrophobicContact CD2-CD1 4.46Å; L33-F122 HydrophobicContact CD1-CB 4.47Å; L33-F122 HydrophobicContact CD1-CD1 4.29Å; L33-F122 HydrophobicContact CD1-CD2 3.98Å; L33-F122 HydrophobicContact CD1-CE2 4.26Å; L33-F122 HydrophobicContact CD1-CG 4Å; L33-F122 HydrophobicContact CD2-CD1 4.07Å; L33-F122 HydrophobicContact CD2-CE1 3.83Å; L33-F122 HydrophobicContact CD2-CZ 4.16Å; L33-F126 HydrophobicContact CD2-CE2 4.19Å; L33-F126 HydrophobicContact CD2-CZ 3.99Å
34	R	90.1	Very high	91.8	Very high	184 Å²	184	49.9 Å²	49.9	69%	0.694	23%	0.226	S	C	*	.	H	α-helix	trans	-66.4	-41	174.7	-169.2	-179.1	70.9	150.6	0.2	111.7	R30 E31 H32 L36 C37	R30-R34 WeakPolarHBondContact O-CB 3.49Å; R30-R34 PolarHBondContact O-N 3.35Å; E31-R34 WeakPolarHBondContact O-CB 3.46Å; E31-R34 PolarHBondContact O-N 2.78Å; H32-R34 PolarHBondContact O-N 3.25Å; R34-L36 PolarHBondContact O-N 3.27Å; R34-C37 PolarHBondContact O-N 3.42Å
35	K	89.6	Confident	91.5	Very high	119 Å²	119	50.4 Å²	50.4	52%	0.517	23%	0.234	S	C	.	.	H	α-helix	trans	-63.3	-24.3	177.6	-73	172.5	-178.6	162.7	0	113.1	E31 H32 C37	E31-K35 WeakPolarHBondContact O-CG 3.46Å; E31-K35 PolarHBondContact O-N 3.19Å; E31-K35 WeakPolarHBondContact OE1-CE 3.12Å; E31-K35 IonicContact OE1-NZ 3.3Å; E31-K35 PolarHBondContact OE1-NZ 3.05Å; H32-K35 WeakPolarHBondContact O-CB 3.36Å; H32-K35 PolarHBondContact O-N 2.87Å; K35-C37 PolarHBondContact O-N 3.23Å
36	L	90	Very high	91.2	Very high	4 Å²	4	51 Å²	51	2%	0.021	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-10	175	-60.9	-177.6	0	0	0	113.6	H32 L33 R34 L38 L95 D103 L106	H32-L36 PolarHBondContact O-N 3.08Å; L33-L36 HydrophobicContact CD2-CD1 4.28Å; L33-L36 PolarHBondContact O-N 2.92Å; R34-L36 PolarHBondContact O-N 3.27Å; L36-L38 HydrophobicContact CB-CD1 4.21Å; L36-L38 HydrophobicContact CB-CD2 3.87Å; L36-L38 HydrophobicContact CB-CG 3.69Å; L36-L38 HydrophobicContact CD1-CD1 4.23Å; L36-L38 PolarHBondContact O-N 2.95Å; L36-L38 VanDerWaalsContact O-N 3.09Å; L36-L95 HydrophobicContact CD2-CD2 3.66Å; L36-D103 HydrophobicContact CD1-CB 4.33Å; L36-D103 HydrophobicContact CD2-CB 3.63Å; L36-L106 HydrophobicContact CD1-CD1 4.15Å
37	C	89.9	Confident	90.9	Very high	45 Å²	45	54 Å²	54	30%	0.304	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	36.8	177.7	-72.5	0	0	0	0	113	R34 K35 R39 E40 C43	R34-C37 PolarHBondContact O-N 3.42Å; K35-C37 PolarHBondContact O-N 3.23Å; C37-R39 PolarHBondContact O-N 3.11Å; C37-E40 HydrophobicContact CB-CB 4.16Å; C37-E40 PolarHBondContact O-N 3.12Å; C37-E40 VanDerWaalsContact O-O 3.12Å; C37-E40 PolarHBondContact SG-OE2 2.6Å; C37-C43 WeakPolarHBondContact O-CB 3.48Å
38	L	91.3	Very high	90.6	Very high	8 Å²	8	54.9 Å²	54.9	4%	0.042	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-15.3	-170.9	-59.7	173.2	0	0	0	114.2	L36 G44 L106 R107 A110 I117 F122	L36-L38 HydrophobicContact CB-CD1 4.21Å; L36-L38 HydrophobicContact CB-CD2 3.87Å; L36-L38 HydrophobicContact CB-CG 3.69Å; L36-L38 HydrophobicContact CD1-CD1 4.23Å; L36-L38 PolarHBondContact O-N 2.95Å; L36-L38 VanDerWaalsContact O-N 3.09Å; L38-G44 WeakPolarHBondContact O-CA 3.2Å; L38-G44 PolarHBondContact O-N 2.82Å; L38-L106 HydrophobicContact CD1-CB 4.32Å; L38-L106 HydrophobicContact CD2-CB 4.04Å; L38-R107 HydrophobicContact CD2-CB 4.34Å; L38-R107 HydrophobicContact CD2-CG 3.7Å; L38-A110 HydrophobicContact CB-CB 4.22Å; L38-A110 HydrophobicContact CD2-CB 4.07Å; L38-A110 WeakPolarHBondContact O-CB 3.35Å; L38-I117 HydrophobicContact CB-CG2 3.92Å; L38-I117 HydrophobicContact CD1-CG2 4.14Å; L38-F122 HydrophobicContact CD1-CE1 3.88Å; L38-F122 HydrophobicContact CD1-CZ 3.54Å
39	R	90.8	Very high	90.2	Very high	148 Å²	148	54.5 Å²	54.5	56%	0.558	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	6.5	178	-61.6	-174.4	177.4	164.1	9.3	112.9	C37 I117 D119	C37-R39 PolarHBondContact O-N 3.11Å; R39-I117 PolarHBondContact NH2-O 3.25Å; R39-D119 IonicContact CZ-OD1 3.98Å; R39-D119 IonicContact NH2-OD1 3.6Å; R39-D119 PolarHBondContact NH2-OD1 2.96Å
40	E	91.1	Very high	89.8	Confident	114 Å²	114	58.8 Å²	58.8	53%	0.533	27%	0.273	S	S	.	.	S	Bend	trans	-125.3	157.7	-174.8	-60.2	174	-173.3	0	0	111.1	C37 C43	C37-E40 HydrophobicContact CB-CB 4.16Å; C37-E40 PolarHBondContact O-N 3.12Å; C37-E40 VanDerWaalsContact O-O 3.12Å; C37-E40 PolarHBondContact SG-OE2 2.6Å; E40-C43 CarbonylContact C-O 3.22Å; E40-C43 VanDerWaalsContact C-O 3.22Å; E40-C43 CarbonylContact O-C 3.56Å; E40-C43 WeakPolarHBondContact O-CA 3.29Å; E40-C43 VanDerWaalsContact O-CB 3.27Å; E40-C43 WeakPolarHBondContact O-CB 3.2Å; E40-C43 PolarHBondContact O-N 2.7Å
41	F	91.7	Very high	89.3	Confident	60 Å²	60	56.1 Å²	56.1	26%	0.263	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	134.7	178.5	-176.9	-87.2	0	0	0	111.4	W48 E77 L82 L85 W93	F41-W48 HydrophobicContact CB-CD2 4.36Å; F41-W48 HydrophobicContact CB-CE3 4.29Å; F41-W48 HydrophobicContact CB-CH2 3.73Å; F41-W48 HydrophobicContact CB-CZ2 3.78Å; F41-W48 HydrophobicContact CB-CZ3 3.99Å; F41-W48 HydrophobicContact CD2-CB 4.2Å; F41-W48 AromaticContact CD2-CD1 3.93Å; F41-W48 AromaticContact CD2-CD2 3.49Å; F41-W48 HydrophobicContact CD2-CD2 3.49Å; F41-W48 VanDerWaalsContact CD2-CD2 3.49Å; F41-W48 AromaticContact CD2-CE2 3.76Å; F41-W48 AromaticContact CD2-CE3 3.82Å; F41-W48 HydrophobicContact CD2-CE3 3.82Å; F41-W48 AromaticContact CD2-CG 3.63Å; F41-W48 HydrophobicContact CD2-CG 3.63Å; F41-W48 HydrophobicContact CD2-CZ2 4.34Å; F41-W48 HydrophobicContact CD2-CZ3 4.38Å; F41-W48 HydrophobicContact CE2-CB 4.11Å; F41-W48 HydrophobicContact CE2-CD2 4.29Å; F41-W48 AromaticContact CE2-CG 3.97Å; F41-W48 HydrophobicContact CE2-CG 3.97Å; F41-W48 HydrophobicContact CG-CD2 4.41Å; F41-E77 HydrophobicContact CE2-CG 4.4Å; F41-L82 HydrophobicContact CD2-CD2 4.45Å; F41-L82 HydrophobicContact CE2-CD2 3.71Å; F41-L82 HydrophobicContact CZ-CD2 4.06Å; F41-L85 HydrophobicContact CE1-CD1 3.9Å; F41-L85 HydrophobicContact CZ-CD1 3.73Å; F41-W93 AromaticContact CD1-CE2 3.87Å; F41-W93 HydrophobicContact CD1-CZ2 4.12Å; F41-W93 AromaticContact CD1-NE1 3.62Å; F41-W93 HydrophobicContact CE1-CD2 4.2Å; F41-W93 AromaticContact CE1-CE2 3.58Å; F41-W93 HydrophobicContact CE1-CH2 4.17Å; F41-W93 AromaticContact CE1-CZ2 3.57Å; F41-W93 HydrophobicContact CE1-CZ2 3.57Å; F41-W93 AromaticContact CE1-NE1 3.84Å
42	P	91.3	Very high	88.8	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.013	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	cis	-85	-4.6	6.7	34	-37.2	0	0	0	114.7	L82 L85 V86 W93	P42-L82 HydrophobicContact CB-CD2 3.88Å; P42-L85 HydrophobicContact CB-CB 4.49Å; P42-L85 HydrophobicContact CB-CD1 4.23Å; P42-V86 HydrophobicContact CB-CG2 4.41Å; P42-V86 HydrophobicContact CG-CG2 3.44Å; P42-V86 VanDerWaalsContact CG-CG2 3.44Å; P42-W93 HydrophobicContact CG-CB 4.01Å; P42-W93 HydrophobicContact CG-CG 4.17Å
43	C	91.4	Very high	88.4	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.007	27%	0.267	C	S	.	.	S	Bend	trans	-81.1	-179.2	176	-58.2	0	0	0	0	111.6	C37 E40 W48 A110	C37-C43 WeakPolarHBondContact O-CB 3.48Å; E40-C43 CarbonylContact C-O 3.22Å; E40-C43 VanDerWaalsContact C-O 3.22Å; E40-C43 CarbonylContact O-C 3.56Å; E40-C43 WeakPolarHBondContact O-CA 3.29Å; E40-C43 VanDerWaalsContact O-CB 3.27Å; E40-C43 WeakPolarHBondContact O-CB 3.2Å; E40-C43 PolarHBondContact O-N 2.7Å; C43-W48 WeakPolarHBondContact O-CZ2 3.29Å; C43-A110 HydrophobicContact CB-CB 3.83Å
44	G	89.4	Confident	87.6	Confident	2 Å²	2	58 Å²	58	2%	0.021	28%	0.278	C	S	.	.	S	Bend	trans	72.6	-179.7	169.4	0	0	0	0	0	114.7	L38 N49 A110	L38-G44 WeakPolarHBondContact O-CA 3.2Å; L38-G44 PolarHBondContact O-N 2.82Å; G44-N49 PolarHBondContact O-ND2 3.26Å; G44-A110 PolarHBondContact N-O 3.28Å
45	A	89	Confident	86.3	Confident	41 Å²	41	54 Å²	54	34%	0.339	28%	0.276	S	S	.	.	S	Bend	trans	-97.8	130.8	174.2	0	0	0	0	0	109.5	F53 P114	A45-F53 HydrophobicContact CB-CB 4.22Å; A45-P114 HydrophobicContact CB-CB 4.21Å; A45-P114 HydrophobicContact CB-CG 4.13Å
46	G	88.1	Confident	84.9	Confident	12 Å²	12	54 Å²	54	12%	0.124	28%	0.278	C	S	.	.	S	Bend	trans	-165.1	-164.2	-174.4	0	0	0	0	0	113.4	W48 N49 K50	G46-W48 PolarHBondContact O-N 3.27Å; G46-N49 PolarHBondContact N-OD1 3.2Å; G46-N49 PolarHBondContact O-N 2.99Å; G46-N49 PolarHBondContact O-OD1 2.79Å; G46-N49 VanDerWaalsContact O-OD1 3.12Å; G46-K50 WeakPolarHBondContact O-CG 2.99Å; G46-K50 PolarHBondContact O-N 2.79Å
47	S	87.1	Confident	83.1	Confident	68 Å²	68	59.5 Å²	59.5	48%	0.476	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-19.3	-176.7	58	0	0	0	0	115.2	K50	S47-K50 VanDerWaalsContact CA-CE 3.47Å; S47-K50 WeakPolarHBondContact O-CG 3.39Å
48	W	88.3	Confident	81	Confident	44 Å²	44	69.2 Å²	69.2	17%	0.167	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-7.2	-178	51.8	95	0	0	0	113.8	F41 C43 G46 E76 E77	F41-W48 HydrophobicContact CB-CD2 4.36Å; F41-W48 HydrophobicContact CB-CE3 4.29Å; F41-W48 HydrophobicContact CB-CH2 3.73Å; F41-W48 HydrophobicContact CB-CZ2 3.78Å; F41-W48 HydrophobicContact CB-CZ3 3.99Å; F41-W48 HydrophobicContact CD2-CB 4.2Å; F41-W48 AromaticContact CD2-CD1 3.93Å; F41-W48 AromaticContact CD2-CD2 3.49Å; F41-W48 HydrophobicContact CD2-CD2 3.49Å; F41-W48 VanDerWaalsContact CD2-CD2 3.49Å; F41-W48 AromaticContact CD2-CE2 3.76Å; F41-W48 AromaticContact CD2-CE3 3.82Å; F41-W48 HydrophobicContact CD2-CE3 3.82Å; F41-W48 AromaticContact CD2-CG 3.63Å; F41-W48 HydrophobicContact CD2-CG 3.63Å; F41-W48 HydrophobicContact CD2-CZ2 4.34Å; F41-W48 HydrophobicContact CD2-CZ3 4.38Å; F41-W48 HydrophobicContact CE2-CB 4.11Å; F41-W48 HydrophobicContact CE2-CD2 4.29Å; F41-W48 AromaticContact CE2-CG 3.97Å; F41-W48 HydrophobicContact CE2-CG 3.97Å; F41-W48 HydrophobicContact CG-CD2 4.41Å; C43-W48 WeakPolarHBondContact O-CZ2 3.29Å; G46-W48 PolarHBondContact O-N 3.27Å; W48-E76 WeakPolarHBondContact O-CA 3.42Å; W48-E77 HydrophobicContact CB-CG 4.26Å; W48-E77 PolarHBondContact O-N 3.23Å
49	N	86.8	Confident	79	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	37%	0.374	C	S	.	.	S	Bend	trans	-145.3	30.8	-179.7	63.1	6.3	0	0	0	113	G44 G46 S51 R52 F53	G44-N49 PolarHBondContact O-ND2 3.26Å; G46-N49 PolarHBondContact N-OD1 3.2Å; G46-N49 PolarHBondContact O-N 2.99Å; G46-N49 PolarHBondContact O-OD1 2.79Å; G46-N49 VanDerWaalsContact O-OD1 3.12Å; N49-S51 PolarHBondContact O-N 3.04Å; N49-R52 VanDerWaalsContact CB-NH2 3.34Å; N49-R52 PolarHBondContact O-N 3.22Å; N49-R52 VanDerWaalsContact O-N 3.14Å; N49-F53 HydrophobicContact CB-CD2 4.12Å; N49-F53 HydrophobicContact CB-CE2 4.39Å; N49-F53 PolarHBondContact O-N 3.21Å
50	K	84.1	Confident	76.6	Confident	102 Å²	102	76.5 Å²	76.5	44%	0.443	38%	0.384	S	S	.	.	H	α-helix	trans	-60.1	-44.9	-172.4	-60.2	-177.9	146.5	145.6	0	112.5	G46 S47 R52 F53 L54 E76	G46-K50 WeakPolarHBondContact O-CG 2.99Å; G46-K50 PolarHBondContact O-N 2.79Å; S47-K50 VanDerWaalsContact CA-CE 3.47Å; S47-K50 WeakPolarHBondContact O-CG 3.39Å; K50-R52 PolarHBondContact O-N 3.15Å; K50-R52 VanDerWaalsContact O-N 3.12Å; K50-F53 PolarHBondContact O-N 3.29Å; K50-L54 HydrophobicContact CB-CB 4.37Å; K50-L54 HydrophobicContact CB-CD1 3.99Å; K50-L54 HydrophobicContact CB-CG 4.41Å; K50-L54 HydrophobicContact CD-CD1 4.17Å; K50-L54 HydrophobicContact CG-CD1 3.58Å; K50-L54 HydrophobicContact CG-CG 4.43Å; K50-L54 PolarHBondContact O-N 3.33Å; K50-E76 PolarHBondContact N-OE1 2.86Å
51	S	82.5	Confident	74.2	Confident	62 Å²	62	82.8 Å²	82.8	43%	0.434	40%	0.403	S	S	.	.	H	α-helix	trans	-55.6	-26.8	178.2	60.3	0	0	0	0	113.8	N49 E76	N49-S51 PolarHBondContact O-N 3.04Å; S51-E76 VanDerWaalsContact CB-OE1 3.25Å; S51-E76 WeakPolarHBondContact CB-OE1 3.47Å; S51-E76 VanDerWaalsContact CB-OE2 3.25Å; S51-E76 WeakPolarHBondContact CB-OE2 3.5Å; S51-E76 PolarHBondContact N-OE1 2.89Å; S51-E76 PolarHBondContact OG-OE1 3.26Å; S51-E76 PolarHBondContact OG-OE2 2.99Å
52	R	81.5	Confident	71.7	Confident	89 Å²	89	91.6 Å²	91.6	34%	0.336	43%	0.434	S	S	.	.	H	α-helix	trans	-90.1	-32	-178.3	-61.4	-167.1	-64.8	-114	3.9	113.6	N49 K50 E77	N49-R52 VanDerWaalsContact CB-NH2 3.34Å; N49-R52 PolarHBondContact O-N 3.22Å; N49-R52 VanDerWaalsContact O-N 3.14Å; K50-R52 PolarHBondContact O-N 3.15Å; K50-R52 VanDerWaalsContact O-N 3.12Å; R52-E77 PolarHBondContact NH1-O 3.33Å; R52-E77 VanDerWaalsContact NH1-O 3.09Å; R52-E77 PolarHBondContact NH2-O 2.81Å
53	F	81.8	Confident	69.6	Low	41 Å²	41	99.5 Å²	99.5	18%	0.18	47%	0.471	C	S	.	.	H	α-helix	trans	-138.1	-13.5	-163.9	-55.3	-63.5	0	0	0	116.4	A45 N49 K50 R112 P114 L115	A45-F53 HydrophobicContact CB-CB 4.22Å; N49-F53 HydrophobicContact CB-CD2 4.12Å; N49-F53 HydrophobicContact CB-CE2 4.39Å; N49-F53 PolarHBondContact O-N 3.21Å; K50-F53 PolarHBondContact O-N 3.29Å; F53-R112 WeakPolarHBondContact CZ-O 3.23Å; F53-P114 HydrophobicContact CB-CG 4.44Å; F53-P114 HydrophobicContact CD1-CG 4.05Å; F53-P114 HydrophobicContact CD2-CG 3.56Å; F53-P114 HydrophobicContact CE1-CG 4.19Å; F53-P114 HydrophobicContact CE2-CG 3.7Å; F53-P114 HydrophobicContact CG-CG 3.75Å; F53-P114 VanDerWaalsContact CZ-CD 3.48Å; F53-P114 HydrophobicContact CZ-CG 4.04Å; F53-L115 HydrophobicContact CD1-CD1 4.35Å; F53-L115 HydrophobicContact CD1-CG 4.44Å
54	L	73.4	Confident	67.1	Low	71 Å²	71	107.9 Å²	107.9	37%	0.372	51%	0.514	S	S	.	.	S	Bend	trans	-96.2	141.8	177.2	-68.1	-176	0	0	0	111.1	K50 Q56	K50-L54 HydrophobicContact CB-CB 4.37Å; K50-L54 HydrophobicContact CB-CD1 3.99Å; K50-L54 HydrophobicContact CB-CG 4.41Å; K50-L54 HydrophobicContact CD-CD1 4.17Å; K50-L54 HydrophobicContact CG-CD1 3.58Å; K50-L54 HydrophobicContact CG-CG 4.43Å; K50-L54 PolarHBondContact O-N 3.33Å; L54-Q56 PolarHBondContact O-N 2.97Å
55	P	64.3	Low	64.7	Low	101 Å²	101	114.3 Å²	114.3	66%	0.656	55%	0.553	S	S	*	*			trans	-65.3	128.8	179.2	22.9	-30	0	0	0	111.5	T57	P55-T57 HydrophobicContact CB-CG2 4.41Å; P55-T57 PolarHBondContact O-N 3.01Å
56	Q	59.5	Low	62.4	Low	120 Å²	120	118.1 Å²	118.1	56%	0.561	58%	0.575	S	S	*	*			trans	-71.4	69.1	175.2	-124.4	87.4	-10.3	0	0	110.9	L54 W58	L54-Q56 PolarHBondContact O-N 2.97Å; Q56-W58 PolarHBondContact O-N 3.09Å
57	T	51.5	Low	60.9	Low	119 Å²	119	127.3 Å²	127.3	73%	0.73	61%	0.611	S	S	*	*			trans	-76.6	20.9	-179.6	44.6	0	0	0	0	114.9	P55	P55-T57 HydrophobicContact CB-CG2 4.41Å; P55-T57 PolarHBondContact O-N 3.01Å
58	W	46.1	Very low	58.5	Low	248 Å²	248	133.3 Å²	133.3	94%	0.939	63%	0.631	S	S	*	*			trans	-145.6	69.6	169.4	-85	-23.1	0	0	0	113.5	Q56	Q56-W58 PolarHBondContact O-N 3.09Å
59	R	48.5	Very low	56.3	Low	186 Å²	186	139.6 Å²	139.6	70%	0.702	66%	0.663	S	S	*	*			trans	-138.9	80	154.4	-70.8	-163.2	-175.8	-167.5	5	110.3
60	T	40.5	Very low	54.5	Low	124 Å²	124	147.6 Å²	147.6	76%	0.761	71%	0.706	S	S	*	*	S	Bend	trans	-133.1	5.4	164.8	5.7	0	0	0	0	114.5
61	W	41	Very low	52.8	Low	246 Å²	246	148.9 Å²	148.9	93%	0.932	72%	0.721	S	S	*	*	S	Bend	trans	-141.1	11.3	179.2	-73.5	99.6	0	0	0	116.5
62	R	39.6	Very low	51.5	Low	244 Å²	244	149.6 Å²	149.6	92%	0.921	72%	0.723	S	S	*	*			trans	-139.3	68.8	174.1	-93.5	-164	-79.3	-115.7	-0.1	111.9
63	E	46.8	Very low	50.7	Low	169 Å²	169	148.4 Å²	148.4	79%	0.79	73%	0.728	S	S	*	*			trans	-117.5	90.9	157.9	-83.2	-170.9	161.3	0	0	108.5
64	L	40.3	Very low	49.7	Very low	176 Å²	176	153.4 Å²	153.4	92%	0.921	77%	0.765	S	S	*	*			trans	-154.4	41.9	159.3	-81	-171.9	0	0	0	111.4
65	V	38.1	Very low	49.6	Very low	137 Å²	137	152.7 Å²	152.7	83%	0.83	78%	0.775	S	S	*	*	S	Bend	trans	-141.5	128.6	163.9	-174	0	0	0	0	109.3
66	P	41.5	Very low	50.6	Low	122 Å²	122	149.1 Å²	149.1	79%	0.792	75%	0.75	S	S	*	*			trans	-78	134.3	-177.1	29	-30.5	0	0	0	112.7
67	K	55	Low	51.9	Low	204 Å²	204	147.2 Å²	147.2	89%	0.887	74%	0.741	S	S	*	*			trans	10.5	118.4	163.7	-85.6	-177	167.3	-174.7	0	119
68	E	37.7	Very low	53.7	Low	194 Å²	194	144.7 Å²	144.7	91%	0.907	73%	0.725	S	S	*	*			trans	-120.1	141.3	132.9	-88.8	-178.4	161.6	0	0	108.3
69	E	42.6	Very low	55.8	Low	177 Å²	177	134.4 Å²	134.4	83%	0.827	69%	0.69	S	S	*	*			trans	-58.9	158.2	-174.2	-70.2	173.4	145.1	0	0	113	V71	E69-V71 VanDerWaalsContact C-N 3.32Å; E69-V71 PolarHBondContact O-N 3.24Å
70	D	47.8	Very low	57.8	Low	168 Å²	168	132.1 Å²	132.1	90%	0.898	69%	0.687	S	S	*	*			trans	-46.7	79.5	-177.1	-65	-56.2	0	0	0	114.6	V72	D70-V72 PolarHBondContact O-N 2.92Å; D70-V72 VanDerWaalsContact O-N 3.16Å
71	V	49.5	Very low	60.2	Low	128 Å²	128	127.9 Å²	127.9	78%	0.776	66%	0.664	S	S	*	*			trans	-75.4	103.3	161.4	-177	0	0	0	0	106	E69 S73	E69-V71 VanDerWaalsContact C-N 3.32Å; E69-V71 PolarHBondContact O-N 3.24Å; V71-S73 PolarHBondContact O-N 3.14Å; V71-S73 VanDerWaalsContact O-N 3.11Å
72	V	55	Low	62.6	Low	78 Å²	78	116.1 Å²	116.1	47%	0.473	62%	0.62	S	S	.	*			trans	-40.2	121.5	166.6	176.6	0	0	0	0	107.4	D70 E76	D70-V72 PolarHBondContact O-N 2.92Å; D70-V72 VanDerWaalsContact O-N 3.16Å; V72-E76 HydrophobicContact CG1-CB 3.54Å
73	S	64.2	Low	65.1	Low	63 Å²	63	105 Å²	105	44%	0.441	58%	0.579	S	S	.	*			trans	-51	137.2	-177.1	-54.2	0	0	0	0	108.5	V71 G75 E76	V71-S73 PolarHBondContact O-N 3.14Å; V71-S73 VanDerWaalsContact O-N 3.11Å; S73-G75 PolarHBondContact O-N 2.76Å; S73-E76 WeakPolarHBondContact O-CB 3.27Å; S73-E76 PolarHBondContact O-N 2.93Å
74	P	61.2	Low	67.2	Low	146 Å²	146	98.7 Å²	98.7	95%	0.948	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	0.8	-171.7	18.5	-30.6	0	0	0	116.2
75	G	71	Confident	69.7	Low	57 Å²	57	92.4 Å²	92.4	59%	0.588	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	12.3	170.6	0	0	0	0	0	114.4	S73	S73-G75 PolarHBondContact O-N 2.76Å
76	E	84.6	Confident	72.2	Confident	26 Å²	26	86.6 Å²	86.6	12%	0.121	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-101.8	138.7	175	-74.8	-175.7	172.2	0	0	111.2	W48 K50 S51 V72 S73	W48-E76 WeakPolarHBondContact O-CA 3.42Å; K50-E76 PolarHBondContact N-OE1 2.86Å; S51-E76 VanDerWaalsContact CB-OE1 3.25Å; S51-E76 WeakPolarHBondContact CB-OE1 3.47Å; S51-E76 VanDerWaalsContact CB-OE2 3.25Å; S51-E76 WeakPolarHBondContact CB-OE2 3.5Å; S51-E76 PolarHBondContact N-OE1 2.89Å; S51-E76 PolarHBondContact OG-OE1 3.26Å; S51-E76 PolarHBondContact OG-OE2 2.99Å; V72-E76 HydrophobicContact CG1-CB 3.54Å; S73-E76 WeakPolarHBondContact O-CB 3.27Å; S73-E76 PolarHBondContact O-N 2.93Å
77	E	86.8	Confident	74.5	Confident	80 Å²	80	87.4 Å²	87.4	37%	0.374	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-97.3	137.8	-179	-66.1	-69.4	171.9	0	0	110.5	F41 W48 R52 L82	F41-E77 HydrophobicContact CE2-CG 4.4Å; W48-E77 HydrophobicContact CB-CG 4.26Å; W48-E77 PolarHBondContact O-N 3.23Å; R52-E77 PolarHBondContact NH1-O 3.33Å; R52-E77 VanDerWaalsContact NH1-O 3.09Å; R52-E77 PolarHBondContact NH2-O 2.81Å; E77-L82 HydrophobicContact CB-CD1 4.17Å; E77-L82 HydrophobicContact CB-CD2 3.67Å; E77-L82 HydrophobicContact CB-CG 3.73Å; E77-L82 HydrophobicContact CG-CD2 4.07Å
78	T	89.6	Confident	76.1	Confident	65 Å²	65	80.1 Å²	80.1	40%	0.399	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-66.6	155.1	172.9	64.9	0	0	0	0	110.3	E80 A81 L82	T78-E80 PolarHBondContact O-N 3.43Å; T78-A81 PolarHBondContact O-N 3.25Å; T78-A81 VanDerWaalsContact OG1-CB 3.29Å; T78-A81 WeakPolarHBondContact OG1-CB 3.36Å; T78-A81 PolarHBondContact OG1-N 3.45Å; T78-A81 VanDerWaalsContact OG1-N 3.17Å; T78-L82 WeakPolarHBondContact O-CG 3.2Å; T78-L82 PolarHBondContact O-N 3.06Å; T78-L82 VanDerWaalsContact O-N 3.12Å
79	V	90.1	Very high	78.3	Confident	33 Å²	33	76 Å²	76	20%	0.2	44%	0.442	C	S	.	.	H	α-helix	trans	-61	-38.8	178.2	177.4	0	0	0	0	109.9	L82 L83 I111 R112	V79-L82 PolarHBondContact O-N 3.28Å; V79-L83 HydrophobicContact CG1-CD1 3.81Å; V79-L83 HydrophobicContact CG1-CG 4.2Å; V79-L83 WeakPolarHBondContact O-CB 3.27Å; V79-L83 VanDerWaalsContact O-CG 3.22Å; V79-L83 WeakPolarHBondContact O-CG 3.49Å; V79-L83 PolarHBondContact O-N 3.4Å; V79-I111 HydrophobicContact CG1-CG2 4.25Å; V79-R112 HydrophobicContact CG1-CG 4.27Å
80	E	91.3	Very high	80.3	Confident	138 Å²	138	76 Å²	76	65%	0.645	44%	0.442	S	S	*	.	H	α-helix	trans	-64.6	-39	178.7	-65.9	66.4	-145.7	0	0	112	T78 G84	T78-E80 PolarHBondContact O-N 3.43Å; E80-G84 PolarHBondContact O-N 3.43Å
81	A	91	Very high	82.2	Confident	34 Å²	34	68.8 Å²	68.8	28%	0.281	41%	0.405	S	S	.	.	H	α-helix	trans	-64.3	-50.4	175.1	0	0	0	0	0	111.1	T78 L83 G84 L85	T78-A81 PolarHBondContact O-N 3.25Å; T78-A81 VanDerWaalsContact OG1-CB 3.29Å; T78-A81 WeakPolarHBondContact OG1-CB 3.36Å; T78-A81 PolarHBondContact OG1-N 3.45Å; T78-A81 VanDerWaalsContact OG1-N 3.17Å; A81-L83 PolarHBondContact O-N 3.06Å; A81-G84 WeakPolarHBondContact O-CA 3.3Å; A81-G84 PolarHBondContact O-N 2.86Å; A81-L85 WeakPolarHBondContact O-CG 3.47Å; A81-L85 PolarHBondContact O-N 3.34Å
82	L	91.5	Very high	84	Confident	0 Å²	0	68 Å²	68	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-61.2	-41.8	178.2	-64.8	173.6	0	0	0	112.3	F41 P42 E77 T78 V79 G84 L85 V86 I111	F41-L82 HydrophobicContact CD2-CD2 4.45Å; F41-L82 HydrophobicContact CE2-CD2 3.71Å; F41-L82 HydrophobicContact CZ-CD2 4.06Å; P42-L82 HydrophobicContact CB-CD2 3.88Å; E77-L82 HydrophobicContact CB-CD1 4.17Å; E77-L82 HydrophobicContact CB-CD2 3.67Å; E77-L82 HydrophobicContact CB-CG 3.73Å; E77-L82 HydrophobicContact CG-CD2 4.07Å; T78-L82 WeakPolarHBondContact O-CG 3.2Å; T78-L82 PolarHBondContact O-N 3.06Å; T78-L82 VanDerWaalsContact O-N 3.12Å; V79-L82 PolarHBondContact O-N 3.28Å; L82-G84 VanDerWaalsContact C-N 3.32Å; L82-L85 HydrophobicContact CD2-CD1 4.48Å; L82-L85 WeakPolarHBondContact O-CB 3.39Å; L82-L85 PolarHBondContact O-N 3.41Å; L82-V86 PolarHBondContact O-N 3.26Å; L82-I111 HydrophobicContact CB-CD1 4.25Å; L82-I111 HydrophobicContact CB-CG1 4.45Å; L82-I111 HydrophobicContact CB-CG2 3.71Å; L82-I111 HydrophobicContact CD1-CG2 4.1Å
83	L	92.6	Very high	85.4	Confident	10 Å²	10	69 Å²	69	5%	0.052	40%	0.398	C	S	.	.	H	α-helix	trans	-64.2	-38.3	173.6	-71.9	174.1	0	0	0	111.4	V79 A81 L85 V86 R87 E108 I111	V79-L83 HydrophobicContact CG1-CD1 3.81Å; V79-L83 HydrophobicContact CG1-CG 4.2Å; V79-L83 WeakPolarHBondContact O-CB 3.27Å; V79-L83 VanDerWaalsContact O-CG 3.22Å; V79-L83 WeakPolarHBondContact O-CG 3.49Å; V79-L83 PolarHBondContact O-N 3.4Å; A81-L83 PolarHBondContact O-N 3.06Å; L83-L85 VanDerWaalsContact C-N 3.29Å; L83-L85 PolarHBondContact O-N 2.92Å; L83-V86 PolarHBondContact O-N 3.27Å; L83-R87 VanDerWaalsContact O-CB 3.29Å; L83-R87 WeakPolarHBondContact O-CB 3.49Å; L83-R87 WeakPolarHBondContact O-CD 3.41Å; L83-R87 WeakPolarHBondContact O-CG 3.28Å; L83-R87 PolarHBondContact O-N 2.99Å; L83-E108 HydrophobicContact CD2-CB 3.93Å; L83-E108 HydrophobicContact CD2-CG 3.71Å; L83-I111 HydrophobicContact CD2-CB 4.38Å; L83-I111 HydrophobicContact CD2-CD1 4.08Å; L83-I111 HydrophobicContact CD2-CG2 4.29Å; L83-I111 HydrophobicContact CG-CG2 4.27Å
84	G	91	Very high	86.3	Confident	37 Å²	37	67.5 Å²	67.5	38%	0.381	39%	0.39	S	S	.	.	H	α-helix	trans	-58.8	-39.5	173.8	0	0	0	0	0	112.7	E80 A81 L82 S88	E80-G84 PolarHBondContact O-N 3.43Å; A81-G84 WeakPolarHBondContact O-CA 3.3Å; A81-G84 PolarHBondContact O-N 2.86Å; L82-G84 VanDerWaalsContact C-N 3.32Å; G84-S88 VanDerWaalsContact O-CB 3.29Å; G84-S88 WeakPolarHBondContact O-CB 3.49Å; G84-S88 PolarHBondContact O-N 3.2Å; G84-S88 VanDerWaalsContact O-N 3.08Å
85	L	91.5	Very high	87.2	Confident	44 Å²	44	62.4 Å²	62.4	23%	0.23	35%	0.354	C	S	.	.	H	α-helix	trans	-64.9	-36.8	176.1	-62.6	-178.3	0	0	0	112.8	F41 P42 A81 L82 L83 S91 W93	F41-L85 HydrophobicContact CE1-CD1 3.9Å; F41-L85 HydrophobicContact CZ-CD1 3.73Å; P42-L85 HydrophobicContact CB-CB 4.49Å; P42-L85 HydrophobicContact CB-CD1 4.23Å; A81-L85 WeakPolarHBondContact O-CG 3.47Å; A81-L85 PolarHBondContact O-N 3.34Å; L82-L85 HydrophobicContact CD2-CD1 4.48Å; L82-L85 WeakPolarHBondContact O-CB 3.39Å; L82-L85 PolarHBondContact O-N 3.41Å; L83-L85 VanDerWaalsContact C-N 3.29Å; L83-L85 PolarHBondContact O-N 2.92Å; L85-S91 WeakPolarHBondContact O-CB 3.43Å; L85-S91 PolarHBondContact O-OG 3.37Å; L85-W93 HydrophobicContact CB-CE3 3.95Å; L85-W93 HydrophobicContact CD1-CD2 4.36Å; L85-W93 HydrophobicContact CD1-CE3 3.82Å; L85-W93 HydrophobicContact CD1-CH2 4.49Å; L85-W93 HydrophobicContact CD1-CZ3 3.89Å; L85-W93 HydrophobicContact CD2-CE3 3.69Å; L85-W93 HydrophobicContact CD2-CZ3 3.6Å; L85-W93 HydrophobicContact CG-CE3 4.01Å; L85-W93 HydrophobicContact CG-CZ3 4.23Å
86	V	90.2	Very high	87.2	Confident	14 Å²	14	66.3 Å²	66.3	9%	0.085	36%	0.361	C	S	.	.	H	α-helix	trans	-82.6	-31.9	-179.7	174.8	0	0	0	0	112.4	P42 L82 L83 R107 I111	P42-V86 HydrophobicContact CB-CG2 4.41Å; P42-V86 HydrophobicContact CG-CG2 3.44Å; P42-V86 VanDerWaalsContact CG-CG2 3.44Å; L82-V86 PolarHBondContact O-N 3.26Å; L83-V86 PolarHBondContact O-N 3.27Å; V86-R107 HydrophobicContact CG1-CB 4.01Å; V86-I111 HydrophobicContact CB-CD1 4.26Å; V86-I111 HydrophobicContact CG2-CD1 3.59Å
87	R	89.8	Confident	86.1	Confident	140 Å²	140	73.1 Å²	73.1	53%	0.528	40%	0.398	S	S	.	.	H	α-helix	trans	-82.3	-26.5	-177	-71.1	170.6	175.3	-177.5	-5.9	114.2	L83 P89 E108 R112	L83-R87 VanDerWaalsContact O-CB 3.29Å; L83-R87 WeakPolarHBondContact O-CB 3.49Å; L83-R87 WeakPolarHBondContact O-CD 3.41Å; L83-R87 WeakPolarHBondContact O-CG 3.28Å; L83-R87 PolarHBondContact O-N 2.99Å; R87-P89 WeakPolarHBondContact O-CD 3.37Å; R87-E108 IonicContact CZ-OE1 2.97Å; R87-E108 VanDerWaalsContact CZ-OE1 3.28Å; R87-E108 IonicContact CZ-OE2 3.28Å; R87-E108 IonicContact NE-OE1 3.31Å; R87-E108 PolarHBondContact NE-OE1 3.31Å; R87-E108 VanDerWaalsContact NH2-CD 3.27Å; R87-E108 IonicContact NH2-OE1 3.01Å; R87-E108 PolarHBondContact NH2-OE1 3.28Å; R87-E108 IonicContact NH2-OE2 2.92Å; R87-E108 PolarHBondContact NH2-OE2 2.94Å; R87-R112 VanDerWaalsContact NH2-NH2 3.12Å
88	S	88.8	Confident	85	Confident	50 Å²	50	76.9 Å²	76.9	35%	0.35	42%	0.421	S	S	.	.			trans	-75.7	121.3	-177.5	179.1	0	0	0	0	110.5	G84 H90 S91 A94	G84-S88 VanDerWaalsContact O-CB 3.29Å; G84-S88 WeakPolarHBondContact O-CB 3.49Å; G84-S88 PolarHBondContact O-N 3.2Å; G84-S88 VanDerWaalsContact O-N 3.08Å; S88-H90 PolarHBondContact O-N 2.79Å; S88-S91 WeakPolarHBondContact O-CB 3.35Å; S88-S91 PolarHBondContact O-N 2.97Å; S88-A94 WeakPolarHBondContact O-CB 3.42Å
89	P	84	Confident	84.2	Confident	107 Å²	107	75.6 Å²	75.6	70%	0.695	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.6	-178.2	-21.8	32	0	0	0	113.9	R87 S91	R87-P89 WeakPolarHBondContact O-CD 3.37Å; P89-S91 VanDerWaalsContact C-N 3.31Å
90	H	84.8	Confident	83.8	Confident	178 Å²	178	77.4 Å²	77.4	82%	0.824	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	3.7	-178.7	-53.5	89.6	0	0	0	112.4	S88	S88-H90 PolarHBondContact O-N 2.79Å
91	S	88.4	Confident	83.5	Confident	16 Å²	16	75 Å²	75	11%	0.112	43%	0.427	C	S	.	.	S	Bend	trans	-72.8	141.5	177.5	177.3	0	0	0	0	110.4	L85 S88 P89 W93 A94	L85-S91 WeakPolarHBondContact O-CB 3.43Å; L85-S91 PolarHBondContact O-OG 3.37Å; S88-S91 WeakPolarHBondContact O-CB 3.35Å; S88-S91 PolarHBondContact O-N 2.97Å; P89-S91 VanDerWaalsContact C-N 3.31Å; S91-W93 PolarHBondContact O-N 3.41Å; S91-W93 VanDerWaalsContact O-N 3.12Å; S91-W93 PolarHBondContact OG-N 3.38Å; S91-W93 VanDerWaalsContact OG-N 3.11Å; S91-A94 WeakPolarHBondContact O-CB 3.42Å; S91-A94 PolarHBondContact O-N 3.01Å
92	P	85.8	Confident	83.4	Confident	113 Å²	113	76.2 Å²	76.2	73%	0.734	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-13.3	170.8	29	-34.1	0	0	0	112.4
93	W	85.8	Confident	83.3	Confident	98 Å²	98	76.4 Å²	76.4	37%	0.371	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	11.4	172.7	-56.5	-77.6	0	0	0	113	F41 P42 L85 S91 R107	F41-W93 AromaticContact CD1-CE2 3.87Å; F41-W93 HydrophobicContact CD1-CZ2 4.12Å; F41-W93 AromaticContact CD1-NE1 3.62Å; F41-W93 HydrophobicContact CE1-CD2 4.2Å; F41-W93 AromaticContact CE1-CE2 3.58Å; F41-W93 HydrophobicContact CE1-CH2 4.17Å; F41-W93 AromaticContact CE1-CZ2 3.57Å; F41-W93 HydrophobicContact CE1-CZ2 3.57Å; F41-W93 AromaticContact CE1-NE1 3.84Å; P42-W93 HydrophobicContact CG-CB 4.01Å; P42-W93 HydrophobicContact CG-CG 4.17Å; L85-W93 HydrophobicContact CB-CE3 3.95Å; L85-W93 HydrophobicContact CD1-CD2 4.36Å; L85-W93 HydrophobicContact CD1-CE3 3.82Å; L85-W93 HydrophobicContact CD1-CH2 4.49Å; L85-W93 HydrophobicContact CD1-CZ3 3.89Å; L85-W93 HydrophobicContact CD2-CE3 3.69Å; L85-W93 HydrophobicContact CD2-CZ3 3.6Å; L85-W93 HydrophobicContact CG-CE3 4.01Å; L85-W93 HydrophobicContact CG-CZ3 4.23Å; S91-W93 PolarHBondContact O-N 3.41Å; S91-W93 VanDerWaalsContact O-N 3.12Å; S91-W93 PolarHBondContact OG-N 3.38Å; S91-W93 VanDerWaalsContact OG-N 3.11Å; W93-R107 VanDerWaalsContact O-CZ 3.22Å; W93-R107 PolarHBondContact O-NH1 3.38Å; W93-R107 PolarHBondContact O-NH2 3.29Å
94	A	82.7	Confident	83.2	Confident	32 Å²	32	78.3 Å²	78.3	26%	0.264	44%	0.442	S	S	.	.	S	Bend	trans	-63	148.8	170.4	0	0	0	0	0	110.1	S88 S91	S88-A94 WeakPolarHBondContact O-CB 3.42Å; S91-A94 WeakPolarHBondContact O-CB 3.42Å; S91-A94 PolarHBondContact O-N 3.01Å
95	L	80.3	Confident	83.2	Confident	38 Å²	38	81 Å²	81	20%	0.199	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-66.6	151.6	171.3	-92.6	165.3	0	0	0	110.2	L36 S99 D103 S104	L36-L95 HydrophobicContact CD2-CD2 3.66Å; L95-S99 WeakPolarHBondContact CB-OG 3.36Å; L95-S99 WeakPolarHBondContact CD2-OG 3.13Å; L95-D103 HydrophobicContact CD1-CB 3.98Å; L95-S104 WeakPolarHBondContact CD1-OG 3.26Å
96	L	70.8	Confident	83.3	Confident	139 Å²	139	79 Å²	79	73%	0.728	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-61.9	154.1	173.1	-72.6	162.4	0	0	0	110.1	D98 S99	L96-D98 PolarHBondContact O-N 2.68Å; L96-S99 PolarHBondContact N-OG 3.19Å; L96-S99 VanDerWaalsContact O-CB 3.3Å; L96-S99 WeakPolarHBondContact O-CB 3.46Å; L96-S99 PolarHBondContact O-N 3.01Å; L96-S99 PolarHBondContact O-OG 2.96Å
97	N	61.5	Low	83.4	Confident	169 Å²	169	79 Å²	79	90%	0.904	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-19.6	-174	-74.4	-13.7	0	0	0	114.9	S99	N97-S99 VanDerWaalsContact C-N 3.32Å; N97-S99 PolarHBondContact O-N 3.45Å
98	D	64.3	Low	83.6	Confident	159 Å²	159	74 Å²	74	85%	0.85	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	6.8	179.6	-51.5	-38.1	0	0	0	114	L96	L96-D98 PolarHBondContact O-N 2.68Å
99	S	72.2	Confident	83.8	Confident	39 Å²	39	73.3 Å²	73.3	27%	0.273	41%	0.406	S	S	.	.			trans	-84.1	138.7	-171.9	-49.2	0	0	0	0	112.1	L95 L96 N97	L95-S99 WeakPolarHBondContact CB-OG 3.36Å; L95-S99 WeakPolarHBondContact CD2-OG 3.13Å; L96-S99 PolarHBondContact N-OG 3.19Å; L96-S99 VanDerWaalsContact O-CB 3.3Å; L96-S99 WeakPolarHBondContact O-CB 3.46Å; L96-S99 PolarHBondContact O-N 3.01Å; L96-S99 PolarHBondContact O-OG 2.96Å; N97-S99 VanDerWaalsContact C-N 3.32Å; N97-S99 PolarHBondContact O-N 3.45Å
100	N	81.3	Confident	84.3	Confident	71 Å²	71	68.2 Å²	68.2	38%	0.38	37%	0.373	S	S	.	.			trans	-89.9	174	-175	71.5	37.4	0	0	0	112.2	E102 D103 S104	N100-E102 VanDerWaalsContact C-N 3.26Å; N100-E102 PolarHBondContact O-N 3.03Å; N100-E102 VanDerWaalsContact OD1-CA 3.3Å; N100-E102 WeakPolarHBondContact OD1-CA 3.25Å; N100-E102 VanDerWaalsContact OD1-CB 3.23Å; N100-E102 WeakPolarHBondContact OD1-CB 3.49Å; N100-E102 PolarHBondContact OD1-N 3.38Å; N100-D103 PolarHBondContact N-OD2 3.16Å; N100-D103 WeakPolarHBondContact O-CB 3.44Å; N100-D103 PolarHBondContact O-N 3.46Å; N100-D103 PolarHBondContact OD1-N 3.38Å; N100-D103 PolarHBondContact OD1-OD1 3.48Å; N100-D103 PolarHBondContact OD1-OD2 3.03Å; N100-S104 PolarHBondContact O-N 3.43Å; N100-S104 PolarHBondContact O-OG 3.25Å
101	A	85.8	Confident	84.7	Confident	88 Å²	88	59.8 Å²	59.8	73%	0.727	33%	0.334	S	S	*	.	H	α-helix	trans	-64.6	-30	178.3	0	0	0	0	0	113.1	F105	A101-F105 WeakPolarHBondContact O-CB 3.38Å; A101-F105 PolarHBondContact O-N 2.86Å
102	E	88.1	Confident	84.9	Confident	58 Å²	58	64.3 Å²	64.3	27%	0.271	35%	0.349	S	S	.	.	H	α-helix	trans	-70.2	-39.8	177.6	-173.9	170.2	-147.1	0	0	111.5	N100 S104 F105 L106 Y125 F126	N100-E102 VanDerWaalsContact C-N 3.26Å; N100-E102 PolarHBondContact O-N 3.03Å; N100-E102 VanDerWaalsContact OD1-CA 3.3Å; N100-E102 WeakPolarHBondContact OD1-CA 3.25Å; N100-E102 VanDerWaalsContact OD1-CB 3.23Å; N100-E102 WeakPolarHBondContact OD1-CB 3.49Å; N100-E102 PolarHBondContact OD1-N 3.38Å; E102-S104 VanDerWaalsContact C-N 3.33Å; E102-S104 PolarHBondContact O-N 3.24Å; E102-F105 WeakPolarHBondContact O-CB 3.45Å; E102-F105 PolarHBondContact O-N 3.01Å; E102-L106 HydrophobicContact CG-CD1 4.47Å; E102-L106 WeakPolarHBondContact O-CB 3.09Å; E102-L106 VanDerWaalsContact O-CG 3.31Å; E102-L106 WeakPolarHBondContact O-CG 3.48Å; E102-L106 PolarHBondContact O-N 3.14Å; E102-Y125 HydrophobicContact CG-CE1 4.1Å; E102-Y125 WeakPolarHBondContact OE1-CE1 3.45Å; E102-F126 HydrophobicContact CG-CE1 4.28Å; E102-F126 WeakPolarHBondContact OE1-CD1 3.49Å; E102-F126 WeakPolarHBondContact OE1-CE1 3.44Å
103	D	89.9	Confident	85.2	Confident	5 Å²	5	62 Å²	62	3%	0.027	33%	0.33	C	S	.	.	H	α-helix	trans	-60	-45.3	174.6	-64.9	-26.4	0	0	0	110.9	H32 L36 L95 N100 L106 R107	H32-D103 IonicContact CD2-OD1 2.69Å; H32-D103 IonicContact CE1-OD1 2.8Å; H32-D103 IonicContact CE1-OD2 2.76Å; H32-D103 PolarHBondContact CE1-OD2 2.77Å; H32-D103 IonicContact NE2-OD1 3.2Å; H32-D103 PolarHBondContact NE2-OD1 2.81Å; H32-D103 IonicContact NE2-OD2 3.42Å; H32-D103 PolarHBondContact NE2-OD2 2.74Å; L36-D103 HydrophobicContact CD1-CB 4.33Å; L36-D103 HydrophobicContact CD2-CB 3.63Å; L95-D103 HydrophobicContact CD1-CB 3.98Å; N100-D103 PolarHBondContact N-OD2 3.16Å; N100-D103 WeakPolarHBondContact O-CB 3.44Å; N100-D103 PolarHBondContact O-N 3.46Å; N100-D103 PolarHBondContact OD1-N 3.38Å; N100-D103 PolarHBondContact OD1-OD1 3.48Å; N100-D103 PolarHBondContact OD1-OD2 3.03Å; D103-L106 PolarHBondContact O-N 3.42Å; D103-R107 WeakPolarHBondContact O-CG 3.34Å; D103-R107 PolarHBondContact O-N 3.15Å
104	S	90	Very high	85.4	Confident	50 Å²	50	58 Å²	58	35%	0.35	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-45.1	175.5	-62.2	0	0	0	0	111.1	L95 N100 E102 R107 E108	L95-S104 WeakPolarHBondContact CD1-OG 3.26Å; N100-S104 PolarHBondContact O-N 3.43Å; N100-S104 PolarHBondContact O-OG 3.25Å; E102-S104 VanDerWaalsContact C-N 3.33Å; E102-S104 PolarHBondContact O-N 3.24Å; S104-R107 PolarHBondContact O-N 3.24Å; S104-E108 WeakPolarHBondContact O-CG 3.09Å; S104-E108 PolarHBondContact O-N 3.02Å
105	F	92.1	Very high	85.7	Confident	94 Å²	94	61.7 Å²	61.7	41%	0.412	33%	0.331	S	S	.	.	H	α-helix	trans	-61	-45	176.2	172.4	-97	0	0	0	112.2	A101 E102 R107 E108 L109 Y125	A101-F105 WeakPolarHBondContact O-CB 3.38Å; A101-F105 PolarHBondContact O-N 2.86Å; E102-F105 WeakPolarHBondContact O-CB 3.45Å; E102-F105 PolarHBondContact O-N 3.01Å; F105-R107 VanDerWaalsContact C-N 3.3Å; F105-R107 PolarHBondContact O-N 3.31Å; F105-E108 PolarHBondContact O-N 2.74Å; F105-L109 HydrophobicContact CE1-CD2 4.12Å; F105-L109 HydrophobicContact CZ-CD2 4.44Å; F105-L109 WeakPolarHBondContact O-CB 3.3Å; F105-L109 PolarHBondContact O-N 2.88Å; F105-Y125 VanDerWaalsContact CD1-OH 3.26Å; F105-Y125 WeakPolarHBondContact CD1-OH 3.49Å; F105-Y125 AromaticContact CE1-CE2 3.91Å; F105-Y125 HydrophobicContact CE1-CE2 3.91Å; F105-Y125 AromaticContact CE1-CZ 3.99Å; F105-Y125 WeakPolarHBondContact CE1-OH 3.31Å
106	L	92.8	Very high	86.1	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-61.1	-39.4	178.4	-73.3	175.3	0	0	0	111.6	L33 L36 L38 E102 D103 L109 A110 F121 F122 Y125 F126	L33-L106 HydrophobicContact CD2-CD1 4.46Å; L36-L106 HydrophobicContact CD1-CD1 4.15Å; L38-L106 HydrophobicContact CD1-CB 4.32Å; L38-L106 HydrophobicContact CD2-CB 4.04Å; E102-L106 HydrophobicContact CG-CD1 4.47Å; E102-L106 WeakPolarHBondContact O-CB 3.09Å; E102-L106 VanDerWaalsContact O-CG 3.31Å; E102-L106 WeakPolarHBondContact O-CG 3.48Å; E102-L106 PolarHBondContact O-N 3.14Å; D103-L106 PolarHBondContact O-N 3.42Å; L106-L109 PolarHBondContact O-N 3.44Å; L106-A110 VanDerWaalsContact O-CB 3.3Å; L106-A110 WeakPolarHBondContact O-CB 3.11Å; L106-A110 PolarHBondContact O-N 3.01Å; L106-F121 HydrophobicContact CD2-CE1 3.8Å; L106-F121 HydrophobicContact CD2-CZ 4.19Å; L106-F122 HydrophobicContact CD1-CE1 4.47Å; L106-F122 HydrophobicContact CD2-CE1 4.31Å; L106-Y125 HydrophobicContact CD2-CD1 4.27Å; L106-Y125 HydrophobicContact CD2-CE1 3.81Å; L106-Y125 HydrophobicContact CG-CE1 4.39Å; L106-F126 HydrophobicContact CD1-CE1 4.2Å; L106-F126 HydrophobicContact CD1-CZ 3.8Å
107	R	92.9	Very high	87.1	Confident	14 Å²	14	58 Å²	58	5%	0.053	31%	0.311	C	S	.	.	H	α-helix	trans	-66.5	-43.9	174.3	-69.8	-174	74.5	-157.9	4.9	112.3	L38 V86 W93 D103 S104 F105 L109 A110 I111	L38-R107 HydrophobicContact CD2-CB 4.34Å; L38-R107 HydrophobicContact CD2-CG 3.7Å; V86-R107 HydrophobicContact CG1-CB 4.01Å; W93-R107 VanDerWaalsContact O-CZ 3.22Å; W93-R107 PolarHBondContact O-NH1 3.38Å; W93-R107 PolarHBondContact O-NH2 3.29Å; D103-R107 WeakPolarHBondContact O-CG 3.34Å; D103-R107 PolarHBondContact O-N 3.15Å; S104-R107 PolarHBondContact O-N 3.24Å; F105-R107 VanDerWaalsContact C-N 3.3Å; F105-R107 PolarHBondContact O-N 3.31Å; R107-L109 VanDerWaalsContact C-N 3.32Å; R107-L109 PolarHBondContact O-N 2.95Å; R107-A110 WeakPolarHBondContact O-CB 2.99Å; R107-A110 PolarHBondContact O-N 3.11Å; R107-I111 WeakPolarHBondContact O-CG1 3.3Å; R107-I111 PolarHBondContact O-N 3.08Å
108	E	93.5	Very high	88.5	Confident	35 Å²	35	52.4 Å²	52.4	16%	0.164	28%	0.282	C	S	.	.	H	α-helix	trans	-61.7	-41.1	174.2	-69.9	-159.6	-177.4	0	0	112.2	L83 R87 S104 F105 A110 I111 R112	L83-E108 HydrophobicContact CD2-CB 3.93Å; L83-E108 HydrophobicContact CD2-CG 3.71Å; R87-E108 IonicContact CZ-OE1 2.97Å; R87-E108 VanDerWaalsContact CZ-OE1 3.28Å; R87-E108 IonicContact CZ-OE2 3.28Å; R87-E108 IonicContact NE-OE1 3.31Å; R87-E108 PolarHBondContact NE-OE1 3.31Å; R87-E108 VanDerWaalsContact NH2-CD 3.27Å; R87-E108 IonicContact NH2-OE1 3.01Å; R87-E108 PolarHBondContact NH2-OE1 3.28Å; R87-E108 IonicContact NH2-OE2 2.92Å; R87-E108 PolarHBondContact NH2-OE2 2.94Å; S104-E108 WeakPolarHBondContact O-CG 3.09Å; S104-E108 PolarHBondContact O-N 3.02Å; F105-E108 PolarHBondContact O-N 2.74Å; E108-A110 VanDerWaalsContact C-N 3.32Å; E108-I111 PolarHBondContact O-N 2.92Å; E108-R112 WeakPolarHBondContact O-CG 3.14Å; E108-R112 PolarHBondContact O-N 2.95Å; E108-R112 IonicContact OE2-CZ 2.76Å; E108-R112 VanDerWaalsContact OE2-CZ 3.3Å; E108-R112 IonicContact OE2-NH1 2.93Å; E108-R112 PolarHBondContact OE2-NH1 3.07Å; E108-R112 IonicContact OE2-NH2 3.91Å; E108-R112 PolarHBondContact OE2-NH2 3.44Å
109	L	94.1	Very high	89.6	Confident	37 Å²	37	49 Å²	49	19%	0.194	26%	0.264	C	S	.	.	H	α-helix	trans	-63	-42	176.1	-177.2	63.5	0	0	0	110.7	F105 L106 R107 I111 R112 N113 I117 F121	F105-L109 HydrophobicContact CE1-CD2 4.12Å; F105-L109 HydrophobicContact CZ-CD2 4.44Å; F105-L109 WeakPolarHBondContact O-CB 3.3Å; F105-L109 PolarHBondContact O-N 2.88Å; L106-L109 PolarHBondContact O-N 3.44Å; R107-L109 VanDerWaalsContact C-N 3.32Å; R107-L109 PolarHBondContact O-N 2.95Å; L109-I111 PolarHBondContact O-N 3.25Å; L109-R112 PolarHBondContact O-N 3.45Å; L109-N113 CarbonylContact O-C 3.16Å; L109-N113 PolarHBondContact O-N 3.5Å; L109-I117 HydrophobicContact CD2-CD1 4.02Å; L109-I117 HydrophobicContact CG-CD1 4.1Å; L109-F121 HydrophobicContact CD2-CE1 4.25Å; L109-F121 HydrophobicContact CD2-CE2 4.08Å; L109-F121 HydrophobicContact CD2-CZ 3.55Å
110	A	93.9	Very high	90.6	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.9	-27.4	175.8	0	0	0	0	0	113.1	L38 C43 G44 L106 R107 E108 P114 I117	L38-A110 HydrophobicContact CB-CB 4.22Å; L38-A110 HydrophobicContact CD2-CB 4.07Å; L38-A110 WeakPolarHBondContact O-CB 3.35Å; C43-A110 HydrophobicContact CB-CB 3.83Å; G44-A110 PolarHBondContact N-O 3.28Å; L106-A110 VanDerWaalsContact O-CB 3.3Å; L106-A110 WeakPolarHBondContact O-CB 3.11Å; L106-A110 PolarHBondContact O-N 3.01Å; R107-A110 WeakPolarHBondContact O-CB 2.99Å; R107-A110 PolarHBondContact O-N 3.11Å; E108-A110 VanDerWaalsContact C-N 3.32Å; A110-P114 WeakPolarHBondContact O-CA 3.29Å; A110-P114 VanDerWaalsContact O-CB 3.27Å; A110-P114 WeakPolarHBondContact O-CB 3.35Å; A110-P114 WeakPolarHBondContact O-CD 3.44Å; A110-I117 HydrophobicContact CB-CD1 4.3Å; A110-I117 HydrophobicContact CB-CG1 3.85Å
111	I	93.3	Very high	91.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-76.2	-45.5	173.1	-68.5	166	0	0	0	111.1	V79 L82 L83 V86 R107 E108 L109	V79-I111 HydrophobicContact CG1-CG2 4.25Å; L82-I111 HydrophobicContact CB-CD1 4.25Å; L82-I111 HydrophobicContact CB-CG1 4.45Å; L82-I111 HydrophobicContact CB-CG2 3.71Å; L82-I111 HydrophobicContact CD1-CG2 4.1Å; L83-I111 HydrophobicContact CD2-CB 4.38Å; L83-I111 HydrophobicContact CD2-CD1 4.08Å; L83-I111 HydrophobicContact CD2-CG2 4.29Å; L83-I111 HydrophobicContact CG-CG2 4.27Å; V86-I111 HydrophobicContact CB-CD1 4.26Å; V86-I111 HydrophobicContact CG2-CD1 3.59Å; R107-I111 WeakPolarHBondContact O-CG1 3.3Å; R107-I111 PolarHBondContact O-N 3.08Å; E108-I111 PolarHBondContact O-N 2.92Å; L109-I111 PolarHBondContact O-N 3.25Å
112	R	93	Very high	91.5	Very high	111 Å²	111	46.7 Å²	46.7	42%	0.419	24%	0.238	S	C	.	.	H	α-helix	trans	-75.2	-39.1	-175.3	-69.5	-175.6	-176.4	113.2	10.7	112.9	F53 V79 R87 E108 L109	F53-R112 WeakPolarHBondContact CZ-O 3.23Å; V79-R112 HydrophobicContact CG1-CG 4.27Å; R87-R112 VanDerWaalsContact NH2-NH2 3.12Å; E108-R112 WeakPolarHBondContact O-CG 3.14Å; E108-R112 PolarHBondContact O-N 2.95Å; E108-R112 IonicContact OE2-CZ 2.76Å; E108-R112 VanDerWaalsContact OE2-CZ 3.3Å; E108-R112 IonicContact OE2-NH1 2.93Å; E108-R112 PolarHBondContact OE2-NH1 3.07Å; E108-R112 IonicContact OE2-NH2 3.91Å; E108-R112 PolarHBondContact OE2-NH2 3.44Å; L109-R112 PolarHBondContact O-N 3.45Å
113	N	91.2	Very high	91.7	Very high	65 Å²	65	46.7 Å²	46.7	35%	0.348	24%	0.236	S	C	.	.			trans	-146.1	72.3	-177.1	-164.4	-12.5	0	0	0	111.4	L109 L115 M116	L109-N113 CarbonylContact O-C 3.16Å; L109-N113 PolarHBondContact O-N 3.5Å; N113-L115 PolarHBondContact O-N 2.88Å; N113-M116 HydrophobicContact CB-CG 4.25Å; N113-M116 VanDerWaalsContact CG-CG 3.42Å; N113-M116 VanDerWaalsContact ND2-CG 3.28Å; N113-M116 WeakPolarHBondContact ND2-CG 3.45Å; N113-M116 PolarHBondContact O-N 3.36Å; N113-M116 VanDerWaalsContact O-N 3.15Å
114	P	90.2	Very high	91.8	Very high	13 Å²	13	48.7 Å²	48.7	8%	0.084	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-61	-28.7	-176.1	21.2	-31.9	0	0	0	114	A45 F53 A110 M116 I117	A45-P114 HydrophobicContact CB-CB 4.21Å; A45-P114 HydrophobicContact CB-CG 4.13Å; F53-P114 HydrophobicContact CB-CG 4.44Å; F53-P114 HydrophobicContact CD1-CG 4.05Å; F53-P114 HydrophobicContact CD2-CG 3.56Å; F53-P114 HydrophobicContact CE1-CG 4.19Å; F53-P114 HydrophobicContact CE2-CG 3.7Å; F53-P114 HydrophobicContact CG-CG 3.75Å; F53-P114 VanDerWaalsContact CZ-CD 3.48Å; F53-P114 HydrophobicContact CZ-CG 4.04Å; A110-P114 WeakPolarHBondContact O-CA 3.29Å; A110-P114 VanDerWaalsContact O-CB 3.27Å; A110-P114 WeakPolarHBondContact O-CB 3.35Å; A110-P114 WeakPolarHBondContact O-CD 3.44Å; P114-M116 PolarHBondContact O-N 3.31Å; P114-I117 PolarHBondContact O-N 3.01Å; P114-I117 VanDerWaalsContact O-N 3.14Å
115	L	88.4	Confident	92	Very high	110 Å²	110	49.5 Å²	49.5	58%	0.576	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-68.3	-17.2	-179.2	-61.6	178.5	0	0	0	112.8	F53 N113 I117	F53-L115 HydrophobicContact CD1-CD1 4.35Å; F53-L115 HydrophobicContact CD1-CG 4.44Å; N113-L115 PolarHBondContact O-N 2.88Å; L115-I117 VanDerWaalsContact C-N 3.34Å
116	M	88.9	Confident	92.1	Very high	95 Å²	95	45.5 Å²	45.5	47%	0.468	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-79.7	-15	174.9	-68.6	-88.2	61.4	0	0	113.7	N113 P114 T118 F121	N113-M116 HydrophobicContact CB-CG 4.25Å; N113-M116 VanDerWaalsContact CG-CG 3.42Å; N113-M116 VanDerWaalsContact ND2-CG 3.28Å; N113-M116 WeakPolarHBondContact ND2-CG 3.45Å; N113-M116 PolarHBondContact O-N 3.36Å; N113-M116 VanDerWaalsContact O-N 3.15Å; P114-M116 PolarHBondContact O-N 3.31Å; M116-T118 VanDerWaalsContact C-N 3.26Å; M116-T118 PolarHBondContact O-N 3.04Å; M116-F121 WeakPolarHBondContact O-CB 3.31Å; M116-F121 WeakPolarHBondContact O-CG 3.35Å
117	I	90.9	Very high	92.2	Very high	6 Å²	6	52.6 Å²	52.6	3%	0.031	26%	0.256	C	S	.	.			trans	-83.1	72.5	-175.4	-53.2	-61.8	0	0	0	110.7	L38 R39 L109 A110 P114 L115 F121 F122	L38-I117 HydrophobicContact CB-CG2 3.92Å; L38-I117 HydrophobicContact CD1-CG2 4.14Å; R39-I117 PolarHBondContact NH2-O 3.25Å; L109-I117 HydrophobicContact CD2-CD1 4.02Å; L109-I117 HydrophobicContact CG-CD1 4.1Å; A110-I117 HydrophobicContact CB-CD1 4.3Å; A110-I117 HydrophobicContact CB-CG1 3.85Å; P114-I117 PolarHBondContact O-N 3.01Å; P114-I117 VanDerWaalsContact O-N 3.14Å; L115-I117 VanDerWaalsContact C-N 3.34Å; I117-F121 HydrophobicContact CD1-CD1 4.46Å; I117-F121 HydrophobicContact CD1-CE1 4.21Å; I117-F122 HydrophobicContact CG2-CE1 4.33Å; I117-F122 HydrophobicContact CG2-CE2 4Å; I117-F122 HydrophobicContact CG2-CZ 3.46Å; I117-F122 VanDerWaalsContact CG2-CZ 3.46Å
118	T	90.8	Very high	92.3	Very high	50 Å²	50	53.7 Å²	53.7	31%	0.307	27%	0.265	S	S	.	.			trans	-107.7	164	176	63.7	0	0	0	0	111.5	M116 T120 F121 F122	M116-T118 VanDerWaalsContact C-N 3.26Å; M116-T118 PolarHBondContact O-N 3.04Å; T118-T120 PolarHBondContact O-N 3.15Å; T118-T120 PolarHBondContact OG1-OG1 3.31Å; T118-F121 WeakPolarHBondContact O-CB 3.43Å; T118-F121 PolarHBondContact O-N 3.5Å; T118-F121 VanDerWaalsContact O-N 3.11Å; T118-F121 PolarHBondContact OG1-N 3.06Å; T118-F121 VanDerWaalsContact OG1-N 3.15Å; T118-F122 VanDerWaalsContact O-CD2 3.25Å; T118-F122 WeakPolarHBondContact O-CD2 3.42Å; T118-F122 PolarHBondContact O-N 3.15Å
119	D	89.4	Confident	92.4	Very high	87 Å²	87	52.5 Å²	52.5	47%	0.465	26%	0.26	S	S	.	.	H	α-helix	trans	-63.7	-36.7	177.1	-56.7	-2.9	0	0	0	110.8	R39 F121 F122 Y123	R39-D119 IonicContact CZ-OD1 3.98Å; R39-D119 IonicContact NH2-OD1 3.6Å; R39-D119 PolarHBondContact NH2-OD1 2.96Å; D119-F121 VanDerWaalsContact C-N 3.31Å; D119-F121 PolarHBondContact O-N 3.01Å; D119-F122 PolarHBondContact O-N 3.38Å; D119-Y123 HydrophobicContact CB-CE2 4.07Å; D119-Y123 WeakPolarHBondContact O-CD2 3.39Å; D119-Y123 VanDerWaalsContact O-CG 3.24Å; D119-Y123 PolarHBondContact O-N 2.99Å; D119-Y123 VanDerWaalsContact O-N 3.08Å
120	T	91.8	Very high	92.4	Very high	99 Å²	99	59.3 Å²	59.3	61%	0.607	28%	0.283	S	S	*	.	H	α-helix	trans	-63.1	-33.4	173.2	51.9	0	0	0	0	113.5	T118 S124	T118-T120 PolarHBondContact O-N 3.15Å; T118-T120 PolarHBondContact OG1-OG1 3.31Å; T120-S124 PolarHBondContact O-N 3.33Å; T120-S124 PolarHBondContact O-OG 3.28Å
121	F	93.4	Very high	92.4	Very high	37 Å²	37	59.7 Å²	59.7	16%	0.162	29%	0.286	C	S	.	.	H	α-helix	trans	-62.4	-52.3	172.2	164.2	-95.6	0	0	0	109.9	L106 L109 M116 I117 T118 D119 Y123 S124 Y125	L106-F121 HydrophobicContact CD2-CE1 3.8Å; L106-F121 HydrophobicContact CD2-CZ 4.19Å; L109-F121 HydrophobicContact CD2-CE1 4.25Å; L109-F121 HydrophobicContact CD2-CE2 4.08Å; L109-F121 HydrophobicContact CD2-CZ 3.55Å; M116-F121 WeakPolarHBondContact O-CB 3.31Å; M116-F121 WeakPolarHBondContact O-CG 3.35Å; I117-F121 HydrophobicContact CD1-CD1 4.46Å; I117-F121 HydrophobicContact CD1-CE1 4.21Å; T118-F121 WeakPolarHBondContact O-CB 3.43Å; T118-F121 PolarHBondContact O-N 3.5Å; T118-F121 VanDerWaalsContact O-N 3.11Å; T118-F121 PolarHBondContact OG1-N 3.06Å; T118-F121 VanDerWaalsContact OG1-N 3.15Å; D119-F121 VanDerWaalsContact C-N 3.31Å; D119-F121 PolarHBondContact O-N 3.01Å; F121-Y123 VanDerWaalsContact C-N 3.32Å; F121-Y123 PolarHBondContact O-N 2.82Å; F121-S124 CarbonylContact O-C 3.44Å; F121-S124 PolarHBondContact O-N 3.11Å; F121-S124 PolarHBondContact O-OG 3.05Å; F121-Y125 HydrophobicContact CE1-CD1 4.31Å; F121-Y125 HydrophobicContact CE1-CD2 4.17Å; F121-Y125 AromaticContact CE1-CG 3.9Å; F121-Y125 HydrophobicContact CE1-CG 3.9Å; F121-Y125 AromaticContact CE2-CD2 3.72Å; F121-Y125 HydrophobicContact CE2-CD2 3.72Å; F121-Y125 HydrophobicContact CE2-CG 4.07Å; F121-Y125 HydrophobicContact CZ-CD1 4.26Å; F121-Y125 AromaticContact CZ-CD2 3.34Å; F121-Y125 HydrophobicContact CZ-CD2 3.34Å; F121-Y125 AromaticContact CZ-CE2 3.94Å; F121-Y125 HydrophobicContact CZ-CE2 3.94Å; F121-Y125 AromaticContact CZ-CG 3.54Å; F121-Y125 HydrophobicContact CZ-CG 3.54Å; F121-Y125 WeakPolarHBondContact O-CB 3.26Å; F121-Y125 PolarHBondContact O-N 3.17Å
122	F	91.9	Very high	92.5	Very high	14 Å²	14	62 Å²	62	6%	0.061	30%	0.299	C	S	.	.	H	α-helix	trans	-57.2	-44.8	179.9	-62.9	-55.4	0	0	0	112.6	L33 L38 L106 I117 T118 D119 S124 Y125 F126	L33-F122 HydrophobicContact CD1-CB 4.47Å; L33-F122 HydrophobicContact CD1-CD1 4.29Å; L33-F122 HydrophobicContact CD1-CD2 3.98Å; L33-F122 HydrophobicContact CD1-CE2 4.26Å; L33-F122 HydrophobicContact CD1-CG 4Å; L33-F122 HydrophobicContact CD2-CD1 4.07Å; L33-F122 HydrophobicContact CD2-CE1 3.83Å; L33-F122 HydrophobicContact CD2-CZ 4.16Å; L38-F122 HydrophobicContact CD1-CE1 3.88Å; L38-F122 HydrophobicContact CD1-CZ 3.54Å; L106-F122 HydrophobicContact CD1-CE1 4.47Å; L106-F122 HydrophobicContact CD2-CE1 4.31Å; I117-F122 HydrophobicContact CG2-CE1 4.33Å; I117-F122 HydrophobicContact CG2-CE2 4Å; I117-F122 HydrophobicContact CG2-CZ 3.46Å; I117-F122 VanDerWaalsContact CG2-CZ 3.46Å; T118-F122 VanDerWaalsContact O-CD2 3.25Å; T118-F122 WeakPolarHBondContact O-CD2 3.42Å; T118-F122 PolarHBondContact O-N 3.15Å; D119-F122 PolarHBondContact O-N 3.38Å; F122-S124 PolarHBondContact O-N 3.17Å; F122-S124 VanDerWaalsContact O-N 3.15Å; F122-Y125 PolarHBondContact O-N 3.45Å; F122-F126 HydrophobicContact CB-CD2 4.2Å; F122-F126 HydrophobicContact CB-CE2 3.93Å; F122-F126 AromaticContact CD1-CE2 3.65Å; F122-F126 HydrophobicContact CD1-CE2 3.65Å; F122-F126 HydrophobicContact CD1-CZ 4.22Å; F122-F126 HydrophobicContact CG-CE2 4.16Å; F122-F126 VanDerWaalsContact O-CD2 3.31Å; F122-F126 WeakPolarHBondContact O-CD2 3.48Å; F122-F126 PolarHBondContact O-N 3.1Å
123	Y	92.9	Very high	92.5	Very high	59 Å²	59	61.9 Å²	61.9	23%	0.231	31%	0.307	C	S	.	.	H	α-helix	trans	-60.2	-22.5	177.1	-67.3	-29.7	0	0	0	114.8	D119 F121 K145 F146 L147	D119-Y123 HydrophobicContact CB-CE2 4.07Å; D119-Y123 WeakPolarHBondContact O-CD2 3.39Å; D119-Y123 VanDerWaalsContact O-CG 3.24Å; D119-Y123 PolarHBondContact O-N 2.99Å; D119-Y123 VanDerWaalsContact O-N 3.08Å; F121-Y123 VanDerWaalsContact C-N 3.32Å; F121-Y123 PolarHBondContact O-N 2.82Å; Y123-K145 VanDerWaalsContact CB-O 3.26Å; Y123-K145 WeakPolarHBondContact CB-O 3.29Å; Y123-K145 HydrophobicContact CD1-CB 3.6Å; Y123-K145 HydrophobicContact CD2-CB 4.15Å; Y123-K145 HydrophobicContact CE1-CB 3.67Å; Y123-K145 HydrophobicContact CE1-CD 3.96Å; Y123-K145 HydrophobicContact CE1-CG 4.47Å; Y123-K145 HydrophobicContact CE2-CB 4.21Å; Y123-K145 HydrophobicContact CE2-CD 3.95Å; Y123-K145 HydrophobicContact CG-CB 3.88Å; Y123-F146 HydrophobicContact CD1-CD1 4.15Å; Y123-F146 HydrophobicContact CD1-CD2 4.36Å; Y123-F146 AromaticContact CD1-CE1 3.98Å; Y123-F146 HydrophobicContact CD1-CE1 3.98Å; Y123-F146 HydrophobicContact CD1-CE2 4.21Å; Y123-F146 HydrophobicContact CD1-CG 4.34Å; Y123-F146 HydrophobicContact CD1-CZ 4.01Å; Y123-F146 HydrophobicContact CE1-CE1 4.46Å; Y123-F146 HydrophobicContact CE1-CE2 4.19Å; Y123-F146 HydrophobicContact CE1-CZ 4.07Å; Y123-F146 CarbonylContact O-C 3.53Å; Y123-F146 WeakPolarHBondContact O-CA 3.49Å; Y123-L147 PolarHBondContact O-N 3.01Å
124	S	93	Very high	92.6	Very high	47 Å²	47	63.4 Å²	63.4	33%	0.329	31%	0.31	S	S	.	.	H	α-helix	trans	-112.5	-4.5	-179.8	65.5	0	0	0	0	114.3	T120 F121 F122 K148	T120-S124 PolarHBondContact O-N 3.33Å; T120-S124 PolarHBondContact O-OG 3.28Å; F121-S124 CarbonylContact O-C 3.44Å; F121-S124 PolarHBondContact O-N 3.11Å; F121-S124 PolarHBondContact O-OG 3.05Å; F122-S124 PolarHBondContact O-N 3.17Å; F122-S124 VanDerWaalsContact O-N 3.15Å; S124-K148 WeakPolarHBondContact O-CD 3.5Å; S124-K148 PolarHBondContact O-NZ 2.69Å
125	Y	93.1	Very high	92.9	Very high	66 Å²	66	67 Å²	67	26%	0.259	33%	0.326	S	S	.	.	H	α-helix	trans	-93.5	-52.6	-177.3	172.5	-98.5	0	0	0	111.5	E102 F105 L106 F121 F122 R127	E102-Y125 HydrophobicContact CG-CE1 4.1Å; E102-Y125 WeakPolarHBondContact OE1-CE1 3.45Å; F105-Y125 VanDerWaalsContact CD1-OH 3.26Å; F105-Y125 WeakPolarHBondContact CD1-OH 3.49Å; F105-Y125 AromaticContact CE1-CE2 3.91Å; F105-Y125 HydrophobicContact CE1-CE2 3.91Å; F105-Y125 AromaticContact CE1-CZ 3.99Å; F105-Y125 WeakPolarHBondContact CE1-OH 3.31Å; L106-Y125 HydrophobicContact CD2-CD1 4.27Å; L106-Y125 HydrophobicContact CD2-CE1 3.81Å; L106-Y125 HydrophobicContact CG-CE1 4.39Å; F121-Y125 HydrophobicContact CE1-CD1 4.31Å; F121-Y125 HydrophobicContact CE1-CD2 4.17Å; F121-Y125 AromaticContact CE1-CG 3.9Å; F121-Y125 HydrophobicContact CE1-CG 3.9Å; F121-Y125 AromaticContact CE2-CD2 3.72Å; F121-Y125 HydrophobicContact CE2-CD2 3.72Å; F121-Y125 HydrophobicContact CE2-CG 4.07Å; F121-Y125 HydrophobicContact CZ-CD1 4.26Å; F121-Y125 AromaticContact CZ-CD2 3.34Å; F121-Y125 HydrophobicContact CZ-CD2 3.34Å; F121-Y125 AromaticContact CZ-CE2 3.94Å; F121-Y125 HydrophobicContact CZ-CE2 3.94Å; F121-Y125 AromaticContact CZ-CG 3.54Å; F121-Y125 HydrophobicContact CZ-CG 3.54Å; F121-Y125 WeakPolarHBondContact O-CB 3.26Å; F121-Y125 PolarHBondContact O-N 3.17Å; F122-Y125 PolarHBondContact O-N 3.45Å; Y125-R127 PolarHBondContact O-N 2.99Å
126	F	93.8	Very high	93.2	Very high	10 Å²	10	61.8 Å²	61.8	4%	0.044	30%	0.299	C	S	.	.			trans	-69.8	125.1	-173.5	-68.8	-70.1	0	0	0	111.9	L33 E102 L106 F122 L129 F146	L33-F126 HydrophobicContact CD2-CE2 4.19Å; L33-F126 HydrophobicContact CD2-CZ 3.99Å; E102-F126 HydrophobicContact CG-CE1 4.28Å; E102-F126 WeakPolarHBondContact OE1-CD1 3.49Å; E102-F126 WeakPolarHBondContact OE1-CE1 3.44Å; L106-F126 HydrophobicContact CD1-CE1 4.2Å; L106-F126 HydrophobicContact CD1-CZ 3.8Å; F122-F126 HydrophobicContact CB-CD2 4.2Å; F122-F126 HydrophobicContact CB-CE2 3.93Å; F122-F126 AromaticContact CD1-CE2 3.65Å; F122-F126 HydrophobicContact CD1-CE2 3.65Å; F122-F126 HydrophobicContact CD1-CZ 4.22Å; F122-F126 HydrophobicContact CG-CE2 4.16Å; F122-F126 VanDerWaalsContact O-CD2 3.31Å; F122-F126 WeakPolarHBondContact O-CD2 3.48Å; F122-F126 PolarHBondContact O-N 3.1Å; F126-L129 HydrophobicContact CB-CD2 3.95Å; F126-L129 HydrophobicContact CB-CG 4.21Å; F126-L129 HydrophobicContact CD1-CD2 3.96Å; F126-L129 HydrophobicContact CD2-CD2 4.09Å; F126-L129 HydrophobicContact CE1-CD2 4.49Å; F126-L129 HydrophobicContact CG-CD2 3.74Å; F126-F146 HydrophobicContact CB-CD1 4.29Å; F126-F146 HydrophobicContact CD2-CD1 4.33Å; F126-F146 AromaticContact CD2-CE1 3.92Å; F126-F146 HydrophobicContact CD2-CE1 3.92Å
127	R	95.4	Very high	93.5	Very high	150 Å²	150	60.9 Å²	60.9	57%	0.566	30%	0.299	S	S	*	.	S	Bend	trans	-104.1	-21.6	166.9	-62.8	-168	-176.1	-169.8	2	112.8	Y125 K148 E150 E151	Y125-R127 PolarHBondContact O-N 2.99Å; R127-K148 WeakPolarHBondContact CA-O 3.1Å; R127-K148 HydrophobicContact CG-CB 4.45Å; R127-E150 IonicContact NH1-OE1 3.46Å; R127-E150 WeakPolarHBondContact O-CA 3.27Å; R127-E150 PolarHBondContact O-N 3.34Å; R127-E151 PolarHBondContact O-N 3.02Å
128	S	95.6	Very high	93.8	Very high	37 Å²	37	64.9 Å²	64.9	26%	0.259	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	132.5	176	-172.5	0	0	0	0	107.8	E151	S128-E151 CarbonylContact C-O 3.12Å; S128-E151 VanDerWaalsContact CA-O 3.3Å; S128-E151 WeakPolarHBondContact CA-O 3.25Å; S128-E151 WeakPolarHBondContact CB-OE2 3.3Å; S128-E151 WeakPolarHBondContact OG-CG 3.26Å; S128-E151 PolarHBondContact OG-OE2 2.86Å
129	L	95.2	Very high	94	Very high	10 Å²	10	62.6 Å²	62.6	5%	0.052	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	126.1	171.8	-74.9	175.4	0	0	0	108.9	V29 F126 L143 F146 L149 E151 L152 V153	V29-L129 HydrophobicContact CG1-CD2 4.43Å; V29-L129 HydrophobicContact CG2-CD1 4.46Å; F126-L129 HydrophobicContact CB-CD2 3.95Å; F126-L129 HydrophobicContact CB-CG 4.21Å; F126-L129 HydrophobicContact CD1-CD2 3.96Å; F126-L129 HydrophobicContact CD2-CD2 4.09Å; F126-L129 HydrophobicContact CE1-CD2 4.49Å; F126-L129 HydrophobicContact CG-CD2 3.74Å; L129-L143 HydrophobicContact CD1-CD1 4.18Å; L129-F146 HydrophobicContact CD1-CD1 3.94Å; L129-F146 HydrophobicContact CD1-CD2 4.12Å; L129-F146 HydrophobicContact CD1-CE1 3.98Å; L129-F146 HydrophobicContact CD1-CE2 4.15Å; L129-F146 HydrophobicContact CD1-CG 4.01Å; L129-F146 HydrophobicContact CD1-CZ 4.08Å; L129-L149 HydrophobicContact CB-CD1 3.9Å; L129-L149 HydrophobicContact CD1-CD1 3.73Å; L129-L149 HydrophobicContact CD1-CD2 3.98Å; L129-L149 HydrophobicContact CG-CD1 3.53Å; L129-E151 PolarHBondContact N-O 2.87Å; L129-L152 HydrophobicContact CB-CD1 4.02Å; L129-L152 WeakPolarHBondContact O-CA 3.41Å; L129-V153 PolarHBondContact O-N 3.26Å
130	R	94.1	Very high	94.3	Very high	180 Å²	180	59.4 Å²	59.4	68%	0.679	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.3	112.3	177.2	-176.9	177.8	-76.2	-131	-3.9	109.8	V132 V153	R130-V132 HydrophobicContact CG-CG2 3.63Å; R130-V153 HydrophobicContact CB-CB 4.36Å; R130-V153 HydrophobicContact CG-CB 4.17Å; R130-V153 HydrophobicContact CG-CG1 4.24Å
131	V	94.4	Very high	94.4	Very high	8 Å²	8	61.8 Å²	61.8	5%	0.048	29%	0.291	C	S	.	.			trans	-124.4	82.4	177.2	-174	0	0	0	0	107.4	V25 A28 V29 K134 V136 V153 L154 N157	V25-V131 HydrophobicContact CG1-CG2 4.37Å; A28-V131 HydrophobicContact CB-CG1 3.57Å; V29-V131 HydrophobicContact CG2-CG2 3.73Å; V131-K134 HydrophobicContact CG1-CB 3.95Å; V131-K134 HydrophobicContact CG1-CG 3.83Å; V131-V136 HydrophobicContact CG1-CG2 3.94Å; V131-V153 PolarHBondContact N-O 2.7Å; V131-L154 HydrophobicContact CB-CD2 3.83Å; V131-L154 HydrophobicContact CG2-CD2 4.35Å; V131-L154 WeakPolarHBondContact O-CA 3.15Å; V131-N157 PolarHBondContact O-ND2 3.44Å
132	V	94.6	Very high	94.5	Very high	48 Å²	48	61.7 Å²	61.7	29%	0.291	29%	0.292	S	S	.	.			trans	-107.9	134.4	-175.4	175.8	0	0	0	0	110	R130 K134 V153 S155 A156	R130-V132 HydrophobicContact CG-CG2 3.63Å; V132-K134 WeakPolarHBondContact O-CG 3.42Å; V132-K134 PolarHBondContact O-NZ 2.93Å; V132-V153 HydrophobicContact CG2-CG1 3.8Å; V132-S155 VanDerWaalsContact CA-O 3.31Å; V132-S155 WeakPolarHBondContact CA-O 3.47Å; V132-A156 HydrophobicContact CG1-CB 4.33Å
133	D	94.1	Very high	94.6	Very high	108 Å²	108	61 Å²	61	58%	0.578	29%	0.289	S	S	*	.	S	Bend	trans	53.4	58.9	177.3	-171.6	29.7	0	0	0	112.2	S155 A156	D133-S155 PolarHBondContact N-O 3.36Å; D133-A156 WeakPolarHBondContact CA-O 3.49Å; D133-A156 HydrophobicContact CB-CB 4.29Å; D133-A156 PolarHBondContact N-O 2.74Å
134	K	93.8	Very high	94.7	Very high	97 Å²	97	61.5 Å²	61.5	42%	0.422	30%	0.295	S	S	.	.	S	Bend	trans	-124.9	13.6	179.3	-59.9	-69.1	158.8	-92.1	0	112.1	T22 A28 V131 V132 V136 N157	T22-K134 PolarHBondContact OG1-O 2.81Å; A28-K134 HydrophobicContact CB-CB 4.33Å; V131-K134 HydrophobicContact CG1-CB 3.95Å; V131-K134 HydrophobicContact CG1-CG 3.83Å; V132-K134 WeakPolarHBondContact O-CG 3.42Å; V132-K134 PolarHBondContact O-NZ 2.93Å; K134-V136 HydrophobicContact CB-CG2 4.04Å; K134-V136 PolarHBondContact O-N 2.85Å; K134-V136 VanDerWaalsContact O-N 3.11Å; K134-N157 PolarHBondContact N-OD1 2.86Å
135	E	94.9	Very high	94.8	Very high	90 Å²	90	63.1 Å²	63.1	42%	0.421	30%	0.296	S	S	.	.			trans	54.7	29.2	-179.4	-51.6	-176.7	156.3	0	0	113.3	N157 R158	E135-N157 PolarHBondContact N-OD1 2.99Å; E135-R158 IonicContact OE1-NH2 3.43Å; E135-R158 PolarHBondContact OE1-NH2 3.12Å
136	V	95.7	Very high	94.9	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.286	C	S	.	.			trans	-69.3	135	-179.7	174	0	0	0	0	109.8	V25 A28 V131 K134 N157 R158 I159	V25-V136 HydrophobicContact CG2-CG1 3.73Å; A28-V136 HydrophobicContact CB-CG2 3.8Å; V131-V136 HydrophobicContact CG1-CG2 3.94Å; K134-V136 HydrophobicContact CB-CG2 4.04Å; K134-V136 PolarHBondContact O-N 2.85Å; K134-V136 VanDerWaalsContact O-N 3.11Å; V136-N157 HydrophobicContact CB-CB 4.23Å; V136-N157 PolarHBondContact N-OD1 2.79Å; V136-N157 VanDerWaalsContact N-OD1 3.13Å; V136-N157 WeakPolarHBondContact O-CB 3.49Å; V136-R158 CarbonylContact O-C 3.34Å; V136-R158 WeakPolarHBondContact O-CA 3.3Å; V136-R158 PolarHBondContact O-N 3.15Å; V136-I159 HydrophobicContact CG1-CG1 4.43Å; V136-I159 WeakPolarHBondContact O-CG1 3.31Å; V136-I159 PolarHBondContact O-N 3.03Å
137	T	95.6	Very high	94.9	Very high	75 Å²	75	65.8 Å²	65.8	46%	0.46	31%	0.314	S	S	.	.			trans	-109.1	-21.1	179.8	51.3	0	0	0	0	113.8	G23 R158	G23-T137 PolarHBondContact O-OG1 2.9Å; T137-R158 HydrophobicContact CG2-CB 4.16Å
138	L	95.6	Very high	94.9	Very high	91 Å²	91	63.4 Å²	63.4	48%	0.476	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-139.9	134.7	-171.6	-176.8	68.6	0	0	0	112.9	G23 T24 V25	G23-L138 WeakPolarHBondContact O-CB 3.49Å; G23-L138 PolarHBondContact O-N 2.78Å; T24-L138 VanDerWaalsContact CA-O 3.29Å; T24-L138 WeakPolarHBondContact CA-O 3.38Å; T24-L138 HydrophobicContact CG2-CB 4.46Å; T24-L138 HydrophobicContact CG2-CD2 4.28Å; V25-L138 PolarHBondContact N-O 2.89Å
139	V	95.6	Very high	94.9	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.006	30%	0.296	C	S	.	.			trans	-87.1	108.2	165.5	-175.2	0	0	0	0	108.8	V25 L143 L154 I159 V162 N166 L167	V25-V139 HydrophobicContact CG2-CB 4.36Å; V25-V139 HydrophobicContact CG2-CG1 4.49Å; V25-V139 HydrophobicContact CG2-CG2 4.01Å; V139-L143 HydrophobicContact CG1-CD2 3.75Å; V139-L154 HydrophobicContact CG2-CD1 3.83Å; V139-I159 HydrophobicContact CG2-CD1 4.21Å; V139-V162 HydrophobicContact CG2-CG1 4.2Å; V139-V162 HydrophobicContact CG2-CG2 4.14Å; V139-N166 HydrophobicContact CG1-CB 4.25Å; V139-N166 PolarHBondContact O-ND2 3.25Å; V139-L167 HydrophobicContact CG1-CD2 4.08Å
140	D	95.2	Very high	95.1	Very high	21 Å²	21	63.8 Å²	63.8	11%	0.112	31%	0.306	C	S	.	.			trans	-96.2	152.9	-174.6	60.9	-30.5	0	0	0	113.5	T24 S26 D142 L143	T24-D140 WeakPolarHBondContact CB-OD2 3.3Å; T24-D140 HydrophobicContact CG2-CB 4.07Å; T24-D140 VanDerWaalsContact OG1-CG 3.3Å; T24-D140 PolarHBondContact OG1-OD1 3.28Å; T24-D140 PolarHBondContact OG1-OD2 3.13Å; S26-D140 VanDerWaalsContact CB-OD1 3.27Å; S26-D140 WeakPolarHBondContact CB-OD1 3.25Å; S26-D140 VanDerWaalsContact CB-OD2 3.25Å; S26-D140 WeakPolarHBondContact CB-OD2 3.49Å; S26-D140 PolarHBondContact N-OD1 3.09Å; S26-D140 VanDerWaalsContact OG-CG 3.26Å; S26-D140 PolarHBondContact OG-OD1 3.46Å; S26-D140 PolarHBondContact OG-OD2 3.19Å; D140-D142 PolarHBondContact O-N 3.13Å; D140-L143 VanDerWaalsContact O-CB 3.32Å; D140-L143 WeakPolarHBondContact O-CB 3.32Å; D140-L143 PolarHBondContact O-N 3.25Å
141	K	95.5	Very high	95.2	Very high	149 Å²	149	58.5 Å²	58.5	65%	0.648	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-53.9	-19.6	179.6	69.6	-177.3	179.8	-176	0	115.7	L143 L144 N166	K141-L143 PolarHBondContact O-N 2.79Å; K141-L144 VanDerWaalsContact O-CB 3.29Å; K141-L144 WeakPolarHBondContact O-CB 3.45Å; K141-L144 WeakPolarHBondContact O-CG 3.29Å; K141-L144 PolarHBondContact O-N 3.04Å; K141-L144 VanDerWaalsContact O-N 3.1Å; K141-N166 VanDerWaalsContact CA-OD1 3.25Å; K141-N166 WeakPolarHBondContact CA-OD1 3.49Å; K141-N166 VanDerWaalsContact CB-OD1 3.31Å; K141-N166 WeakPolarHBondContact CB-OD1 3.43Å; K141-N166 PolarHBondContact N-OD1 3.03Å
142	D	94.7	Very high	95.4	Very high	34 Å²	34	58.1 Å²	58.1	18%	0.182	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-62.5	-21.2	176	-91.5	4.2	0	0	0	111.9	S26 R30 D140 L144 K145	S26-D142 WeakPolarHBondContact OG-CB 3.39Å; R30-D142 IonicContact NH1-OD2 2.86Å; R30-D142 PolarHBondContact NH1-OD2 2.94Å; D140-D142 PolarHBondContact O-N 3.13Å; D142-L144 PolarHBondContact O-N 3.27Å; D142-K145 VanDerWaalsContact O-CB 3.26Å; D142-K145 WeakPolarHBondContact O-CB 3.21Å; D142-K145 VanDerWaalsContact O-CG 3.3Å; D142-K145 WeakPolarHBondContact O-CG 3.47Å; D142-K145 PolarHBondContact O-N 3.39Å; D142-K145 VanDerWaalsContact O-N 3.1Å; D142-K145 WeakPolarHBondContact OD1-CE 3.49Å; D142-K145 IonicContact OD1-NZ 2.97Å; D142-K145 PolarHBondContact OD1-NZ 3.5Å; D142-K145 IonicContact OD2-NZ 2.89Å; D142-K145 PolarHBondContact OD2-NZ 3.05Å
143	L	94.4	Very high	95.6	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-62.7	-28.5	173.7	-169.9	67.5	0	0	0	112.5	V25 S26 L129 V139 D140 K141 K145 F146 L149 L152 L167 P168	V25-L143 HydrophobicContact CG1-CD1 4.21Å; S26-L143 PolarHBondContact OG-N 3.24Å; L129-L143 HydrophobicContact CD1-CD1 4.18Å; V139-L143 HydrophobicContact CG1-CD2 3.75Å; D140-L143 VanDerWaalsContact O-CB 3.32Å; D140-L143 WeakPolarHBondContact O-CB 3.32Å; D140-L143 PolarHBondContact O-N 3.25Å; K141-L143 PolarHBondContact O-N 2.79Å; L143-K145 PolarHBondContact O-N 3.42Å; L143-K145 VanDerWaalsContact O-N 3.08Å; L143-F146 HydrophobicContact CD1-CD2 4.05Å; L143-F146 HydrophobicContact CD1-CE2 4.45Å; L143-F146 WeakPolarHBondContact O-CD2 3.31Å; L143-F146 PolarHBondContact O-N 3.08Å; L143-L149 HydrophobicContact CD1-CD2 3.91Å; L143-L149 HydrophobicContact CG-CD2 4.38Å; L143-L152 HydrophobicContact CD1-CD1 4.46Å; L143-L152 HydrophobicContact CD2-CD2 3.58Å; L143-L167 HydrophobicContact CD2-CD2 4.24Å; L143-P168 HydrophobicContact CG-CG 4.08Å; L143-P168 WeakPolarHBondContact O-CG 3.4Å
144	L	95.2	Very high	95.7	Very high	70 Å²	70	51.1 Å²	51.1	37%	0.366	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-62.9	-15.5	174.8	-61.3	174.3	0	0	0	113.2	K141 D142 F146 L167	K141-L144 VanDerWaalsContact O-CB 3.29Å; K141-L144 WeakPolarHBondContact O-CB 3.45Å; K141-L144 WeakPolarHBondContact O-CG 3.29Å; K141-L144 PolarHBondContact O-N 3.04Å; K141-L144 VanDerWaalsContact O-N 3.1Å; D142-L144 PolarHBondContact O-N 3.27Å; L144-F146 PolarHBondContact O-N 3.23Å; L144-L167 WeakPolarHBondContact CD2-O 3.47Å
145	K	95.1	Very high	95.9	Very high	80 Å²	80	47.3 Å²	47.3	35%	0.348	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-69.1	-22.8	174.4	-60.9	175	-170.8	165	0	111.9	Y123 D142 L143 L147	Y123-K145 VanDerWaalsContact CB-O 3.26Å; Y123-K145 WeakPolarHBondContact CB-O 3.29Å; Y123-K145 HydrophobicContact CD1-CB 3.6Å; Y123-K145 HydrophobicContact CD2-CB 4.15Å; Y123-K145 HydrophobicContact CE1-CB 3.67Å; Y123-K145 HydrophobicContact CE1-CD 3.96Å; Y123-K145 HydrophobicContact CE1-CG 4.47Å; Y123-K145 HydrophobicContact CE2-CB 4.21Å; Y123-K145 HydrophobicContact CE2-CD 3.95Å; Y123-K145 HydrophobicContact CG-CB 3.88Å; D142-K145 VanDerWaalsContact O-CB 3.26Å; D142-K145 WeakPolarHBondContact O-CB 3.21Å; D142-K145 VanDerWaalsContact O-CG 3.3Å; D142-K145 WeakPolarHBondContact O-CG 3.47Å; D142-K145 PolarHBondContact O-N 3.39Å; D142-K145 VanDerWaalsContact O-N 3.1Å; D142-K145 WeakPolarHBondContact OD1-CE 3.49Å; D142-K145 IonicContact OD1-NZ 2.97Å; D142-K145 PolarHBondContact OD1-NZ 3.5Å; D142-K145 IonicContact OD2-NZ 2.89Å; D142-K145 PolarHBondContact OD2-NZ 3.05Å; L143-K145 PolarHBondContact O-N 3.42Å; L143-K145 VanDerWaalsContact O-N 3.08Å; K145-L147 WeakPolarHBondContact O-CG 3.48Å; K145-L147 PolarHBondContact O-N 3.4Å
146	F	95.1	Very high	96	Very high	9 Å²	9	45.3 Å²	45.3	4%	0.039	23%	0.232	C	C	.	.			trans	-81.2	84.4	179.6	-64.1	-89.9	0	0	0	111.2	V29 Y123 F126 L129 L143 L144 K148 L149	V29-F146 HydrophobicContact CG1-CZ 3.98Å; Y123-F146 HydrophobicContact CD1-CD1 4.15Å; Y123-F146 HydrophobicContact CD1-CD2 4.36Å; Y123-F146 AromaticContact CD1-CE1 3.98Å; Y123-F146 HydrophobicContact CD1-CE1 3.98Å; Y123-F146 HydrophobicContact CD1-CE2 4.21Å; Y123-F146 HydrophobicContact CD1-CG 4.34Å; Y123-F146 HydrophobicContact CD1-CZ 4.01Å; Y123-F146 HydrophobicContact CE1-CE1 4.46Å; Y123-F146 HydrophobicContact CE1-CE2 4.19Å; Y123-F146 HydrophobicContact CE1-CZ 4.07Å; Y123-F146 CarbonylContact O-C 3.53Å; Y123-F146 WeakPolarHBondContact O-CA 3.49Å; F126-F146 HydrophobicContact CB-CD1 4.29Å; F126-F146 HydrophobicContact CD2-CD1 4.33Å; F126-F146 AromaticContact CD2-CE1 3.92Å; F126-F146 HydrophobicContact CD2-CE1 3.92Å; L129-F146 HydrophobicContact CD1-CD1 3.94Å; L129-F146 HydrophobicContact CD1-CD2 4.12Å; L129-F146 HydrophobicContact CD1-CE1 3.98Å; L129-F146 HydrophobicContact CD1-CE2 4.15Å; L129-F146 HydrophobicContact CD1-CG 4.01Å; L129-F146 HydrophobicContact CD1-CZ 4.08Å; L143-F146 HydrophobicContact CD1-CD2 4.05Å; L143-F146 HydrophobicContact CD1-CE2 4.45Å; L143-F146 WeakPolarHBondContact O-CD2 3.31Å; L143-F146 PolarHBondContact O-N 3.08Å; L144-F146 PolarHBondContact O-N 3.23Å; F146-K148 PolarHBondContact O-N 2.98Å; F146-K148 VanDerWaalsContact O-N 3.13Å; F146-L149 HydrophobicContact CB-CB 3.94Å; F146-L149 HydrophobicContact CB-CD2 4.43Å; F146-L149 WeakPolarHBondContact O-CB 3.25Å; F146-L149 PolarHBondContact O-N 3.01Å
147	L	92.7	Very high	96.1	Very high	124 Å²	124	45.7 Å²	45.7	65%	0.649	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-12.8	-167.7	-56.6	179.7	0	0	0	115.4	Y123 K145	Y123-L147 PolarHBondContact O-N 3.01Å; K145-L147 WeakPolarHBondContact O-CG 3.48Å; K145-L147 PolarHBondContact O-N 3.4Å
148	K	95.3	Very high	96.2	Very high	100 Å²	100	48 Å²	48	44%	0.435	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.6	15	-179.9	-60.2	-169.8	-166.7	149.1	0	112.7	S124 R127 F146 E150	S124-K148 WeakPolarHBondContact O-CD 3.5Å; S124-K148 PolarHBondContact O-NZ 2.69Å; R127-K148 WeakPolarHBondContact CA-O 3.1Å; R127-K148 HydrophobicContact CG-CB 4.45Å; F146-K148 PolarHBondContact O-N 2.98Å; F146-K148 VanDerWaalsContact O-N 3.13Å; K148-E150 PolarHBondContact O-N 3.1Å
149	L	97.1	Very high	96.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.212	C	C	.	.			trans	-68.8	120	-178.1	-166.7	67.9	0	0	0	110.1	L129 L143 F146 E151 L152 P168 T170 L171	L129-L149 HydrophobicContact CB-CD1 3.9Å; L129-L149 HydrophobicContact CD1-CD1 3.73Å; L129-L149 HydrophobicContact CD1-CD2 3.98Å; L129-L149 HydrophobicContact CG-CD1 3.53Å; L143-L149 HydrophobicContact CD1-CD2 3.91Å; L143-L149 HydrophobicContact CG-CD2 4.38Å; F146-L149 HydrophobicContact CB-CB 3.94Å; F146-L149 HydrophobicContact CB-CD2 4.43Å; F146-L149 WeakPolarHBondContact O-CB 3.25Å; F146-L149 PolarHBondContact O-N 3.01Å; L149-E151 WeakPolarHBondContact CD1-O 3.46Å; L149-L152 HydrophobicContact CD2-CB 4.33Å; L149-L152 HydrophobicContact CD2-CD1 4.37Å; L149-P168 HydrophobicContact CB-CB 4.43Å; L149-P168 HydrophobicContact CB-CG 4.26Å; L149-P168 HydrophobicContact CD2-CG 4.03Å; L149-T170 CarbonylContact O-C 3.55Å; L149-T170 WeakPolarHBondContact O-CB 3.49Å; L149-T170 PolarHBondContact O-OG1 3.31Å; L149-L171 HydrophobicContact CD2-CD1 4.2Å; L149-L171 HydrophobicContact CG-CD1 4.12Å; L149-L171 PolarHBondContact O-N 2.93Å
150	E	97.6	Very high	96.2	Very high	55 Å²	55	50 Å²	50	26%	0.257	24%	0.239	S	C	.	.			trans	-110.8	-28.7	178.9	-64.5	-177	-151.6	0	0	111.4	R127 K148 K172 V173	R127-E150 IonicContact NH1-OE1 3.46Å; R127-E150 WeakPolarHBondContact O-CA 3.27Å; R127-E150 PolarHBondContact O-N 3.34Å; K148-E150 PolarHBondContact O-N 3.1Å; E150-K172 HydrophobicContact CB-CD 4.42Å; E150-K172 WeakPolarHBondContact O-CA 3.45Å; E150-K172 PolarHBondContact O-N 3.35Å; E150-K172 IonicContact OE1-NZ 3.29Å; E150-K172 WeakPolarHBondContact OE2-CE 3.44Å; E150-K172 IonicContact OE2-NZ 3.43Å; E150-K172 PolarHBondContact OE2-NZ 2.91Å; E150-V173 PolarHBondContact O-N 2.72Å
151	E	98.2	Very high	96.1	Very high	68 Å²	68	53.9 Å²	53.9	32%	0.318	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	132.1	-179.2	176.5	-177.1	-170.2	0	0	110.8	R127 S128 L129 L149 V153 V173	R127-E151 PolarHBondContact O-N 3.02Å; S128-E151 CarbonylContact C-O 3.12Å; S128-E151 VanDerWaalsContact CA-O 3.3Å; S128-E151 WeakPolarHBondContact CA-O 3.25Å; S128-E151 WeakPolarHBondContact CB-OE2 3.3Å; S128-E151 WeakPolarHBondContact OG-CG 3.26Å; S128-E151 PolarHBondContact OG-OE2 2.86Å; L129-E151 PolarHBondContact N-O 2.87Å; L149-E151 WeakPolarHBondContact CD1-O 3.46Å; E151-V153 HydrophobicContact CG-CG2 4.09Å; E151-V173 WeakPolarHBondContact CA-O 3.33Å; E151-V173 HydrophobicContact CB-CB 4.09Å; E151-V173 HydrophobicContact CG-CB 3.94Å; E151-V173 HydrophobicContact CG-CG1 3.98Å
152	L	97.9	Very high	96.1	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	116.2	176.7	179.2	63.5	0	0	0	109.6	L129 L143 L149 L154 L167 L171 V173 L174 E175	L129-L152 HydrophobicContact CB-CD1 4.02Å; L129-L152 WeakPolarHBondContact O-CA 3.41Å; L143-L152 HydrophobicContact CD1-CD1 4.46Å; L143-L152 HydrophobicContact CD2-CD2 3.58Å; L149-L152 HydrophobicContact CD2-CB 4.33Å; L149-L152 HydrophobicContact CD2-CD1 4.37Å; L152-L154 HydrophobicContact CD1-CD1 4.44Å; L152-L154 HydrophobicContact CD1-CD2 3.88Å; L152-L154 HydrophobicContact CD1-CG 4.05Å; L152-L154 HydrophobicContact CD2-CD1 3.87Å; L152-L154 HydrophobicContact CD2-CG 4.27Å; L152-L154 HydrophobicContact CG-CD1 4.04Å; L152-L154 HydrophobicContact CG-CD2 4.27Å; L152-L154 HydrophobicContact CG-CG 3.87Å; L152-L167 HydrophobicContact CD2-CD2 4.12Å; L152-L171 HydrophobicContact CB-CD1 3.73Å; L152-L171 HydrophobicContact CB-CD2 4.39Å; L152-V173 PolarHBondContact N-O 2.92Å; L152-L174 HydrophobicContact CB-CD1 4.24Å; L152-L174 HydrophobicContact CD2-CD1 3.92Å; L152-L174 HydrophobicContact CG-CD1 4.21Å; L152-E175 PolarHBondContact O-N 2.97Å
153	V	97.8	Very high	96	Very high	8 Å²	8	48.4 Å²	48.4	5%	0.048	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	113.6	179.2	-177.3	0	0	0	0	109.2	L129 R130 V131 V132 E151 S155 E175	L129-V153 PolarHBondContact O-N 3.26Å; R130-V153 HydrophobicContact CB-CB 4.36Å; R130-V153 HydrophobicContact CG-CB 4.17Å; R130-V153 HydrophobicContact CG-CG1 4.24Å; V131-V153 PolarHBondContact N-O 2.7Å; V132-V153 HydrophobicContact CG2-CG1 3.8Å; E151-V153 HydrophobicContact CG-CG2 4.09Å; V153-S155 WeakPolarHBondContact CG1-OG 3.35Å; V153-E175 HydrophobicContact CB-CB 4.39Å; V153-E175 HydrophobicContact CG1-CB 4.19Å; V153-E175 HydrophobicContact CG1-CG 4.1Å; V153-E175 HydrophobicContact CG2-CB 4.22Å
154	L	97.7	Very high	95.9	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	24%	0.235	C	C	.	.			trans	-121.4	28.7	-177.1	-61.8	178.9	0	0	0	111.7	V25 V131 V139 L152 N157 I159 E175 L176 N179	V25-L154 HydrophobicContact CG1-CD2 4.02Å; V25-L154 HydrophobicContact CG2-CD1 4Å; V25-L154 HydrophobicContact CG2-CD2 3.82Å; V131-L154 HydrophobicContact CB-CD2 3.83Å; V131-L154 HydrophobicContact CG2-CD2 4.35Å; V131-L154 WeakPolarHBondContact O-CA 3.15Å; V139-L154 HydrophobicContact CG2-CD1 3.83Å; L152-L154 HydrophobicContact CD1-CD1 4.44Å; L152-L154 HydrophobicContact CD1-CD2 3.88Å; L152-L154 HydrophobicContact CD1-CG 4.05Å; L152-L154 HydrophobicContact CD2-CD1 3.87Å; L152-L154 HydrophobicContact CD2-CG 4.27Å; L152-L154 HydrophobicContact CG-CD1 4.04Å; L152-L154 HydrophobicContact CG-CD2 4.27Å; L152-L154 HydrophobicContact CG-CG 3.87Å; L154-N157 VanDerWaalsContact C-ND2 3.29Å; L154-N157 PolarHBondContact O-ND2 3.29Å; L154-I159 HydrophobicContact CB-CD1 3.98Å; L154-I159 HydrophobicContact CD1-CD1 3.86Å; L154-I159 HydrophobicContact CG-CD1 4.45Å; L154-E175 PolarHBondContact N-O 2.74Å; L154-L176 HydrophobicContact CB-CD2 3.98Å; L154-L176 HydrophobicContact CD1-CD2 3.97Å; L154-N179 PolarHBondContact O-ND2 3.45Å
155	S	97.6	Very high	95.9	Very high	18 Å²	18	48.3 Å²	48.3	13%	0.126	24%	0.237	C	C	.	.			trans	-63.4	153.1	-176.1	-40.4	0	0	0	0	113.2	V132 D133 V153 N157 E175 Y177	V132-S155 VanDerWaalsContact CA-O 3.31Å; V132-S155 WeakPolarHBondContact CA-O 3.47Å; D133-S155 PolarHBondContact N-O 3.36Å; V153-S155 WeakPolarHBondContact CG1-OG 3.35Å; S155-N157 VanDerWaalsContact C-N 3.35Å; S155-N157 PolarHBondContact O-N 3.48Å; S155-N157 PolarHBondContact O-ND2 2.62Å; S155-E175 WeakPolarHBondContact OG-CG 3.18Å; S155-Y177 CarbonylContact C-O 3.59Å; S155-Y177 WeakPolarHBondContact CA-O 3.43Å; S155-Y177 WeakPolarHBondContact CB-O 3.47Å
156	A	96.9	Very high	95.9	Very high	47 Å²	47	45.9 Å²	45.9	39%	0.388	23%	0.228	S	C	.	.	S	Bend	trans	55.6	44.6	176.3	0	0	0	0	0	113.1	V132 D133 Y177 G178	V132-A156 HydrophobicContact CG1-CB 4.33Å; D133-A156 WeakPolarHBondContact CA-O 3.49Å; D133-A156 HydrophobicContact CB-CB 4.29Å; D133-A156 PolarHBondContact N-O 2.74Å; A156-Y177 PolarHBondContact N-O 3.41Å; A156-G178 CarbonylContact C-O 3.6Å; A156-G178 WeakPolarHBondContact CA-O 3.09Å; A156-G178 PolarHBondContact N-O 3.31Å
157	N	97.3	Very high	95.9	Very high	9 Å²	9	45.8 Å²	45.8	5%	0.048	23%	0.228	C	C	.	.	S	Bend	trans	-114.3	-165.5	173.3	-74.1	-67.7	0	0	0	110	V131 K134 E135 V136 L154 S155 I159 G178 N179	V131-N157 PolarHBondContact O-ND2 3.44Å; K134-N157 PolarHBondContact N-OD1 2.86Å; E135-N157 PolarHBondContact N-OD1 2.99Å; V136-N157 HydrophobicContact CB-CB 4.23Å; V136-N157 PolarHBondContact N-OD1 2.79Å; V136-N157 VanDerWaalsContact N-OD1 3.13Å; V136-N157 WeakPolarHBondContact O-CB 3.49Å; L154-N157 VanDerWaalsContact C-ND2 3.29Å; L154-N157 PolarHBondContact O-ND2 3.29Å; S155-N157 VanDerWaalsContact C-N 3.35Å; S155-N157 PolarHBondContact O-N 3.48Å; S155-N157 PolarHBondContact O-ND2 2.62Å; N157-I159 HydrophobicContact CB-CD1 4.38Å; N157-I159 HydrophobicContact CB-CG1 4.2Å; N157-G178 PolarHBondContact N-O 3.32Å; N157-N179 WeakPolarHBondContact CA-OD1 3.14Å; N157-N179 VanDerWaalsContact CB-OD1 3.22Å; N157-N179 WeakPolarHBondContact CB-OD1 3.34Å; N157-N179 PolarHBondContact N-OD1 2.86Å; N157-N179 PolarHBondContact O-OD1 3.32Å
158	R	96.9	Very high	96	Very high	124 Å²	124	40 Å²	40	47%	0.468	20%	0.197	S	C	.	.			trans	-121	36.3	-178.9	-57.5	-172.9	-168	-179.8	9	111.2	E135 V136 T137 N179	E135-R158 IonicContact OE1-NH2 3.43Å; E135-R158 PolarHBondContact OE1-NH2 3.12Å; V136-R158 CarbonylContact O-C 3.34Å; V136-R158 WeakPolarHBondContact O-CA 3.3Å; V136-R158 PolarHBondContact O-N 3.15Å; T137-R158 HydrophobicContact CG2-CB 4.16Å; R158-N179 PolarHBondContact N-OD1 3.33Å
159	I	96.6	Very high	95.9	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.208	C	C	.	.			trans	-74.5	127.8	-179.1	-58.7	171.6	0	0	0	108.3	V136 V139 L154 N157 E161 V162 L176 N179 E180 I181	V136-I159 HydrophobicContact CG1-CG1 4.43Å; V136-I159 WeakPolarHBondContact O-CG1 3.31Å; V136-I159 PolarHBondContact O-N 3.03Å; V139-I159 HydrophobicContact CG2-CD1 4.21Å; L154-I159 HydrophobicContact CB-CD1 3.98Å; L154-I159 HydrophobicContact CD1-CD1 3.86Å; L154-I159 HydrophobicContact CG-CD1 4.45Å; N157-I159 HydrophobicContact CB-CD1 4.38Å; N157-I159 HydrophobicContact CB-CG1 4.2Å; I159-E161 VanDerWaalsContact CG2-O 3.29Å; I159-E161 WeakPolarHBondContact CG2-O 3.35Å; I159-V162 HydrophobicContact CG2-CG2 3.69Å; I159-L176 HydrophobicContact CD1-CD2 4.14Å; I159-N179 HydrophobicContact CB-CB 4.35Å; I159-N179 WeakPolarHBondContact CB-OD1 3.33Å; I159-N179 WeakPolarHBondContact CG1-OD1 3.44Å; I159-N179 PolarHBondContact N-OD1 2.88Å; I159-E180 CarbonylContact O-C 3.33Å; I159-E180 VanDerWaalsContact O-C 3.31Å; I159-E180 WeakPolarHBondContact O-CA 3.4Å; I159-E180 PolarHBondContact O-N 3.22Å; I159-I181 HydrophobicContact CG2-CG1 4.49Å; I159-I181 WeakPolarHBondContact O-CG1 3.22Å; I159-I181 PolarHBondContact O-N 3.4Å
160	K	95.3	Very high	95.8	Very high	132 Å²	132	42.5 Å²	42.5	57%	0.574	22%	0.223	S	C	*	.			trans	-100.4	-26.1	178.8	-65.2	-176.7	178.1	-174.2	0	113.2	E180 I181	K160-E180 WeakPolarHBondContact CE-OE2 3.49Å; K160-E180 HydrophobicContact CG-CB 4Å; K160-I181 WeakPolarHBondContact O-CA 3.28Å
161	E	93.5	Very high	95.8	Very high	104 Å²	104	39.9 Å²	39.9	49%	0.486	21%	0.211	S	C	.	.			trans	-152.9	146	-176.1	-166.7	-170.5	139.4	0	0	108.8	I159 C186	I159-E161 VanDerWaalsContact CG2-O 3.29Å; I159-E161 WeakPolarHBondContact CG2-O 3.35Å; E161-C186 VanDerWaalsContact CD-SG 3.52Å; E161-C186 HydrophobicContact CG-CB 3.74Å; E161-C186 VanDerWaalsContact OE1-CB 3.28Å; E161-C186 WeakPolarHBondContact OE1-CB 3.49Å; E161-C186 PolarHBondContact OE1-SG 3.42Å
162	V	94.5	Very high	95.8	Very high	5 Å²	5	40 Å²	40	3%	0.03	21%	0.21	C	C	.	.			trans	-125.1	108.3	174.3	-179.4	0	0	0	0	108.4	V139 I159 A164 L167 L176 I181 C186 L187	V139-V162 HydrophobicContact CG2-CG1 4.2Å; V139-V162 HydrophobicContact CG2-CG2 4.14Å; I159-V162 HydrophobicContact CG2-CG2 3.69Å; V162-A164 PolarHBondContact O-N 3.28Å; V162-L167 HydrophobicContact CG1-CD1 4Å; V162-L167 HydrophobicContact CG1-CD2 4.11Å; V162-L167 HydrophobicContact CG1-CG 4.18Å; V162-L176 HydrophobicContact CG2-CD1 4Å; V162-L176 HydrophobicContact CG2-CD2 3.96Å; V162-I181 HydrophobicContact CG2-CD1 4.17Å; V162-C186 CarbonylContact O-C 3.6Å; V162-C186 VanDerWaalsContact O-C 3.25Å; V162-L187 HydrophobicContact CB-CD1 4.16Å; V162-L187 HydrophobicContact CG1-CD1 3.84Å; V162-L187 WeakPolarHBondContact O-CA 3.45Å; V162-L187 PolarHBondContact O-N 3.38Å
163	D	93.3	Very high	95.9	Very high	62 Å²	62	41.9 Å²	41.9	33%	0.332	22%	0.222	S	C	.	.			trans	-73.4	112.9	168.9	179.1	-8.1	0	0	0	109.1	T165 N166	D163-T165 PolarHBondContact O-N 3.18Å; D163-T165 VanDerWaalsContact O-N 3.13Å; D163-T165 VanDerWaalsContact OD1-CB 3.32Å; D163-T165 WeakPolarHBondContact OD1-CB 3.34Å; D163-T165 WeakPolarHBondContact OD1-CG2 3.49Å; D163-T165 PolarHBondContact OD1-N 3.05Å; D163-T165 PolarHBondContact OD1-OG1 2.71Å; D163-T165 PolarHBondContact OD2-OG1 2.99Å; D163-N166 PolarHBondContact O-N 2.91Å
164	A	93.1	Very high	95.9	Very high	2 Å²	2	41.6 Å²	41.6	2%	0.017	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-59.8	-23.3	-178.2	0	0	0	0	0	113.6	V162 N166 L167 C186 L187 H190	V162-A164 PolarHBondContact O-N 3.28Å; A164-N166 PolarHBondContact O-N 3.02Å; A164-L167 WeakPolarHBondContact O-CB 3.5Å; A164-L167 PolarHBondContact O-N 2.97Å; A164-C186 PolarHBondContact N-O 2.91Å; A164-L187 VanDerWaalsContact CB-O 3.27Å; A164-L187 WeakPolarHBondContact CB-O 3.34Å; A164-H190 HydrophobicContact CB-CB 4.49Å; A164-H190 VanDerWaalsContact CB-O 3.28Å; A164-H190 WeakPolarHBondContact CB-O 3.48Å
165	T	94.1	Very high	95.9	Very high	67 Å²	67	43.1 Å²	43.1	41%	0.411	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-66.1	-19.8	177.3	69.7	0	0	0	0	113	D163 H190	D163-T165 PolarHBondContact O-N 3.18Å; D163-T165 VanDerWaalsContact O-N 3.13Å; D163-T165 VanDerWaalsContact OD1-CB 3.32Å; D163-T165 WeakPolarHBondContact OD1-CB 3.34Å; D163-T165 WeakPolarHBondContact OD1-CG2 3.49Å; D163-T165 PolarHBondContact OD1-N 3.05Å; D163-T165 PolarHBondContact OD1-OG1 2.71Å; D163-T165 PolarHBondContact OD2-OG1 2.99Å; T165-H190 HydrophobicContact CG2-CB 4.13Å
166	N	95.1	Very high	95.9	Very high	28 Å²	28	42.2 Å²	42.2	15%	0.15	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-87.6	-6.9	174.9	-64.1	-42.5	0	0	0	113	V139 K141 D163 A164	V139-N166 HydrophobicContact CG1-CB 4.25Å; V139-N166 PolarHBondContact O-ND2 3.25Å; K141-N166 VanDerWaalsContact CA-OD1 3.25Å; K141-N166 WeakPolarHBondContact CA-OD1 3.49Å; K141-N166 VanDerWaalsContact CB-OD1 3.31Å; K141-N166 WeakPolarHBondContact CB-OD1 3.43Å; K141-N166 PolarHBondContact N-OD1 3.03Å; D163-N166 PolarHBondContact O-N 2.91Å; A164-N166 PolarHBondContact O-N 3.02Å
167	L	95.8	Very high	96	Very high	7 Å²	7	44.5 Å²	44.5	4%	0.037	22%	0.22	C	C	.	.	S	Bend	trans	-87.1	134.2	179.5	-61.9	177.1	0	0	0	111.2	V139 L143 L144 L152 V162 A164 L174 L187 P192	V139-L167 HydrophobicContact CG1-CD2 4.08Å; L143-L167 HydrophobicContact CD2-CD2 4.24Å; L144-L167 WeakPolarHBondContact CD2-O 3.47Å; L152-L167 HydrophobicContact CD2-CD2 4.12Å; V162-L167 HydrophobicContact CG1-CD1 4Å; V162-L167 HydrophobicContact CG1-CD2 4.11Å; V162-L167 HydrophobicContact CG1-CG 4.18Å; A164-L167 WeakPolarHBondContact O-CB 3.5Å; A164-L167 PolarHBondContact O-N 2.97Å; L167-L174 HydrophobicContact CD1-CD2 3.81Å; L167-L187 HydrophobicContact CD1-CD1 3.64Å; L167-P192 HydrophobicContact CB-CG 3.94Å; L167-P192 HydrophobicContact CD1-CG 4.2Å
168	P	94.3	Very high	96	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.013	23%	0.229	C	C	.	.			trans	-60.9	137	176	-26.8	37	0	0	0	112.2	L143 L149 T170 L171	L143-P168 HydrophobicContact CG-CG 4.08Å; L143-P168 WeakPolarHBondContact O-CG 3.4Å; L149-P168 HydrophobicContact CB-CB 4.43Å; L149-P168 HydrophobicContact CB-CG 4.26Å; L149-P168 HydrophobicContact CD2-CG 4.03Å; P168-T170 PolarHBondContact O-N 3.47Å; P168-T170 VanDerWaalsContact O-N 3.12Å; P168-L171 VanDerWaalsContact O-CB 3.3Å; P168-L171 WeakPolarHBondContact O-CB 3.29Å; P168-L171 PolarHBondContact O-N 2.84Å; P168-L171 VanDerWaalsContact O-N 3.15Å
169	P	93.5	Very high	96	Very high	102 Å²	102	39.7 Å²	39.7	66%	0.662	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-11.5	-178.9	28.1	-35.7	0	0	0	113.5	L171 S194	P169-L171 VanDerWaalsContact C-N 3.29Å; P169-S194 PolarHBondContact O-OG 3.38Å
170	T	95.6	Very high	96.1	Very high	51 Å²	51	42.5 Å²	42.5	31%	0.313	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-6.9	176.3	49.8	0	0	0	0	113.6	L149 P168	L149-T170 CarbonylContact O-C 3.55Å; L149-T170 WeakPolarHBondContact O-CB 3.49Å; L149-T170 PolarHBondContact O-OG1 3.31Å; P168-T170 PolarHBondContact O-N 3.47Å; P168-T170 VanDerWaalsContact O-N 3.12Å
171	L	97.4	Very high	96.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.196	C	C	.	.			trans	-63.9	137.8	-173.4	-153.3	77.2	0	0	0	111.3	L149 L152 P168 P169 L174 P192 S194 L195	L149-L171 HydrophobicContact CD2-CD1 4.2Å; L149-L171 HydrophobicContact CG-CD1 4.12Å; L149-L171 PolarHBondContact O-N 2.93Å; L152-L171 HydrophobicContact CB-CD1 3.73Å; L152-L171 HydrophobicContact CB-CD2 4.39Å; P168-L171 VanDerWaalsContact O-CB 3.3Å; P168-L171 WeakPolarHBondContact O-CB 3.29Å; P168-L171 PolarHBondContact O-N 2.84Å; P168-L171 VanDerWaalsContact O-N 3.15Å; P169-L171 VanDerWaalsContact C-N 3.29Å; L171-L174 HydrophobicContact CD2-CB 3.78Å; L171-L174 HydrophobicContact CD2-CD1 4.09Å; L171-L174 HydrophobicContact CD2-CD2 4.44Å; L171-L174 HydrophobicContact CD2-CG 4.33Å; L171-P192 HydrophobicContact CB-CB 4.22Å; L171-P192 HydrophobicContact CB-CG 4.35Å; L171-S194 CarbonylContact O-C 3.57Å; L171-S194 PolarHBondContact O-OG 3Å; L171-L195 HydrophobicContact CB-CD1 4.19Å; L171-L195 HydrophobicContact CD2-CD1 3.83Å; L171-L195 HydrophobicContact CG-CD1 4Å; L171-L195 PolarHBondContact O-N 2.86Å
172	K	98.2	Very high	96.1	Very high	71 Å²	71	35 Å²	35	31%	0.309	20%	0.197	S	C	.	.			trans	-121	-30.4	177.6	-63.6	178.4	-173.1	163.3	0	111.6	E150 Q196 H197	E150-K172 HydrophobicContact CB-CD 4.42Å; E150-K172 WeakPolarHBondContact O-CA 3.45Å; E150-K172 PolarHBondContact O-N 3.35Å; E150-K172 IonicContact OE1-NZ 3.29Å; E150-K172 WeakPolarHBondContact OE2-CE 3.44Å; E150-K172 IonicContact OE2-NZ 3.43Å; E150-K172 PolarHBondContact OE2-NZ 2.91Å; K172-Q196 PolarHBondContact O-N 2.96Å; K172-H197 PolarHBondContact O-N 2.99Å
173	V	98.6	Very high	96.1	Very high	40 Å²	40	36.6 Å²	36.6	24%	0.242	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	122	-178.7	-178.7	0	0	0	0	108.4	E150 E151 L152 H197	E150-V173 PolarHBondContact O-N 2.72Å; E151-V173 WeakPolarHBondContact CA-O 3.33Å; E151-V173 HydrophobicContact CB-CB 4.09Å; E151-V173 HydrophobicContact CG-CB 3.94Å; E151-V173 HydrophobicContact CG-CG1 3.98Å; L152-V173 PolarHBondContact N-O 2.92Å; V173-H197 HydrophobicContact CB-CB 4.46Å; V173-H197 HydrophobicContact CG1-CB 4.19Å; V173-H197 HydrophobicContact CG2-CB 4.23Å
174	L	98.4	Very high	96.1	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	119.1	172	179.8	58	0	0	0	108.7	L152 L167 L171 L176 L187 L195 H197 L198 G199	L152-L174 HydrophobicContact CB-CD1 4.24Å; L152-L174 HydrophobicContact CD2-CD1 3.92Å; L152-L174 HydrophobicContact CG-CD1 4.21Å; L167-L174 HydrophobicContact CD1-CD2 3.81Å; L171-L174 HydrophobicContact CD2-CB 3.78Å; L171-L174 HydrophobicContact CD2-CD1 4.09Å; L171-L174 HydrophobicContact CD2-CD2 4.44Å; L171-L174 HydrophobicContact CD2-CG 4.33Å; L174-L176 HydrophobicContact CD1-CD1 4.29Å; L174-L176 HydrophobicContact CD1-CD2 4.49Å; L174-L176 HydrophobicContact CD1-CG 4.14Å; L174-L176 HydrophobicContact CD2-CD1 3.86Å; L174-L176 HydrophobicContact CG-CD1 3.9Å; L174-L176 HydrophobicContact CG-CG 4.09Å; L174-L187 HydrophobicContact CD2-CD1 3.98Å; L174-L195 HydrophobicContact CB-CD1 3.92Å; L174-L195 HydrophobicContact CB-CD2 4.27Å; L174-H197 PolarHBondContact N-O 2.77Å; L174-L198 HydrophobicContact CB-CD1 4.2Å; L174-L198 HydrophobicContact CD2-CD1 3.96Å; L174-L198 HydrophobicContact CG-CD1 4.15Å; L174-L198 CarbonylContact O-C 3.54Å; L174-L198 WeakPolarHBondContact O-CA 3.13Å; L174-G199 PolarHBondContact O-N 2.78Å
175	E	98.3	Very high	96	Very high	33 Å²	33	39.1 Å²	39.1	15%	0.154	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	115.8	179.5	178.9	57.8	-92.8	0	0	110	L152 V153 L154 S155 Y177 H197 G199	L152-E175 PolarHBondContact O-N 2.97Å; V153-E175 HydrophobicContact CB-CB 4.39Å; V153-E175 HydrophobicContact CG1-CB 4.19Å; V153-E175 HydrophobicContact CG1-CG 4.1Å; V153-E175 HydrophobicContact CG2-CB 4.22Å; L154-E175 PolarHBondContact N-O 2.74Å; S155-E175 WeakPolarHBondContact OG-CG 3.18Å; E175-Y177 WeakPolarHBondContact OE1-CB 3.32Å; E175-Y177 PolarHBondContact OE1-N 3.15Å; E175-H197 IonicContact OE2-NE2 2.7Å; E175-H197 PolarHBondContact OE2-NE2 3.39Å; E175-G199 WeakPolarHBondContact OE1-CA 3.4Å
176	L	98	Very high	95.9	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.211	C	C	.	.			trans	-122.8	19.2	-176.7	-66.9	160.8	0	0	0	111.5	L154 I159 V162 L174 G178 N179 I181 G199 L200 N203	L154-L176 HydrophobicContact CB-CD2 3.98Å; L154-L176 HydrophobicContact CD1-CD2 3.97Å; I159-L176 HydrophobicContact CD1-CD2 4.14Å; V162-L176 HydrophobicContact CG2-CD1 4Å; V162-L176 HydrophobicContact CG2-CD2 3.96Å; L174-L176 HydrophobicContact CD1-CD1 4.29Å; L174-L176 HydrophobicContact CD1-CD2 4.49Å; L174-L176 HydrophobicContact CD1-CG 4.14Å; L174-L176 HydrophobicContact CD2-CD1 3.86Å; L174-L176 HydrophobicContact CG-CD1 3.9Å; L174-L176 HydrophobicContact CG-CG 4.09Å; L176-G178 PolarHBondContact O-N 2.89Å; L176-N179 PolarHBondContact O-ND2 3.45Å; L176-I181 HydrophobicContact CB-CD1 4.01Å; L176-I181 HydrophobicContact CD1-CD1 3.9Å; L176-I181 HydrophobicContact CD2-CD1 4.29Å; L176-I181 HydrophobicContact CG-CD1 4.3Å; L176-G199 WeakPolarHBondContact CA-O 3.39Å; L176-G199 WeakPolarHBondContact CB-O 3.24Å; L176-G199 PolarHBondContact N-O 2.86Å; L176-L200 HydrophobicContact CB-CD2 3.98Å; L176-L200 HydrophobicContact CD1-CD2 3.82Å; L176-N203 PolarHBondContact O-ND2 3.34Å; L176-N203 VanDerWaalsContact O-ND2 3.07Å
177	Y	97.9	Very high	95.7	Very high	95 Å²	95	36.9 Å²	36.9	37%	0.373	21%	0.206	S	C	.	.			trans	-50.5	134.1	177.7	-179.6	-82.7	0	0	0	113.4	S155 A156 E175 G201 H202	S155-Y177 CarbonylContact C-O 3.59Å; S155-Y177 WeakPolarHBondContact CA-O 3.43Å; S155-Y177 WeakPolarHBondContact CB-O 3.47Å; A156-Y177 PolarHBondContact N-O 3.41Å; E175-Y177 WeakPolarHBondContact OE1-CB 3.32Å; E175-Y177 PolarHBondContact OE1-N 3.15Å; Y177-G201 CarbonylContact C-O 3.44Å; Y177-G201 VanDerWaalsContact CA-O 3.24Å; Y177-G201 WeakPolarHBondContact CA-O 3.24Å; Y177-H202 HydrophobicContact CE1-CB 4.46Å; Y177-H202 HydrophobicContact CE2-CB 4.33Å; Y177-H202 AromaticContact CE2-CD2 3.14Å; Y177-H202 WeakPolarHBondContact CE2-CD2 3.3Å; Y177-H202 AromaticContact CE2-CG 3.97Å; Y177-H202 AromaticContact CE2-NE2 3.85Å; Y177-H202 AromaticContact CZ-CD2 3.17Å; Y177-H202 AromaticContact CZ-CG 3.73Å; Y177-H202 AromaticContact CZ-NE2 3.65Å; Y177-H202 PolarHBondContact OH-CD2 3.47Å; Y177-H202 PolarHBondContact OH-NE2 3.41Å
178	G	97.5	Very high	95.5	Very high	23 Å²	23	36.7 Å²	36.7	24%	0.237	21%	0.206	C	C	.	.	S	Bend	trans	68.3	54.3	174.8	0	0	0	0	0	112.6	A156 N157 L176 G201 H202	A156-G178 CarbonylContact C-O 3.6Å; A156-G178 WeakPolarHBondContact CA-O 3.09Å; A156-G178 PolarHBondContact N-O 3.31Å; N157-G178 PolarHBondContact N-O 3.32Å; L176-G178 PolarHBondContact O-N 2.89Å; G178-G201 PolarHBondContact N-O 3.46Å; G178-H202 VanDerWaalsContact CA-O 3.24Å; G178-H202 WeakPolarHBondContact CA-O 3.39Å; G178-H202 PolarHBondContact N-O 3.07Å
179	N	98.1	Very high	95.3	Very high	9 Å²	9	39.5 Å²	39.5	5%	0.048	23%	0.229	C	C	.	.	S	Bend	trans	-123.7	-166.3	174.2	-83.8	-80.3	0	0	0	109.6	L154 N157 R158 I159 L176 I181 H202 N203	L154-N179 PolarHBondContact O-ND2 3.45Å; N157-N179 WeakPolarHBondContact CA-OD1 3.14Å; N157-N179 VanDerWaalsContact CB-OD1 3.22Å; N157-N179 WeakPolarHBondContact CB-OD1 3.34Å; N157-N179 PolarHBondContact N-OD1 2.86Å; N157-N179 PolarHBondContact O-OD1 3.32Å; R158-N179 PolarHBondContact N-OD1 3.33Å; I159-N179 HydrophobicContact CB-CB 4.35Å; I159-N179 WeakPolarHBondContact CB-OD1 3.33Å; I159-N179 WeakPolarHBondContact CG1-OD1 3.44Å; I159-N179 PolarHBondContact N-OD1 2.88Å; L176-N179 PolarHBondContact O-ND2 3.45Å; N179-I181 HydrophobicContact CB-CD1 4.45Å; N179-I181 HydrophobicContact CB-CG1 4.25Å; N179-H202 PolarHBondContact N-O 2.8Å; N179-N203 WeakPolarHBondContact CA-OD1 3.42Å; N179-N203 WeakPolarHBondContact CB-OD1 3.27Å; N179-N203 PolarHBondContact N-OD1 3Å; N179-N203 PolarHBondContact O-OD1 3.26Å
180	E	96.8	Very high	95	Very high	58 Å²	58	40.9 Å²	40.9	27%	0.271	23%	0.226	S	C	.	.			trans	-115.9	29.9	-179	-62	-177.2	-149.7	0	0	111.9	I159 K160 S182 N203 K204	I159-E180 CarbonylContact O-C 3.33Å; I159-E180 VanDerWaalsContact O-C 3.31Å; I159-E180 WeakPolarHBondContact O-CA 3.4Å; I159-E180 PolarHBondContact O-N 3.22Å; K160-E180 WeakPolarHBondContact CE-OE2 3.49Å; K160-E180 HydrophobicContact CG-CB 4Å; E180-S182 PolarHBondContact O-N 3.48Å; E180-N203 PolarHBondContact N-OD1 2.84Å; E180-K204 HydrophobicContact CB-CD 4.46Å; E180-K204 IonicContact OE2-NZ 2.77Å; E180-K204 PolarHBondContact OE2-NZ 3.11Å
181	I	96.4	Very high	94.8	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.026	22%	0.221	C	C	.	.			trans	-72.2	123.6	-176	-58.2	171.9	0	0	0	109.7	I159 K160 V162 L176 N179 S183 L200 N203 K204 L205	I159-I181 HydrophobicContact CG2-CG1 4.49Å; I159-I181 WeakPolarHBondContact O-CG1 3.22Å; I159-I181 PolarHBondContact O-N 3.4Å; K160-I181 WeakPolarHBondContact O-CA 3.28Å; V162-I181 HydrophobicContact CG2-CD1 4.17Å; L176-I181 HydrophobicContact CB-CD1 4.01Å; L176-I181 HydrophobicContact CD1-CD1 3.9Å; L176-I181 HydrophobicContact CD2-CD1 4.29Å; L176-I181 HydrophobicContact CG-CD1 4.3Å; N179-I181 HydrophobicContact CB-CD1 4.45Å; N179-I181 HydrophobicContact CB-CG1 4.25Å; I181-S183 WeakPolarHBondContact CG2-O 3.37Å; I181-L200 HydrophobicContact CD1-CD2 3.78Å; I181-N203 HydrophobicContact CB-CB 4.27Å; I181-N203 WeakPolarHBondContact CB-OD1 3.33Å; I181-N203 WeakPolarHBondContact CG1-OD1 3.18Å; I181-N203 PolarHBondContact N-OD1 3.37Å; I181-K204 CarbonylContact O-C 3.54Å; I181-K204 VanDerWaalsContact O-C 3.28Å; I181-K204 WeakPolarHBondContact O-CA 3.45Å; I181-K204 PolarHBondContact O-N 3.32Å; I181-L205 HydrophobicContact CG2-CD2 4.02Å; I181-L205 PolarHBondContact O-N 3.21Å
182	S	94.1	Very high	94.6	Very high	74 Å²	74	40.2 Å²	40.2	52%	0.517	22%	0.223	S	C	.	.			trans	-102.2	-16.2	-179.5	57.3	0	0	0	0	114.5	E180 K204	E180-S182 PolarHBondContact O-N 3.48Å; S182-K204 WeakPolarHBondContact CA-O 3.44Å
183	S	93.2	Very high	94.2	Very high	38 Å²	38	39.9 Å²	39.9	27%	0.266	23%	0.233	S	C	.	.			trans	-152.3	149.8	175.5	-171.9	0	0	0	0	113.3	I181 E185 E210	I181-S183 WeakPolarHBondContact CG2-O 3.37Å; S183-E185 PolarHBondContact OG-N 3.13Å; S183-E210 VanDerWaalsContact CA-OE1 3.27Å; S183-E210 WeakPolarHBondContact CA-OE1 3.33Å; S183-E210 WeakPolarHBondContact CB-OE1 3.27Å; S183-E210 PolarHBondContact OG-OE1 3.35Å
184	M	93.7	Very high	94	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	24%	0.235	C	C	.	.	S	Bend	trans	-87	-2.6	174.7	-63.5	179.9	64.7	0	0	114.3	C186 L187 C188 L198 L200 L205 E210 Y213 V214 L227	M184-C186 PolarHBondContact O-N 3.22Å; M184-L187 WeakPolarHBondContact O-CB 3.18Å; M184-L187 PolarHBondContact O-N 2.96Å; M184-L187 VanDerWaalsContact O-N 3.11Å; M184-C188 PolarHBondContact O-N 2.9Å; M184-C188 PolarHBondContact O-SG 2.82Å; M184-L198 HydrophobicContact CE-CD2 3.93Å; M184-L200 HydrophobicContact CE-CD1 3.74Å; M184-L200 HydrophobicContact CG-CD1 4.01Å; M184-L200 HydrophobicContact SD-CD1 3.88Å; M184-L205 HydrophobicContact CG-CD1 4.16Å; M184-L205 HydrophobicContact CG-CD2 3.96Å; M184-L205 HydrophobicContact SD-CD1 4.24Å; M184-E210 VanDerWaalsContact CB-OE2 3.31Å; M184-E210 WeakPolarHBondContact CB-OE2 3.32Å; M184-E210 VanDerWaalsContact CG-OE2 3.25Å; M184-E210 WeakPolarHBondContact CG-OE2 3.25Å; M184-E210 PolarHBondContact N-OE2 3.31Å; M184-Y213 HydrophobicContact CB-CD2 3.86Å; M184-Y213 HydrophobicContact CB-CG 3.92Å; M184-V214 HydrophobicContact CE-CG1 3.86Å; M184-V214 HydrophobicContact SD-CG1 3.97Å; M184-L227 HydrophobicContact SD-CD2 4.18Å
185	E	92.1	Very high	93.9	Very high	116 Å²	116	39.9 Å²	39.9	54%	0.542	24%	0.235	S	C	.	.	H	α-helix	trans	-51.1	-54.9	-174	-174.5	175.6	-167.5	0	0	113.1	S183 L187 C188 A189 Y213	S183-E185 PolarHBondContact OG-N 3.13Å; E185-L187 VanDerWaalsContact C-N 3.25Å; E185-L187 PolarHBondContact O-N 3.15Å; E185-C188 PolarHBondContact O-N 3.11Å; E185-A189 PolarHBondContact O-N 3.11Å; E185-Y213 HydrophobicContact CB-CE1 4.03Å; E185-Y213 HydrophobicContact CB-CE2 4.16Å; E185-Y213 WeakPolarHBondContact CB-OH 3.43Å; E185-Y213 HydrophobicContact CG-CE1 4.14Å; E185-Y213 WeakPolarHBondContact CG-OH 3.34Å
186	C	90.9	Very high	93.9	Very high	39 Å²	39	42.7 Å²	42.7	26%	0.264	25%	0.248	S	C	.	.	H	α-helix	trans	-69.5	-26.1	-176.5	-58.4	0	0	0	0	112.9	E161 V162 A164 M184 C188	E161-C186 VanDerWaalsContact CD-SG 3.52Å; E161-C186 HydrophobicContact CG-CB 3.74Å; E161-C186 VanDerWaalsContact OE1-CB 3.28Å; E161-C186 WeakPolarHBondContact OE1-CB 3.49Å; E161-C186 PolarHBondContact OE1-SG 3.42Å; V162-C186 CarbonylContact O-C 3.6Å; V162-C186 VanDerWaalsContact O-C 3.25Å; A164-C186 PolarHBondContact N-O 2.91Å; M184-C186 PolarHBondContact O-N 3.22Å; C186-C188 VanDerWaalsContact C-N 3.29Å
187	L	92.1	Very high	93.9	Very high	8 Å²	8	44.8 Å²	44.8	4%	0.042	26%	0.258	C	S	.	.	H	α-helix	trans	-73	-25.6	173.8	-173.1	64.5	0	0	0	111.6	V162 A164 L167 L174 M184 E185 L198 L200 W219	V162-L187 HydrophobicContact CB-CD1 4.16Å; V162-L187 HydrophobicContact CG1-CD1 3.84Å; V162-L187 WeakPolarHBondContact O-CA 3.45Å; V162-L187 PolarHBondContact O-N 3.38Å; A164-L187 VanDerWaalsContact CB-O 3.27Å; A164-L187 WeakPolarHBondContact CB-O 3.34Å; L167-L187 HydrophobicContact CD1-CD1 3.64Å; L174-L187 HydrophobicContact CD2-CD1 3.98Å; M184-L187 WeakPolarHBondContact O-CB 3.18Å; M184-L187 PolarHBondContact O-N 2.96Å; M184-L187 VanDerWaalsContact O-N 3.11Å; E185-L187 VanDerWaalsContact C-N 3.25Å; E185-L187 PolarHBondContact O-N 3.15Å; L187-L198 HydrophobicContact CD2-CD1 4.02Å; L187-L198 HydrophobicContact CD2-CD2 4.18Å; L187-L200 HydrophobicContact CD2-CD1 4.36Å; L187-W219 HydrophobicContact CD1-CH2 4.35Å; L187-W219 HydrophobicContact CD2-CH2 4.2Å; L187-W219 HydrophobicContact CD2-CZ2 4.13Å; L187-W219 HydrophobicContact CG-CH2 3.81Å; L187-W219 HydrophobicContact CG-CZ2 3.9Å
188	C	91.3	Very high	94	Very high	4 Å²	4	40.2 Å²	40.2	3%	0.027	24%	0.24	C	C	.	.	H	α-helix	trans	-97	-5.5	-176.6	-66.3	0	0	0	0	114.3	M184 E185 C186 P191 Y213 H218	M184-C188 PolarHBondContact O-N 2.9Å; M184-C188 PolarHBondContact O-SG 2.82Å; E185-C188 PolarHBondContact O-N 3.11Å; C186-C188 VanDerWaalsContact C-N 3.29Å; C188-P191 WeakPolarHBondContact O-CD 3.47Å; C188-Y213 HydrophobicContact CB-CD1 3.81Å; C188-Y213 HydrophobicContact CB-CG 4.45Å; C188-Y213 VanDerWaalsContact SG-CB 3.59Å; C188-H218 HydrophobicContact CB-CB 4.4Å; C188-H218 PolarHBondContact O-CE1 2.93Å; C188-H218 PolarHBondContact O-ND1 3Å
189	A	89.8	Confident	94	Very high	60 Å²	60	39.1 Å²	39.1	50%	0.496	23%	0.229	S	C	.	.	S	Bend	trans	-63.5	-45.1	177.5	0	0	0	0	0	112.7	E185	E185-A189 PolarHBondContact O-N 3.11Å
190	H	87.6	Confident	94	Very high	132 Å²	132	38.8 Å²	38.8	61%	0.611	23%	0.227	S	C	*	.	S	Bend	trans	-144.3	62.7	179.1	-63.5	93.7	0	0	0	111.9	A164 T165	A164-H190 HydrophobicContact CB-CB 4.49Å; A164-H190 VanDerWaalsContact CB-O 3.28Å; A164-H190 WeakPolarHBondContact CB-O 3.48Å; T165-H190 HydrophobicContact CG2-CB 4.13Å
191	P	90.9	Very high	94	Very high	30 Å²	30	36 Å²	36	20%	0.195	21%	0.214	C	C	.	.			trans	-68.5	149	-170.8	27.4	-34.6	0	0	0	112.5	C188 A193 H218 W219	C188-P191 WeakPolarHBondContact O-CD 3.47Å; P191-A193 PolarHBondContact O-N 2.96Å; P191-A193 VanDerWaalsContact O-N 3.1Å; P191-H218 HydrophobicContact CG-CB 4.29Å; P191-H218 WeakPolarHBondContact CG-O 3.14Å; P191-W219 HydrophobicContact CB-CD2 4.42Å; P191-W219 HydrophobicContact CB-CE3 3.9Å; P191-W219 HydrophobicContact CB-CH2 3.4Å; P191-W219 HydrophobicContact CB-CZ2 3.96Å; P191-W219 HydrophobicContact CB-CZ3 3.36Å
192	P	92.4	Very high	94	Very high	6 Å²	6	39 Å²	39	4%	0.039	23%	0.228	C	C	.	.			trans	-62.5	111.8	171.7	-21.4	32.5	0	0	0	111.3	L167 L171 S194 L195	L167-P192 HydrophobicContact CB-CG 3.94Å; L167-P192 HydrophobicContact CD1-CG 4.2Å; L171-P192 HydrophobicContact CB-CB 4.22Å; L171-P192 HydrophobicContact CB-CG 4.35Å; P192-S194 PolarHBondContact O-N 2.79Å; P192-S194 VanDerWaalsContact O-N 3.08Å; P192-L195 HydrophobicContact CB-CB 4.5Å; P192-L195 VanDerWaalsContact O-CB 3.3Å; P192-L195 WeakPolarHBondContact O-CB 3.38Å; P192-L195 PolarHBondContact O-N 2.81Å
193	A	90.5	Very high	94.2	Very high	65 Å²	65	35.9 Å²	35.9	54%	0.537	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-22.6	-174.3	0	0	0	0	0	114	P191 L195 N221	P191-A193 PolarHBondContact O-N 2.96Å; P191-A193 VanDerWaalsContact O-N 3.1Å; A193-L195 VanDerWaalsContact C-N 3.35Å; A193-N221 PolarHBondContact O-ND2 2.9Å
194	S	93.6	Very high	94.2	Very high	38 Å²	38	39 Å²	39	27%	0.266	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	1.8	177.7	55.5	0	0	0	0	114.4	P169 L171 P192 Q196	P169-S194 PolarHBondContact O-OG 3.38Å; L171-S194 CarbonylContact O-C 3.57Å; L171-S194 PolarHBondContact O-OG 3Å; P192-S194 PolarHBondContact O-N 2.79Å; P192-S194 VanDerWaalsContact O-N 3.08Å; S194-Q196 WeakPolarHBondContact O-CG 3.44Å; S194-Q196 PolarHBondContact O-N 3.11Å
195	L	97.4	Very high	94.3	Very high	2 Å²	2	39 Å²	39	1%	0.01	21%	0.213	C	C	.	.			trans	-63.1	129.8	-178	-154.7	79.4	0	0	0	110.6	L171 L174 P192 A193 L198 W219 N221	L171-L195 HydrophobicContact CB-CD1 4.19Å; L171-L195 HydrophobicContact CD2-CD1 3.83Å; L171-L195 HydrophobicContact CG-CD1 4Å; L171-L195 PolarHBondContact O-N 2.86Å; L174-L195 HydrophobicContact CB-CD1 3.92Å; L174-L195 HydrophobicContact CB-CD2 4.27Å; P192-L195 HydrophobicContact CB-CB 4.5Å; P192-L195 VanDerWaalsContact O-CB 3.3Å; P192-L195 WeakPolarHBondContact O-CB 3.38Å; P192-L195 PolarHBondContact O-N 2.81Å; A193-L195 VanDerWaalsContact C-N 3.35Å; L195-L198 HydrophobicContact CD2-CB 3.97Å; L195-L198 HydrophobicContact CD2-CD1 4.28Å; L195-W219 HydrophobicContact CB-CE3 4.28Å; L195-W219 HydrophobicContact CB-CZ3 4.24Å; L195-W219 HydrophobicContact CD2-CE3 3.87Å; L195-W219 HydrophobicContact CD2-CH2 4.28Å; L195-W219 HydrophobicContact CD2-CZ3 3.46Å; L195-W219 VanDerWaalsContact CD2-CZ3 3.46Å; L195-W219 HydrophobicContact CG-CZ3 4.47Å; L195-N221 CarbonylContact O-C 3.44Å
196	Q	98.2	Very high	94	Very high	93 Å²	93	38.3 Å²	38.3	44%	0.435	21%	0.213	S	C	.	.			trans	-115.4	-28.9	-178.6	-63.4	178.8	9.9	0	0	111.6	K172 S194 V223 S224	K172-Q196 PolarHBondContact O-N 2.96Å; S194-Q196 WeakPolarHBondContact O-CG 3.44Å; S194-Q196 PolarHBondContact O-N 3.11Å; Q196-V223 HydrophobicContact CB-CG2 4.39Å; Q196-V223 WeakPolarHBondContact O-CA 3.39Å; Q196-V223 PolarHBondContact O-N 2.97Å; Q196-S224 PolarHBondContact O-N 3.45Å
197	H	98.5	Very high	93.4	Very high	43 Å²	43	37 Å²	37	20%	0.199	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	128.9	177.7	176.2	89.4	0	0	0	110.3	K172 V173 L174 E175 S224	K172-H197 PolarHBondContact O-N 2.99Å; V173-H197 HydrophobicContact CB-CB 4.46Å; V173-H197 HydrophobicContact CG1-CB 4.19Å; V173-H197 HydrophobicContact CG2-CB 4.23Å; L174-H197 PolarHBondContact N-O 2.77Å; E175-H197 IonicContact OE2-NE2 2.7Å; E175-H197 PolarHBondContact OE2-NE2 3.39Å; H197-S224 WeakPolarHBondContact CA-O 3.16Å; H197-S224 VanDerWaalsContact ND1-CB 3.25Å; H197-S224 WeakPolarHBondContact ND1-CB 3.31Å; H197-S224 PolarHBondContact ND1-OG 3Å
198	L	98.3	Very high	92.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	116.1	172.8	178.7	58.8	0	0	0	109	L174 M184 L187 L195 L200 W219 L222 S224 L225 D226	L174-L198 HydrophobicContact CB-CD1 4.2Å; L174-L198 HydrophobicContact CD2-CD1 3.96Å; L174-L198 HydrophobicContact CG-CD1 4.15Å; L174-L198 CarbonylContact O-C 3.54Å; L174-L198 WeakPolarHBondContact O-CA 3.13Å; M184-L198 HydrophobicContact CE-CD2 3.93Å; L187-L198 HydrophobicContact CD2-CD1 4.02Å; L187-L198 HydrophobicContact CD2-CD2 4.18Å; L195-L198 HydrophobicContact CD2-CB 3.97Å; L195-L198 HydrophobicContact CD2-CD1 4.28Å; L198-L200 HydrophobicContact CD1-CD1 4.13Å; L198-L200 HydrophobicContact CD1-CG 4.1Å; L198-L200 HydrophobicContact CD2-CD1 3.78Å; L198-L200 HydrophobicContact CG-CD1 3.87Å; L198-L200 HydrophobicContact CG-CG 4.13Å; L198-W219 HydrophobicContact CD2-CH2 4.43Å; L198-W219 HydrophobicContact CD2-CZ2 4.12Å; L198-L222 HydrophobicContact CB-CD1 3.96Å; L198-S224 PolarHBondContact N-O 3.07Å; L198-S224 VanDerWaalsContact N-O 3.11Å; L198-L225 HydrophobicContact CB-CD1 4.15Å; L198-L225 HydrophobicContact CD2-CD1 4.18Å; L198-L225 HydrophobicContact CG-CD1 4.23Å; L198-L225 WeakPolarHBondContact O-CA 3.16Å; L198-D226 PolarHBondContact O-N 3.39Å
199	G	98.1	Very high	92.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	121	173.5	0	0	0	0	0	110.9	L174 E175 L176	L174-G199 PolarHBondContact O-N 2.78Å; E175-G199 WeakPolarHBondContact OE1-CA 3.4Å; L176-G199 WeakPolarHBondContact CA-O 3.39Å; L176-G199 WeakPolarHBondContact CB-O 3.24Å; L176-G199 PolarHBondContact N-O 2.86Å
200	L	97.8	Very high	92.6	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	23%	0.229	C	C	.	.			trans	-134.2	18.7	-179.7	-77	166.3	0	0	0	110.8	L176 I181 M184 L187 L198 N203 L205 D226 L227 N230	L176-L200 HydrophobicContact CB-CD2 3.98Å; L176-L200 HydrophobicContact CD1-CD2 3.82Å; I181-L200 HydrophobicContact CD1-CD2 3.78Å; M184-L200 HydrophobicContact CE-CD1 3.74Å; M184-L200 HydrophobicContact CG-CD1 4.01Å; M184-L200 HydrophobicContact SD-CD1 3.88Å; L187-L200 HydrophobicContact CD2-CD1 4.36Å; L198-L200 HydrophobicContact CD1-CD1 4.13Å; L198-L200 HydrophobicContact CD1-CG 4.1Å; L198-L200 HydrophobicContact CD2-CD1 3.78Å; L198-L200 HydrophobicContact CG-CD1 3.87Å; L198-L200 HydrophobicContact CG-CG 4.13Å; L200-N203 PolarHBondContact O-ND2 3.08Å; L200-L205 HydrophobicContact CB-CD1 4.25Å; L200-L205 HydrophobicContact CD1-CD1 4.36Å; L200-D226 CarbonylContact C-O 3.34Å; L200-D226 WeakPolarHBondContact CA-O 3.47Å; L200-D226 PolarHBondContact N-O 3.1Å; L200-L227 HydrophobicContact CB-CD2 3.95Å; L200-L227 HydrophobicContact CD1-CD2 4.07Å; L200-N230 PolarHBondContact O-ND2 3.33Å
201	G	97.2	Very high	92.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.203	C	C	.	.			trans	-59.4	151.4	177.9	0	0	0	0	0	112.9	Y177 G178 N203 D226 G228	Y177-G201 CarbonylContact C-O 3.44Å; Y177-G201 VanDerWaalsContact CA-O 3.24Å; Y177-G201 WeakPolarHBondContact CA-O 3.24Å; G178-G201 PolarHBondContact N-O 3.46Å; G201-N203 PolarHBondContact O-N 2.94Å; G201-N203 PolarHBondContact O-ND2 3.1Å; G201-N203 VanDerWaalsContact O-ND2 3.11Å; G201-D226 PolarHBondContact N-O 3.13Å; G201-G228 CarbonylContact C-O 3.6Å; G201-G228 WeakPolarHBondContact CA-O 3.41Å
202	H	96.8	Very high	92.9	Very high	69 Å²	69	39.8 Å²	39.8	32%	0.319	22%	0.218	S	C	.	.	S	Bend	trans	49.8	54.3	-179	-68.1	-107.8	0	0	0	113.1	Y177 G178 N179 G228 F229	Y177-H202 HydrophobicContact CE1-CB 4.46Å; Y177-H202 HydrophobicContact CE2-CB 4.33Å; Y177-H202 AromaticContact CE2-CD2 3.14Å; Y177-H202 WeakPolarHBondContact CE2-CD2 3.3Å; Y177-H202 AromaticContact CE2-CG 3.97Å; Y177-H202 AromaticContact CE2-NE2 3.85Å; Y177-H202 AromaticContact CZ-CD2 3.17Å; Y177-H202 AromaticContact CZ-CG 3.73Å; Y177-H202 AromaticContact CZ-NE2 3.65Å; Y177-H202 PolarHBondContact OH-CD2 3.47Å; Y177-H202 PolarHBondContact OH-NE2 3.41Å; G178-H202 VanDerWaalsContact CA-O 3.24Å; G178-H202 WeakPolarHBondContact CA-O 3.39Å; G178-H202 PolarHBondContact N-O 3.07Å; N179-H202 PolarHBondContact N-O 2.8Å; H202-G228 PolarHBondContact N-O 2.8Å; H202-F229 AromaticContact CD2-CD2 3.79Å; H202-F229 AromaticContact CD2-CG 3.85Å; H202-F229 AromaticContact CE1-CD1 3.79Å; H202-F229 AromaticContact CE1-CD2 3.78Å; H202-F229 AromaticContact CE1-CG 3.48Å; H202-F229 VanDerWaalsContact CE1-CG 3.48Å; H202-F229 WeakPolarHBondContact CE1-CG 3.36Å; H202-F229 AromaticContact NE2-CD2 3.18Å; H202-F229 WeakPolarHBondContact NE2-CD2 3.27Å; H202-F229 AromaticContact NE2-CE2 3.79Å; H202-F229 AromaticContact NE2-CG 3.34Å; H202-F229 VanDerWaalsContact NE2-CG 3.34Å; H202-F229 WeakPolarHBondContact NE2-CG 3.18Å
203	N	97.3	Very high	93	Very high	8 Å²	8	41.5 Å²	41.5	4%	0.043	22%	0.224	C	C	.	.	S	Bend	trans	-116.4	-161.9	170.1	-83.5	-81.3	0	0	0	109.2	L176 N179 E180 I181 L200 G201 L205 N230	L176-N203 PolarHBondContact O-ND2 3.34Å; L176-N203 VanDerWaalsContact O-ND2 3.07Å; N179-N203 WeakPolarHBondContact CA-OD1 3.42Å; N179-N203 WeakPolarHBondContact CB-OD1 3.27Å; N179-N203 PolarHBondContact N-OD1 3Å; N179-N203 PolarHBondContact O-OD1 3.26Å; E180-N203 PolarHBondContact N-OD1 2.84Å; I181-N203 HydrophobicContact CB-CB 4.27Å; I181-N203 WeakPolarHBondContact CB-OD1 3.33Å; I181-N203 WeakPolarHBondContact CG1-OD1 3.18Å; I181-N203 PolarHBondContact N-OD1 3.37Å; L200-N203 PolarHBondContact O-ND2 3.08Å; G201-N203 PolarHBondContact O-N 2.94Å; G201-N203 PolarHBondContact O-ND2 3.1Å; G201-N203 VanDerWaalsContact O-ND2 3.11Å; N203-L205 HydrophobicContact CB-CG 4.44Å; N203-N230 VanDerWaalsContact CA-OD1 3.27Å; N203-N230 WeakPolarHBondContact CA-OD1 3.41Å; N203-N230 WeakPolarHBondContact CB-OD1 3.38Å; N203-N230 PolarHBondContact N-OD1 3.49Å; N203-N230 PolarHBondContact O-OD1 2.77Å
204	K	94.6	Very high	93.1	Very high	104 Å²	104	38.5 Å²	38.5	45%	0.452	20%	0.199	S	C	.	.			trans	-119.2	29.4	-178	-59.6	176.8	-178.4	169.8	0	111.2	E180 I181 S182 L206 N230	E180-K204 HydrophobicContact CB-CD 4.46Å; E180-K204 IonicContact OE2-NZ 2.77Å; E180-K204 PolarHBondContact OE2-NZ 3.11Å; I181-K204 CarbonylContact O-C 3.54Å; I181-K204 VanDerWaalsContact O-C 3.28Å; I181-K204 WeakPolarHBondContact O-CA 3.45Å; I181-K204 PolarHBondContact O-N 3.32Å; S182-K204 WeakPolarHBondContact CA-O 3.44Å; K204-L206 PolarHBondContact O-N 3.32Å; K204-N230 PolarHBondContact N-OD1 2.88Å
205	L	94.3	Very high	93.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.192	C	C	.	.			trans	-64.4	122.6	179.2	-61.2	176.9	0	0	0	108.7	I181 M184 L200 N203 E210 L227 N230 D231 L232	I181-L205 HydrophobicContact CG2-CD2 4.02Å; I181-L205 PolarHBondContact O-N 3.21Å; M184-L205 HydrophobicContact CG-CD1 4.16Å; M184-L205 HydrophobicContact CG-CD2 3.96Å; M184-L205 HydrophobicContact SD-CD1 4.24Å; L200-L205 HydrophobicContact CB-CD1 4.25Å; L200-L205 HydrophobicContact CD1-CD1 4.36Å; N203-L205 HydrophobicContact CB-CG 4.44Å; L205-E210 HydrophobicContact CB-CG 4.22Å; L205-L227 HydrophobicContact CD1-CD2 3.69Å; L205-N230 HydrophobicContact CB-CB 3.98Å; L205-N230 WeakPolarHBondContact CB-OD1 3.17Å; L205-N230 WeakPolarHBondContact CG-OD1 3.27Å; L205-N230 PolarHBondContact N-OD1 2.98Å; L205-D231 CarbonylContact O-C 3.52Å; L205-D231 VanDerWaalsContact O-CA 3.31Å; L205-D231 WeakPolarHBondContact O-CA 3.4Å; L205-D231 WeakPolarHBondContact O-CB 3.4Å; L205-D231 PolarHBondContact O-N 2.75Å; L205-L232 HydrophobicContact CB-CD2 4.26Å
206	L	86.9	Confident	93.1	Very high	102 Å²	102	38.9 Å²	38.9	53%	0.534	20%	0.203	S	C	.	.	B	Isolated β-bridge	trans	-122.6	133.7	-167.9	-178.9	69.4	0	0	0	112.1	K204 D231	K204-L206 PolarHBondContact O-N 3.32Å; L206-D231 HydrophobicContact CB-CB 4.49Å; L206-D231 HydrophobicContact CD1-CB 3.51Å
207	G	77.9	Confident	92.9	Very high	12 Å²	12	41.7 Å²	41.7	12%	0.124	22%	0.221	C	C	.	.	S	Bend	trans	78.4	-171.4	162.5	0	0	0	0	0	115.1	D231	G207-D231 PolarHBondContact N-O 3.25Å; G207-D231 VanDerWaalsContact N-O 3.07Å
208	P	77.7	Confident	92.7	Very high	65 Å²	65	42 Å²	42	42%	0.422	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-77.3	-23.3	-170.1	29.4	-35.1	0	0	0	113.7	E210 S211 D234	P208-E210 PolarHBondContact O-N 3.34Å; P208-S211 WeakPolarHBondContact O-CB 3.28Å; P208-S211 PolarHBondContact O-N 3.04Å; P208-S211 VanDerWaalsContact O-N 3.1Å; P208-S211 PolarHBondContact O-OG 3.01Å; P208-D234 HydrophobicContact CB-CB 3.81Å
209	L	87	Confident	92.6	Very high	113 Å²	113	42.2 Å²	42.2	59%	0.592	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-62.4	-28.4	-174.4	-67.2	176.2	0	0	0	112.9	S211 L212	L209-S211 PolarHBondContact O-N 3.21Å; L209-S211 VanDerWaalsContact O-N 3.16Å; L209-L212 HydrophobicContact CD2-CD1 4.06Å; L209-L212 VanDerWaalsContact O-CB 3.27Å; L209-L212 WeakPolarHBondContact O-CB 3.46Å; L209-L212 WeakPolarHBondContact O-CG 3.41Å; L209-L212 PolarHBondContact O-N 3.28Å
210	E	91.9	Very high	92.5	Very high	7 Å²	7	44.9 Å²	44.9	3%	0.033	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-63.9	-21.1	179.3	-61.4	-58.2	137.2	0	0	112.7	S183 M184 L205 P208 L212 Y213 L232	S183-E210 VanDerWaalsContact CA-OE1 3.27Å; S183-E210 WeakPolarHBondContact CA-OE1 3.33Å; S183-E210 WeakPolarHBondContact CB-OE1 3.27Å; S183-E210 PolarHBondContact OG-OE1 3.35Å; M184-E210 VanDerWaalsContact CB-OE2 3.31Å; M184-E210 WeakPolarHBondContact CB-OE2 3.32Å; M184-E210 VanDerWaalsContact CG-OE2 3.25Å; M184-E210 WeakPolarHBondContact CG-OE2 3.25Å; M184-E210 PolarHBondContact N-OE2 3.31Å; L205-E210 HydrophobicContact CB-CG 4.22Å; P208-E210 PolarHBondContact O-N 3.34Å; E210-L212 PolarHBondContact O-N 3.34Å; E210-Y213 PolarHBondContact O-N 2.57Å; E210-L232 HydrophobicContact CB-CD2 3.71Å; E210-L232 HydrophobicContact CG-CD2 4.16Å
211	S	91.1	Very high	92.4	Very high	7 Å²	7	48.3 Å²	48.3	5%	0.049	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-62.7	-25.8	172.4	76.9	0	0	0	0	112.7	P208 L209 Y213 V214 S237 S241	P208-S211 WeakPolarHBondContact O-CB 3.28Å; P208-S211 PolarHBondContact O-N 3.04Å; P208-S211 VanDerWaalsContact O-N 3.1Å; P208-S211 PolarHBondContact O-OG 3.01Å; L209-S211 PolarHBondContact O-N 3.21Å; L209-S211 VanDerWaalsContact O-N 3.16Å; S211-Y213 PolarHBondContact O-N 3.19Å; S211-V214 VanDerWaalsContact O-CG2 3.29Å; S211-V214 WeakPolarHBondContact O-CG2 3.4Å; S211-S237 WeakPolarHBondContact OG-CB 3.43Å; S211-S241 WeakPolarHBondContact O-CB 3.16Å; S211-S241 PolarHBondContact O-OG 3.46Å
212	L	93	Very high	92.4	Very high	100 Å²	100	48.4 Å²	48.4	52%	0.524	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-68.2	-25.1	-179.7	-60	173.9	0	0	0	112.3	L209 E210 T215	L209-L212 HydrophobicContact CD2-CD1 4.06Å; L209-L212 VanDerWaalsContact O-CB 3.27Å; L209-L212 WeakPolarHBondContact O-CB 3.46Å; L209-L212 WeakPolarHBondContact O-CG 3.41Å; L209-L212 PolarHBondContact O-N 3.28Å; E210-L212 PolarHBondContact O-N 3.34Å; L212-T215 WeakPolarHBondContact O-CG2 3.39Å
213	Y	94.1	Very high	92.5	Very high	42 Å²	42	47.7 Å²	47.7	17%	0.165	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-92.4	-11.3	-174.4	-61.9	-54	0	0	0	113.8	M184 E185 C188 E210 S211 T215 W219	M184-Y213 HydrophobicContact CB-CD2 3.86Å; M184-Y213 HydrophobicContact CB-CG 3.92Å; E185-Y213 HydrophobicContact CB-CE1 4.03Å; E185-Y213 HydrophobicContact CB-CE2 4.16Å; E185-Y213 WeakPolarHBondContact CB-OH 3.43Å; E185-Y213 HydrophobicContact CG-CE1 4.14Å; E185-Y213 WeakPolarHBondContact CG-OH 3.34Å; C188-Y213 HydrophobicContact CB-CD1 3.81Å; C188-Y213 HydrophobicContact CB-CG 4.45Å; C188-Y213 VanDerWaalsContact SG-CB 3.59Å; E210-Y213 PolarHBondContact O-N 2.57Å; S211-Y213 PolarHBondContact O-N 3.19Å; Y213-T215 PolarHBondContact O-N 3Å; Y213-W219 PolarHBondContact O-NE1 3.01Å
214	V	94.3	Very high	92.6	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.012	26%	0.264	C	S	.	.	S	Bend	trans	-101	53.1	-179.5	-67.8	0	0	0	0	112.1	M184 S211 L225 L227 M238 S241 L242	M184-V214 HydrophobicContact CE-CG1 3.86Å; M184-V214 HydrophobicContact SD-CG1 3.97Å; S211-V214 VanDerWaalsContact O-CG2 3.29Å; S211-V214 WeakPolarHBondContact O-CG2 3.4Å; V214-L225 HydrophobicContact CB-CD2 4.47Å; V214-L225 HydrophobicContact CG1-CD2 4.08Å; V214-L227 HydrophobicContact CG1-CD1 4.15Å; V214-M238 HydrophobicContact CG2-CE 4.24Å; V214-M238 HydrophobicContact CG2-SD 3.68Å; V214-S241 CarbonylContact O-C 3.42Å; V214-L242 HydrophobicContact CB-CD2 4.16Å; V214-L242 HydrophobicContact CG2-CD2 4.27Å
215	T	95.5	Very high	92.8	Very high	20 Å²	20	43.3 Å²	43.3	12%	0.123	24%	0.243	C	C	.	.	S	Bend	trans	-118.8	162.5	-178.1	67.3	0	0	0	0	112.3	L212 Y213 D217 H218 W219 T244 L245	L212-T215 WeakPolarHBondContact O-CG2 3.39Å; Y213-T215 PolarHBondContact O-N 3Å; T215-D217 PolarHBondContact O-N 3.12Å; T215-H218 PolarHBondContact O-N 3.14Å; T215-H218 PolarHBondContact OG1-CD2 3.18Å; T215-W219 PolarHBondContact O-N 2.78Å; T215-T244 VanDerWaalsContact CA-OG1 3.3Å; T215-T244 WeakPolarHBondContact CA-OG1 3.45Å; T215-L245 VanDerWaalsContact C-CD2 3.45Å
216	A	94.8	Very high	93	Very high	29 Å²	29	44.6 Å²	44.6	24%	0.24	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-17.9	177.1	0	0	0	0	0	114.1	H218 P220 T244 L245	A216-H218 VanDerWaalsContact C-N 3.28Å; A216-P220 WeakPolarHBondContact O-CA 3.46Å; A216-P220 WeakPolarHBondContact O-CB 3.5Å; A216-P220 WeakPolarHBondContact O-CD 3.41Å; A216-T244 WeakPolarHBondContact CB-O 3.33Å; A216-T244 PolarHBondContact N-OG1 2.97Å; A216-L245 HydrophobicContact CB-CD2 4.37Å
217	D	94.1	Very high	93.5	Very high	151 Å²	151	39.8 Å²	39.8	81%	0.807	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-34.1	174.8	-66.4	-23.2	0	0	0	110.9	T215	T215-D217 PolarHBondContact O-N 3.12Å
218	H	94.5	Very high	94.4	Very high	51 Å²	51	39.2 Å²	39.2	24%	0.236	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-40.4	175.1	-60.5	-64	0	0	0	112.5	C188 P191 T215 A216 P220	C188-H218 HydrophobicContact CB-CB 4.4Å; C188-H218 PolarHBondContact O-CE1 2.93Å; C188-H218 PolarHBondContact O-ND1 3Å; P191-H218 HydrophobicContact CG-CB 4.29Å; P191-H218 WeakPolarHBondContact CG-O 3.14Å; T215-H218 PolarHBondContact O-N 3.14Å; T215-H218 PolarHBondContact OG1-CD2 3.18Å; A216-H218 VanDerWaalsContact C-N 3.28Å; H218-P220 VanDerWaalsContact C-CD 3.49Å; H218-P220 WeakPolarHBondContact O-CD 3.41Å
219	W	95.8	Very high	95.3	Very high	3 Å²	3	38.1 Å²	38.1	1%	0.011	21%	0.207	C	C	.	.			trans	-128.2	60	-168.4	-48.9	105.9	0	0	0	113.6	L187 P191 L195 L198 Y213 T215 N221 L222 L245	L187-W219 HydrophobicContact CD1-CH2 4.35Å; L187-W219 HydrophobicContact CD2-CH2 4.2Å; L187-W219 HydrophobicContact CD2-CZ2 4.13Å; L187-W219 HydrophobicContact CG-CH2 3.81Å; L187-W219 HydrophobicContact CG-CZ2 3.9Å; P191-W219 HydrophobicContact CB-CD2 4.42Å; P191-W219 HydrophobicContact CB-CE3 3.9Å; P191-W219 HydrophobicContact CB-CH2 3.4Å; P191-W219 HydrophobicContact CB-CZ2 3.96Å; P191-W219 HydrophobicContact CB-CZ3 3.36Å; L195-W219 HydrophobicContact CB-CE3 4.28Å; L195-W219 HydrophobicContact CB-CZ3 4.24Å; L195-W219 HydrophobicContact CD2-CE3 3.87Å; L195-W219 HydrophobicContact CD2-CH2 4.28Å; L195-W219 HydrophobicContact CD2-CZ3 3.46Å; L195-W219 VanDerWaalsContact CD2-CZ3 3.46Å; L195-W219 HydrophobicContact CG-CZ3 4.47Å; L198-W219 HydrophobicContact CD2-CH2 4.43Å; L198-W219 HydrophobicContact CD2-CZ2 4.12Å; Y213-W219 PolarHBondContact O-NE1 3.01Å; T215-W219 PolarHBondContact O-N 2.78Å; W219-N221 PolarHBondContact O-N 2.93Å; W219-N221 VanDerWaalsContact O-N 3.12Å; W219-L222 HydrophobicContact CB-CB 3.95Å; W219-L222 HydrophobicContact CB-CD2 4.17Å; W219-L222 HydrophobicContact CB-CG 4.5Å; W219-L222 PolarHBondContact O-N 3.33Å; W219-L245 HydrophobicContact CB-CD2 4.08Å; W219-L245 VanDerWaalsContact O-CD2 3.3Å; W219-L245 WeakPolarHBondContact O-CD2 3.49Å
220	P	94.9	Very high	95.7	Very high	56 Å²	56	32.7 Å²	32.7	36%	0.364	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-26.2	-169.1	24.3	-34.8	0	0	0	114.3	A216 H218 H247	A216-P220 WeakPolarHBondContact O-CA 3.46Å; A216-P220 WeakPolarHBondContact O-CB 3.5Å; A216-P220 WeakPolarHBondContact O-CD 3.41Å; H218-P220 VanDerWaalsContact C-CD 3.49Å; H218-P220 WeakPolarHBondContact O-CD 3.41Å; P220-H247 PolarHBondContact O-CD2 3.42Å
221	N	96.6	Very high	95.8	Very high	74 Å²	74	34.4 Å²	34.4	40%	0.396	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107	11.2	-175.7	-66.4	-57.5	0	0	0	113.9	A193 L195 W219 V223	A193-N221 PolarHBondContact O-ND2 2.9Å; L195-N221 CarbonylContact O-C 3.44Å; W219-N221 PolarHBondContact O-N 2.93Å; W219-N221 VanDerWaalsContact O-N 3.12Å; N221-V223 PolarHBondContact O-N 2.87Å
222	L	97.9	Very high	96	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	19%	0.187	C	C	.	.			trans	-67.3	127.7	-175.4	-156.9	70.6	0	0	0	111.3	L198 W219 L225 L245 H247 L248	L198-L222 HydrophobicContact CB-CD1 3.96Å; W219-L222 HydrophobicContact CB-CB 3.95Å; W219-L222 HydrophobicContact CB-CD2 4.17Å; W219-L222 HydrophobicContact CB-CG 4.5Å; W219-L222 PolarHBondContact O-N 3.33Å; L222-L225 HydrophobicContact CD2-CB 3.91Å; L222-L225 HydrophobicContact CD2-CD1 4.17Å; L222-L225 HydrophobicContact CD2-CD2 4.26Å; L222-L225 HydrophobicContact CD2-CG 4.34Å; L222-L245 HydrophobicContact CD2-CD1 4.19Å; L222-H247 CarbonylContact O-C 3.58Å; L222-H247 WeakPolarHBondContact O-CB 3.38Å; L222-L248 WeakPolarHBondContact O-CA 3.47Å; L222-L248 PolarHBondContact O-N 3.28Å; L222-L248 VanDerWaalsContact O-N 3.11Å
223	V	98.4	Very high	95.9	Very high	54 Å²	54	30.6 Å²	30.6	33%	0.327	17%	0.169	S	C	.	.			trans	-109	-32.7	179.3	-179.1	0	0	0	0	111	Q196 N221 H247 R249 L250	Q196-V223 HydrophobicContact CB-CG2 4.39Å; Q196-V223 WeakPolarHBondContact O-CA 3.39Å; Q196-V223 PolarHBondContact O-N 2.97Å; N221-V223 PolarHBondContact O-N 2.87Å; V223-H247 WeakPolarHBondContact CA-O 3.39Å; V223-H247 HydrophobicContact CG2-CB 4.43Å; V223-R249 HydrophobicContact CG1-CB 4.17Å; V223-R249 HydrophobicContact CG1-CG 4.12Å; V223-R249 PolarHBondContact O-N 2.67Å; V223-L250 PolarHBondContact O-N 3.31Å; V223-L250 VanDerWaalsContact O-N 3.1Å
224	S	98.6	Very high	95.8	Very high	17 Å²	17	30 Å²	30	12%	0.119	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	131.1	-176.2	-174.6	0	0	0	0	110.3	Q196 H197 L198 L250	Q196-S224 PolarHBondContact O-N 3.45Å; H197-S224 WeakPolarHBondContact CA-O 3.16Å; H197-S224 VanDerWaalsContact ND1-CB 3.25Å; H197-S224 WeakPolarHBondContact ND1-CB 3.31Å; H197-S224 PolarHBondContact ND1-OG 3Å; L198-S224 PolarHBondContact N-O 3.07Å; L198-S224 VanDerWaalsContact N-O 3.11Å; S224-L250 WeakPolarHBondContact CA-O 3.31Å
225	L	98.6	Very high	95.8	Very high	2 Å²	2	30 Å²	30	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	123	177.2	179	58.6	0	0	0	109.4	L198 V214 L222 L227 L242 L248 L250 L251 V252	L198-L225 HydrophobicContact CB-CD1 4.15Å; L198-L225 HydrophobicContact CD2-CD1 4.18Å; L198-L225 HydrophobicContact CG-CD1 4.23Å; L198-L225 WeakPolarHBondContact O-CA 3.16Å; V214-L225 HydrophobicContact CB-CD2 4.47Å; V214-L225 HydrophobicContact CG1-CD2 4.08Å; L222-L225 HydrophobicContact CD2-CB 3.91Å; L222-L225 HydrophobicContact CD2-CD1 4.17Å; L222-L225 HydrophobicContact CD2-CD2 4.26Å; L222-L225 HydrophobicContact CD2-CG 4.34Å; L225-L227 HydrophobicContact CD1-CD1 4.27Å; L225-L227 HydrophobicContact CD1-CD2 4.29Å; L225-L227 HydrophobicContact CD1-CG 3.93Å; L225-L227 HydrophobicContact CD2-CD1 3.77Å; L225-L227 HydrophobicContact CD2-CG 4.29Å; L225-L227 HydrophobicContact CG-CD1 3.99Å; L225-L227 HydrophobicContact CG-CG 3.94Å; L225-L242 HydrophobicContact CD2-CD2 3.64Å; L225-L248 HydrophobicContact CB-CD1 3.85Å; L225-L250 PolarHBondContact N-O 3.44Å; L225-L251 HydrophobicContact CB-CD1 4.2Å; L225-L251 HydrophobicContact CD2-CD1 4.18Å; L225-L251 HydrophobicContact CG-CD1 4.26Å; L225-L251 WeakPolarHBondContact O-CA 3.35Å; L225-V252 PolarHBondContact O-N 3.42Å
226	D	98.4	Very high	95.6	Very high	27 Å²	27	31.1 Å²	31.1	14%	0.144	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	118	170.3	174.3	16.2	0	0	0	109.6	L198 L200 G201 G228 V252	L198-D226 PolarHBondContact O-N 3.39Å; L200-D226 CarbonylContact C-O 3.34Å; L200-D226 WeakPolarHBondContact CA-O 3.47Å; L200-D226 PolarHBondContact N-O 3.1Å; G201-D226 PolarHBondContact N-O 3.13Å; D226-G228 PolarHBondContact OD1-N 3.36Å; D226-V252 HydrophobicContact CB-CB 4.23Å; D226-V252 WeakPolarHBondContact OD1-CB 3.33Å
227	L	97.8	Very high	95.6	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	18%	0.176	C	C	.	.			trans	-123.8	18.4	175.2	-69.5	170.2	0	0	0	110.7	M184 L200 L205 V214 L225 N230 L232 M238 V252 L253 N256	M184-L227 HydrophobicContact SD-CD2 4.18Å; L200-L227 HydrophobicContact CB-CD2 3.95Å; L200-L227 HydrophobicContact CD1-CD2 4.07Å; L205-L227 HydrophobicContact CD1-CD2 3.69Å; V214-L227 HydrophobicContact CG1-CD1 4.15Å; L225-L227 HydrophobicContact CD1-CD1 4.27Å; L225-L227 HydrophobicContact CD1-CD2 4.29Å; L225-L227 HydrophobicContact CD1-CG 3.93Å; L225-L227 HydrophobicContact CD2-CD1 3.77Å; L225-L227 HydrophobicContact CD2-CG 4.29Å; L225-L227 HydrophobicContact CG-CD1 3.99Å; L225-L227 HydrophobicContact CG-CG 3.94Å; L227-N230 PolarHBondContact O-ND2 3.17Å; L227-L232 HydrophobicContact CB-CD1 4.01Å; L227-L232 HydrophobicContact CD1-CD1 4.2Å; L227-M238 HydrophobicContact CD1-SD 4.42Å; L227-V252 CarbonylContact C-O 3.38Å; L227-V252 PolarHBondContact N-O 3.44Å; L227-L253 HydrophobicContact CB-CD2 3.89Å; L227-L253 HydrophobicContact CD1-CD2 4Å; L227-N256 PolarHBondContact O-ND2 2.99Å
228	G	97.2	Very high	95.6	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.01	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	152	-175.1	0	0	0	0	0	113.4	G201 H202 D226 N230 V252 Q254	G201-G228 CarbonylContact C-O 3.6Å; G201-G228 WeakPolarHBondContact CA-O 3.41Å; H202-G228 PolarHBondContact N-O 2.8Å; D226-G228 PolarHBondContact OD1-N 3.36Å; G228-N230 VanDerWaalsContact C-N 3.26Å; G228-N230 PolarHBondContact O-N 2.81Å; G228-N230 PolarHBondContact O-ND2 3.02Å; G228-N230 VanDerWaalsContact O-ND2 3.16Å; G228-V252 PolarHBondContact N-O 2.97Å; G228-Q254 CarbonylContact C-O 3.59Å; G228-Q254 WeakPolarHBondContact CA-O 3.5Å
229	F	96.2	Very high	95.7	Very high	41 Å²	41	22.6 Å²	22.6	18%	0.18	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	38.4	175.2	-66.9	-94.9	0	0	0	114.7	H202 Q254 A575	H202-F229 AromaticContact CD2-CD2 3.79Å; H202-F229 AromaticContact CD2-CG 3.85Å; H202-F229 AromaticContact CE1-CD1 3.79Å; H202-F229 AromaticContact CE1-CD2 3.78Å; H202-F229 AromaticContact CE1-CG 3.48Å; H202-F229 VanDerWaalsContact CE1-CG 3.48Å; H202-F229 WeakPolarHBondContact CE1-CG 3.36Å; H202-F229 AromaticContact NE2-CD2 3.18Å; H202-F229 WeakPolarHBondContact NE2-CD2 3.27Å; H202-F229 AromaticContact NE2-CE2 3.79Å; H202-F229 AromaticContact NE2-CG 3.34Å; H202-F229 VanDerWaalsContact NE2-CG 3.34Å; H202-F229 WeakPolarHBondContact NE2-CG 3.18Å; F229-Q254 PolarHBondContact N-O 2.76Å; F229-A575 HydrophobicContact CZ-CB 4.39Å
230	N	96.3	Very high	95.6	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	-104.4	-174.2	168	-77.5	-78.4	0	0	0	110.6	L200 N203 K204 L205 L227 G228 L232 N256 P257 K480	L200-N230 PolarHBondContact O-ND2 3.33Å; N203-N230 VanDerWaalsContact CA-OD1 3.27Å; N203-N230 WeakPolarHBondContact CA-OD1 3.41Å; N203-N230 WeakPolarHBondContact CB-OD1 3.38Å; N203-N230 PolarHBondContact N-OD1 3.49Å; N203-N230 PolarHBondContact O-OD1 2.77Å; K204-N230 PolarHBondContact N-OD1 2.88Å; L205-N230 HydrophobicContact CB-CB 3.98Å; L205-N230 WeakPolarHBondContact CB-OD1 3.17Å; L205-N230 WeakPolarHBondContact CG-OD1 3.27Å; L205-N230 PolarHBondContact N-OD1 2.98Å; L227-N230 PolarHBondContact O-ND2 3.17Å; G228-N230 VanDerWaalsContact C-N 3.26Å; G228-N230 PolarHBondContact O-N 2.81Å; G228-N230 PolarHBondContact O-ND2 3.02Å; G228-N230 VanDerWaalsContact O-ND2 3.16Å; N230-L232 HydrophobicContact CB-CD1 4.49Å; N230-L232 HydrophobicContact CB-CG 4.17Å; N230-N256 VanDerWaalsContact CA-OD1 3.27Å; N230-N256 WeakPolarHBondContact CA-OD1 3.48Å; N230-N256 WeakPolarHBondContact CB-OD1 3.42Å; N230-N256 PolarHBondContact N-OD1 2.94Å; N230-N256 WeakPolarHBondContact O-CA 3.48Å; N230-N256 PolarHBondContact O-OD1 2.78Å; N230-P257 WeakPolarHBondContact O-CD 3.49Å; N230-K480 PolarHBondContact O-NZ 3.13Å
231	D	94.2	Very high	95.6	Very high	42 Å²	42	23 Å²	23	23%	0.225	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-107.4	40.8	-177.7	-58.1	-55.5	0	0	0	111.9	L205 L206 G207 K480	L205-D231 CarbonylContact O-C 3.52Å; L205-D231 VanDerWaalsContact O-CA 3.31Å; L205-D231 WeakPolarHBondContact O-CA 3.4Å; L205-D231 WeakPolarHBondContact O-CB 3.4Å; L205-D231 PolarHBondContact O-N 2.75Å; L206-D231 HydrophobicContact CB-CB 4.49Å; L206-D231 HydrophobicContact CD1-CB 3.51Å; G207-D231 PolarHBondContact N-O 3.25Å; G207-D231 VanDerWaalsContact N-O 3.07Å; D231-K480 WeakPolarHBondContact OD1-CD 3.45Å; D231-K480 WeakPolarHBondContact OD1-CE 3.37Å; D231-K480 IonicContact OD1-NZ 2.95Å; D231-K480 PolarHBondContact OD1-NZ 3.34Å
232	L	95.1	Very high	95.6	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.01	12%	0.117	C	C	.	.			trans	-78	124	178.7	-55.1	170.9	0	0	0	111	L205 E210 L227 N230 M238 L253 N256 P257 L258	L205-L232 HydrophobicContact CB-CD2 4.26Å; E210-L232 HydrophobicContact CB-CD2 3.71Å; E210-L232 HydrophobicContact CG-CD2 4.16Å; L227-L232 HydrophobicContact CB-CD1 4.01Å; L227-L232 HydrophobicContact CD1-CD1 4.2Å; N230-L232 HydrophobicContact CB-CD1 4.49Å; N230-L232 HydrophobicContact CB-CG 4.17Å; L232-M238 HydrophobicContact CD1-CE 4.01Å; L232-M238 HydrophobicContact CD2-CE 4.26Å; L232-L253 HydrophobicContact CD1-CD2 4.11Å; L232-N256 HydrophobicContact CB-CB 4.17Å; L232-N256 VanDerWaalsContact CB-OD1 3.25Å; L232-N256 WeakPolarHBondContact CB-OD1 3.07Å; L232-N256 WeakPolarHBondContact CD1-OD1 3.27Å; L232-N256 WeakPolarHBondContact CG-OD1 3.46Å; L232-N256 PolarHBondContact N-OD1 2.8Å; L232-N256 VanDerWaalsContact N-OD1 3.1Å; L232-P257 WeakPolarHBondContact O-CD 3.31Å; L232-L258 HydrophobicContact CB-CD2 3.54Å; L232-L258 HydrophobicContact CB-CG 4.17Å; L232-L258 WeakPolarHBondContact O-CB 3.23Å; L232-L258 WeakPolarHBondContact O-CG 3.31Å; L232-L258 PolarHBondContact O-N 3.21Å
233	T	91.6	Very high	95.5	Very high	26 Å²	26	26.4 Å²	26.4	16%	0.16	14%	0.143	C	C	.	.			trans	-108.3	-35.1	-171.9	52.5	0	0	0	0	114.3	P257 L258 Q303 V477	T233-P257 HydrophobicContact CG2-CB 4Å; T233-P257 HydrophobicContact CG2-CG 4.18Å; T233-L258 WeakPolarHBondContact O-CB 3.49Å; T233-Q303 PolarHBondContact O-NE2 3.42Å; T233-V477 HydrophobicContact CG2-CG2 3.4Å; T233-V477 VanDerWaalsContact CG2-CG2 3.4Å
234	D	91.4	Very high	95.4	Very high	30 Å²	30	26.3 Å²	26.3	16%	0.16	14%	0.143	C	C	.	.			trans	-94.7	101.9	-173.3	-176.9	0.7	0	0	0	113.1	P208 Q236 S237 M238	P208-D234 HydrophobicContact CB-CB 3.81Å; D234-Q236 PolarHBondContact OD1-N 3.41Å; D234-S237 PolarHBondContact OD1-N 2.65Å; D234-S237 WeakPolarHBondContact OD2-CB 3.3Å; D234-S237 PolarHBondContact OD2-OG 2.84Å; D234-M238 WeakPolarHBondContact O-CB 3.24Å; D234-M238 PolarHBondContact O-N 2.85Å
235	L	94.1	Very high	95.3	Very high	1 Å²	1	26 Å²	26	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-68.3	-38.9	177.7	-178.6	59.6	0	0	0	113.1	M238 V239 L258 V261 Y263 Y264 L267	L235-M238 PolarHBondContact O-N 2.98Å; L235-V239 HydrophobicContact CD1-CG2 3.64Å; L235-V239 HydrophobicContact CG-CG2 4.21Å; L235-V239 WeakPolarHBondContact O-CB 3.43Å; L235-V239 VanDerWaalsContact O-CG2 3.3Å; L235-V239 WeakPolarHBondContact O-CG2 3.47Å; L235-V239 PolarHBondContact O-N 3.37Å; L235-L258 HydrophobicContact CB-CB 4.2Å; L235-L258 HydrophobicContact CD1-CD1 4.23Å; L235-V261 HydrophobicContact CD2-CG2 3.58Å; L235-Y263 HydrophobicContact CD2-CD2 4.16Å; L235-Y263 HydrophobicContact CD2-CE2 3.93Å; L235-Y264 HydrophobicContact CD1-CD2 3.67Å; L235-Y264 HydrophobicContact CD1-CE2 4Å; L235-Y264 HydrophobicContact CD2-CD2 4.07Å; L235-L267 HydrophobicContact CD2-CD2 3.76Å; L235-L267 HydrophobicContact CG-CD2 3.96Å
236	Q	92.3	Very high	95.1	Very high	43 Å²	43	34.3 Å²	34.3	20%	0.201	17%	0.171	C	C	.	.	H	α-helix	trans	-68	-50.7	-172.7	-65.4	-59.7	-20.7	0	0	110.4	D234 M238 V239 A240 G298	D234-Q236 PolarHBondContact OD1-N 3.41Å; Q236-M238 VanDerWaalsContact C-N 3.32Å; Q236-M238 PolarHBondContact O-N 3.24Å; Q236-V239 PolarHBondContact O-N 3.11Å; Q236-A240 VanDerWaalsContact O-CB 3.3Å; Q236-A240 WeakPolarHBondContact O-CB 3.48Å; Q236-A240 PolarHBondContact O-N 3.38Å; Q236-G298 PolarHBondContact NE2-O 3.12Å
237	S	93.1	Very high	95	Very high	46 Å²	46	37.6 Å²	37.6	32%	0.322	19%	0.185	S	C	.	.	H	α-helix	trans	-63.5	-40.4	178	-60.5	0	0	0	0	111.4	S211 D234 A240 S241	S211-S237 WeakPolarHBondContact OG-CB 3.43Å; D234-S237 PolarHBondContact OD1-N 2.65Å; D234-S237 WeakPolarHBondContact OD2-CB 3.3Å; D234-S237 PolarHBondContact OD2-OG 2.84Å; S237-A240 PolarHBondContact O-N 3.46Å; S237-S241 PolarHBondContact O-N 2.68Å; S237-S241 PolarHBondContact O-OG 2.81Å
238	M	95.6	Very high	95	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.015	19%	0.186	C	C	.	.	H	α-helix	trans	-57.8	-53.1	175.7	-179.6	56.4	60.5	0	0	111.5	V214 L227 L232 D234 L235 Q236 A240 S241 L242 L253 L258	V214-M238 HydrophobicContact CG2-CE 4.24Å; V214-M238 HydrophobicContact CG2-SD 3.68Å; L227-M238 HydrophobicContact CD1-SD 4.42Å; L232-M238 HydrophobicContact CD1-CE 4.01Å; L232-M238 HydrophobicContact CD2-CE 4.26Å; D234-M238 WeakPolarHBondContact O-CB 3.24Å; D234-M238 PolarHBondContact O-N 2.85Å; L235-M238 PolarHBondContact O-N 2.98Å; Q236-M238 VanDerWaalsContact C-N 3.32Å; Q236-M238 PolarHBondContact O-N 3.24Å; M238-A240 VanDerWaalsContact C-N 3.34Å; M238-A240 PolarHBondContact O-N 3.03Å; M238-S241 PolarHBondContact O-N 2.71Å; M238-L242 HydrophobicContact CG-CD1 3.79Å; M238-L242 HydrophobicContact CG-CG 4.41Å; M238-L242 WeakPolarHBondContact O-CB 3.31Å; M238-L242 VanDerWaalsContact O-CG 3.23Å; M238-L242 WeakPolarHBondContact O-CG 3.37Å; M238-L242 PolarHBondContact O-N 3.16Å; M238-L242 HydrophobicContact SD-CD1 3.86Å; M238-L242 HydrophobicContact SD-CD2 4.46Å; M238-L242 HydrophobicContact SD-CG 4.01Å; M238-L253 HydrophobicContact CG-CD1 4.46Å; M238-L253 HydrophobicContact CG-CD2 4.44Å; M238-L258 HydrophobicContact CB-CD2 4.29Å; M238-L258 HydrophobicContact CG-CD2 4.21Å
239	V	95.3	Very high	95.1	Very high	4 Å²	4	41 Å²	41	2%	0.024	20%	0.198	C	C	.	.	H	α-helix	trans	-65.5	-37.7	-179.5	170.1	0	0	0	0	111.9	L235 Q236 S241 L242 R243 S271	L235-V239 HydrophobicContact CD1-CG2 3.64Å; L235-V239 HydrophobicContact CG-CG2 4.21Å; L235-V239 WeakPolarHBondContact O-CB 3.43Å; L235-V239 VanDerWaalsContact O-CG2 3.3Å; L235-V239 WeakPolarHBondContact O-CG2 3.47Å; L235-V239 PolarHBondContact O-N 3.37Å; Q236-V239 PolarHBondContact O-N 3.11Å; V239-S241 VanDerWaalsContact C-N 3.33Å; V239-S241 PolarHBondContact O-N 2.9Å; V239-L242 PolarHBondContact O-N 2.96Å; V239-R243 WeakPolarHBondContact O-CB 3.4Å; V239-R243 PolarHBondContact O-N 3.03Å; V239-S271 VanDerWaalsContact CG1-OG 3.28Å; V239-S271 WeakPolarHBondContact CG1-OG 3.35Å
240	A	94.1	Very high	95.2	Very high	50 Å²	50	42.5 Å²	42.5	41%	0.413	21%	0.208	S	C	.	.	H	α-helix	trans	-59.5	-43.2	175.9	0	0	0	0	0	112	Q236 S237 M238 R243	Q236-A240 VanDerWaalsContact O-CB 3.3Å; Q236-A240 WeakPolarHBondContact O-CB 3.48Å; Q236-A240 PolarHBondContact O-N 3.38Å; S237-A240 PolarHBondContact O-N 3.46Å; M238-A240 VanDerWaalsContact C-N 3.34Å; M238-A240 PolarHBondContact O-N 3.03Å; A240-R243 WeakPolarHBondContact O-CB 3.25Å
241	S	95.5	Very high	95.3	Very high	17 Å²	17	42.6 Å²	42.6	12%	0.119	21%	0.208	C	C	.	.	H	α-helix	trans	-68.7	-49	175.4	-69.5	0	0	0	0	112.5	S211 V214 S237 M238 V239 R243 T244	S211-S241 WeakPolarHBondContact O-CB 3.16Å; S211-S241 PolarHBondContact O-OG 3.46Å; V214-S241 CarbonylContact O-C 3.42Å; S237-S241 PolarHBondContact O-N 2.68Å; S237-S241 PolarHBondContact O-OG 2.81Å; M238-S241 PolarHBondContact O-N 2.71Å; V239-S241 VanDerWaalsContact C-N 3.33Å; V239-S241 PolarHBondContact O-N 2.9Å; S241-R243 PolarHBondContact O-N 3.33Å; S241-R243 VanDerWaalsContact O-N 3.14Å; S241-T244 WeakPolarHBondContact O-CB 3.31Å; S241-T244 WeakPolarHBondContact O-CG2 3.44Å; S241-T244 PolarHBondContact O-N 2.91Å; S241-T244 PolarHBondContact O-OG1 3.01Å
242	L	96.8	Very high	95.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58.8	-29.9	179.4	-69.7	171.1	0	0	0	112.5	V214 L225 M238 V239 T244 L245 L248 L251 L253 L272	V214-L242 HydrophobicContact CB-CD2 4.16Å; V214-L242 HydrophobicContact CG2-CD2 4.27Å; L225-L242 HydrophobicContact CD2-CD2 3.64Å; M238-L242 HydrophobicContact CG-CD1 3.79Å; M238-L242 HydrophobicContact CG-CG 4.41Å; M238-L242 WeakPolarHBondContact O-CB 3.31Å; M238-L242 VanDerWaalsContact O-CG 3.23Å; M238-L242 WeakPolarHBondContact O-CG 3.37Å; M238-L242 PolarHBondContact O-N 3.16Å; M238-L242 HydrophobicContact SD-CD1 3.86Å; M238-L242 HydrophobicContact SD-CD2 4.46Å; M238-L242 HydrophobicContact SD-CG 4.01Å; V239-L242 PolarHBondContact O-N 2.96Å; L242-T244 PolarHBondContact O-N 3.17Å; L242-T244 VanDerWaalsContact O-N 3.14Å; L242-L245 HydrophobicContact CD2-CD1 3.83Å; L242-L245 WeakPolarHBondContact O-CB 3.28Å; L242-L245 PolarHBondContact O-N 2.81Å; L242-L248 HydrophobicContact CD2-CD2 4.05Å; L242-L251 HydrophobicContact CD1-CD1 4.25Å; L242-L251 HydrophobicContact CD1-CD2 3.75Å; L242-L251 HydrophobicContact CD2-CD1 4.43Å; L242-L253 HydrophobicContact CD1-CD1 4.33Å; L242-L272 HydrophobicContact CB-CD1 4.1Å; L242-L272 HydrophobicContact CB-CD2 3.91Å; L242-L272 HydrophobicContact CD1-CD1 4.34Å
243	R	95.6	Very high	95.6	Very high	147 Å²	147	41.6 Å²	41.6	56%	0.555	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-23.8	176.1	-171.9	175.9	64.8	175	-2.2	113.3	V239 A240 S241 L245 L272	V239-R243 WeakPolarHBondContact O-CB 3.4Å; V239-R243 PolarHBondContact O-N 3.03Å; A240-R243 WeakPolarHBondContact O-CB 3.25Å; S241-R243 PolarHBondContact O-N 3.33Å; S241-R243 VanDerWaalsContact O-N 3.14Å; R243-L245 VanDerWaalsContact C-N 3.31Å; R243-L272 HydrophobicContact CB-CD2 4.17Å
244	T	96.2	Very high	95.8	Very high	53 Å²	53	42.2 Å²	42.2	33%	0.325	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-29.6	175.1	69.4	0	0	0	0	111.8	T215 A216 S241 L242 R246	T215-T244 VanDerWaalsContact CA-OG1 3.3Å; T215-T244 WeakPolarHBondContact CA-OG1 3.45Å; A216-T244 WeakPolarHBondContact CB-O 3.33Å; A216-T244 PolarHBondContact N-OG1 2.97Å; S241-T244 WeakPolarHBondContact O-CB 3.31Å; S241-T244 WeakPolarHBondContact O-CG2 3.44Å; S241-T244 PolarHBondContact O-N 2.91Å; S241-T244 PolarHBondContact O-OG1 3.01Å; L242-T244 PolarHBondContact O-N 3.17Å; L242-T244 VanDerWaalsContact O-N 3.14Å; T244-R246 WeakPolarHBondContact O-CG 3.48Å; T244-R246 PolarHBondContact O-N 2.91Å
245	L	96.3	Very high	96	Very high	9 Å²	9	40.8 Å²	40.8	5%	0.047	20%	0.197	C	C	.	.			trans	-75.1	83.1	-179	-56.5	175.3	0	0	0	111.7	T215 A216 W219 L222 L242 R243 H247 L248	T215-L245 VanDerWaalsContact C-CD2 3.45Å; A216-L245 HydrophobicContact CB-CD2 4.37Å; W219-L245 HydrophobicContact CB-CD2 4.08Å; W219-L245 VanDerWaalsContact O-CD2 3.3Å; W219-L245 WeakPolarHBondContact O-CD2 3.49Å; L222-L245 HydrophobicContact CD2-CD1 4.19Å; L242-L245 HydrophobicContact CD2-CD1 3.83Å; L242-L245 WeakPolarHBondContact O-CB 3.28Å; L242-L245 PolarHBondContact O-N 2.81Å; R243-L245 VanDerWaalsContact C-N 3.31Å; L245-H247 PolarHBondContact O-N 3.05Å; L245-H247 VanDerWaalsContact O-N 3.14Å; L245-L248 HydrophobicContact CB-CB 3.94Å; L245-L248 HydrophobicContact CD1-CD2 4.24Å; L245-L248 WeakPolarHBondContact O-CB 3.16Å; L245-L248 PolarHBondContact O-N 3.29Å
246	R	94.1	Very high	96.1	Very high	178 Å²	178	40.8 Å²	40.8	67%	0.672	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-23.1	-173.9	-56.2	-54.3	-171.7	167.9	1.2	114.6	T244 R249	T244-R246 WeakPolarHBondContact O-CG 3.48Å; T244-R246 PolarHBondContact O-N 2.91Å; R246-R249 PolarHBondContact O-NH1 2.78Å
247	H	96.6	Very high	96.2	Very high	95 Å²	95	38.7 Å²	38.7	44%	0.44	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-7	-178.7	-66.7	-63.5	0	0	0	114	P220 L222 V223 L245 R249	P220-H247 PolarHBondContact O-CD2 3.42Å; L222-H247 CarbonylContact O-C 3.58Å; L222-H247 WeakPolarHBondContact O-CB 3.38Å; V223-H247 WeakPolarHBondContact CA-O 3.39Å; V223-H247 HydrophobicContact CG2-CB 4.43Å; L245-H247 PolarHBondContact O-N 3.05Å; L245-H247 VanDerWaalsContact O-N 3.14Å; H247-R249 WeakPolarHBondContact O-CG 3.43Å; H247-R249 PolarHBondContact O-N 3Å; H247-R249 PolarHBondContact O-NH1 3.4Å; H247-R249 VanDerWaalsContact O-NH1 3.13Å
248	L	98.2	Very high	96.3	Very high	6 Å²	6	36.5 Å²	36.5	3%	0.031	17%	0.172	C	C	.	.			trans	-62.4	130.4	-179	-169.7	68.1	0	0	0	110.6	L222 L225 L242 L245 L250 L251 L272	L222-L248 WeakPolarHBondContact O-CA 3.47Å; L222-L248 PolarHBondContact O-N 3.28Å; L222-L248 VanDerWaalsContact O-N 3.11Å; L225-L248 HydrophobicContact CB-CD1 3.85Å; L242-L248 HydrophobicContact CD2-CD2 4.05Å; L245-L248 HydrophobicContact CB-CB 3.94Å; L245-L248 HydrophobicContact CD1-CD2 4.24Å; L245-L248 WeakPolarHBondContact O-CB 3.16Å; L245-L248 PolarHBondContact O-N 3.29Å; L248-L250 WeakPolarHBondContact CD1-O 3.45Å; L248-L251 HydrophobicContact CD2-CD1 4.46Å; L248-L272 HydrophobicContact CD2-CD1 4.47Å
249	R	98.1	Very high	96.3	Very high	69 Å²	69	37.1 Å²	37.1	26%	0.26	18%	0.177	S	C	.	.			trans	-129.4	-32.6	-179.6	-62.8	-57.1	179	-95	5.6	112.4	V223 R246 H247 Q274 L275 C276 V277	V223-R249 HydrophobicContact CG1-CB 4.17Å; V223-R249 HydrophobicContact CG1-CG 4.12Å; V223-R249 PolarHBondContact O-N 2.67Å; R246-R249 PolarHBondContact O-NH1 2.78Å; H247-R249 WeakPolarHBondContact O-CG 3.43Å; H247-R249 PolarHBondContact O-N 3Å; H247-R249 PolarHBondContact O-NH1 3.4Å; H247-R249 VanDerWaalsContact O-NH1 3.13Å; R249-Q274 WeakPolarHBondContact CD-O 3.19Å; R249-Q274 VanDerWaalsContact NH1-CB 3.28Å; R249-L275 WeakPolarHBondContact O-CD1 3.44Å; R249-C276 HydrophobicContact CB-CB 4.43Å; R249-C276 WeakPolarHBondContact O-CA 3.23Å; R249-C276 WeakPolarHBondContact O-CB 3.47Å; R249-C276 PolarHBondContact O-N 2.75Å; R249-V277 PolarHBondContact O-N 2.89Å
250	L	98.6	Very high	96.3	Very high	72 Å²	72	37 Å²	37	38%	0.377	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	125.3	-179	-50.1	175.1	0	0	0	108.3	V223 S224 L225 L248 V277	V223-L250 PolarHBondContact O-N 3.31Å; V223-L250 VanDerWaalsContact O-N 3.1Å; S224-L250 WeakPolarHBondContact CA-O 3.31Å; L225-L250 PolarHBondContact N-O 3.44Å; L248-L250 WeakPolarHBondContact CD1-O 3.45Å; L250-V277 HydrophobicContact CD2-CB 3.52Å; L250-V277 HydrophobicContact CD2-CG1 4.49Å; L250-V277 HydrophobicContact CD2-CG2 3.41Å; L250-V277 VanDerWaalsContact CD2-CG2 3.41Å
251	L	98.6	Very high	96.3	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	131.6	179	179.1	62.2	0	0	0	109.5	L225 L242 L248 L253 T268 L272 L275 V277 L278 D279	L225-L251 HydrophobicContact CB-CD1 4.2Å; L225-L251 HydrophobicContact CD2-CD1 4.18Å; L225-L251 HydrophobicContact CG-CD1 4.26Å; L225-L251 WeakPolarHBondContact O-CA 3.35Å; L242-L251 HydrophobicContact CD1-CD1 4.25Å; L242-L251 HydrophobicContact CD1-CD2 3.75Å; L242-L251 HydrophobicContact CD2-CD1 4.43Å; L248-L251 HydrophobicContact CD2-CD1 4.46Å; L251-L253 HydrophobicContact CD1-CD1 4.24Å; L251-L253 HydrophobicContact CD1-CD2 4.48Å; L251-L253 HydrophobicContact CD1-CG 3.97Å; L251-L253 HydrophobicContact CD2-CD1 3.73Å; L251-L253 HydrophobicContact CD2-CG 4.3Å; L251-L253 HydrophobicContact CG-CD1 4.03Å; L251-L253 HydrophobicContact CG-CG 4.02Å; L251-T268 HydrophobicContact CD2-CG2 3.92Å; L251-L272 HydrophobicContact CD2-CD1 3.79Å; L251-L275 HydrophobicContact CB-CD1 3.71Å; L251-V277 PolarHBondContact N-O 3.14Å; L251-V277 VanDerWaalsContact N-O 3.07Å; L251-L278 HydrophobicContact CB-CD1 4.14Å; L251-L278 HydrophobicContact CD2-CD1 3.96Å; L251-L278 HydrophobicContact CG-CD1 4.03Å; L251-L278 CarbonylContact O-C 3.6Å; L251-L278 VanDerWaalsContact O-CA 3.31Å; L251-L278 WeakPolarHBondContact O-CA 3.29Å; L251-D279 PolarHBondContact O-N 2.93Å
252	V	98.3	Very high	96.3	Very high	24 Å²	24	34.1 Å²	34.1	15%	0.145	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	120.7	170.7	-177.2	0	0	0	0	108.3	L225 D226 L227 G228 Q254 D279	L225-V252 PolarHBondContact O-N 3.42Å; D226-V252 HydrophobicContact CB-CB 4.23Å; D226-V252 WeakPolarHBondContact OD1-CB 3.33Å; L227-V252 CarbonylContact C-O 3.38Å; L227-V252 PolarHBondContact N-O 3.44Å; G228-V252 PolarHBondContact N-O 2.97Å; V252-Q254 HydrophobicContact CG1-CB 4.33Å; V252-D279 WeakPolarHBondContact CA-OD1 3.39Å
253	L	97.3	Very high	96.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.155	C	C	.	.			trans	-131.5	-0.8	175.7	-68.8	166	0	0	0	111.5	L227 L232 M238 L242 L251 N256 L258 Y264 D279	L227-L253 HydrophobicContact CB-CD2 3.89Å; L227-L253 HydrophobicContact CD1-CD2 4Å; L232-L253 HydrophobicContact CD1-CD2 4.11Å; M238-L253 HydrophobicContact CG-CD1 4.46Å; M238-L253 HydrophobicContact CG-CD2 4.44Å; L242-L253 HydrophobicContact CD1-CD1 4.33Å; L251-L253 HydrophobicContact CD1-CD1 4.24Å; L251-L253 HydrophobicContact CD1-CD2 4.48Å; L251-L253 HydrophobicContact CD1-CG 3.97Å; L251-L253 HydrophobicContact CD2-CD1 3.73Å; L251-L253 HydrophobicContact CD2-CG 4.3Å; L251-L253 HydrophobicContact CG-CD1 4.03Å; L251-L253 HydrophobicContact CG-CG 4.02Å; L253-N256 VanDerWaalsContact O-CB 3.29Å; L253-N256 WeakPolarHBondContact O-CB 3.47Å; L253-N256 PolarHBondContact O-N 3.31Å; L253-N256 PolarHBondContact O-ND2 3.42Å; L253-L258 HydrophobicContact CB-CD1 4.15Å; L253-L258 HydrophobicContact CD1-CD1 4.32Å; L253-Y264 HydrophobicContact CB-CE2 4.31Å; L253-Y264 WeakPolarHBondContact CB-OH 3.44Å; L253-Y264 HydrophobicContact CD1-CE2 4.14Å; L253-D279 PolarHBondContact N-OD1 3.18Å
254	Q	96	Very high	96.1	Very high	39 Å²	39	28.1 Å²	28.1	18%	0.182	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-43.7	147.7	171.2	-171.3	-177.7	6.4	0	0	112.5	G228 F229 V252 N256 D279 A575	G228-Q254 CarbonylContact C-O 3.59Å; G228-Q254 WeakPolarHBondContact CA-O 3.5Å; F229-Q254 PolarHBondContact N-O 2.76Å; V252-Q254 HydrophobicContact CG1-CB 4.33Å; Q254-N256 PolarHBondContact O-N 3.17Å; Q254-D279 HydrophobicContact CB-CB 4.02Å; Q254-D279 PolarHBondContact N-OD1 3.11Å; Q254-A575 PolarHBondContact NE2-O 3.1Å
255	G	95.3	Very high	96.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	1.9	-179.2	0	0	0	0	0	115.2	K480 L574	G255-K480 WeakPolarHBondContact O-CE 3.46Å; G255-L574 VanDerWaalsContact CA-O 3.31Å; G255-L574 WeakPolarHBondContact CA-O 3.49Å; G255-L574 PolarHBondContact N-O 3.09Å
256	N	96.5	Very high	96.1	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.12	C	C	.	.	S	Bend	trans	-91.6	149.7	170.3	-72.6	-90.1	0	0	0	111.8	L227 N230 L232 L253 Q254 L258 A259	L227-N256 PolarHBondContact O-ND2 2.99Å; N230-N256 VanDerWaalsContact CA-OD1 3.27Å; N230-N256 WeakPolarHBondContact CA-OD1 3.48Å; N230-N256 WeakPolarHBondContact CB-OD1 3.42Å; N230-N256 PolarHBondContact N-OD1 2.94Å; N230-N256 WeakPolarHBondContact O-CA 3.48Å; N230-N256 PolarHBondContact O-OD1 2.78Å; L232-N256 HydrophobicContact CB-CB 4.17Å; L232-N256 VanDerWaalsContact CB-OD1 3.25Å; L232-N256 WeakPolarHBondContact CB-OD1 3.07Å; L232-N256 WeakPolarHBondContact CD1-OD1 3.27Å; L232-N256 WeakPolarHBondContact CG-OD1 3.46Å; L232-N256 PolarHBondContact N-OD1 2.8Å; L232-N256 VanDerWaalsContact N-OD1 3.1Å; L253-N256 VanDerWaalsContact O-CB 3.29Å; L253-N256 WeakPolarHBondContact O-CB 3.47Å; L253-N256 PolarHBondContact O-N 3.31Å; L253-N256 PolarHBondContact O-ND2 3.42Å; Q254-N256 PolarHBondContact O-N 3.17Å; N256-L258 HydrophobicContact CB-CD1 4.25Å; N256-L258 HydrophobicContact CB-CG 3.93Å; N256-L258 PolarHBondContact O-N 3.5Å; N256-A259 WeakPolarHBondContact O-CB 3.45Å; N256-A259 PolarHBondContact O-N 3.07Å
257	P	94.8	Very high	96.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-51.7	-40.1	173.4	-25.7	32.6	0	0	0	113.7	N230 L232 T233 A259 L260 L476 K480	N230-P257 WeakPolarHBondContact O-CD 3.49Å; L232-P257 WeakPolarHBondContact O-CD 3.31Å; T233-P257 HydrophobicContact CG2-CB 4Å; T233-P257 HydrophobicContact CG2-CG 4.18Å; P257-A259 PolarHBondContact O-N 3.02Å; P257-A259 VanDerWaalsContact O-N 3.1Å; P257-L260 WeakPolarHBondContact O-CB 3.48Å; P257-L260 PolarHBondContact O-N 2.8Å; P257-L260 VanDerWaalsContact O-N 3.07Å; P257-L476 HydrophobicContact CB-CB 3.52Å; P257-K480 HydrophobicContact CG-CB 4.16Å; P257-K480 HydrophobicContact CG-CD 4.02Å
258	L	94.6	Very high	96.1	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.067	C	C	.	.	G	3₁₀ helix	trans	-61.4	-17.6	177.4	64.6	71.4	0	0	0	114.7	L232 T233 L235 M238 L253 N256 L260 V261 Y264	L232-L258 HydrophobicContact CB-CD2 3.54Å; L232-L258 HydrophobicContact CB-CG 4.17Å; L232-L258 WeakPolarHBondContact O-CB 3.23Å; L232-L258 WeakPolarHBondContact O-CG 3.31Å; L232-L258 PolarHBondContact O-N 3.21Å; T233-L258 WeakPolarHBondContact O-CB 3.49Å; L235-L258 HydrophobicContact CB-CB 4.2Å; L235-L258 HydrophobicContact CD1-CD1 4.23Å; M238-L258 HydrophobicContact CB-CD2 4.29Å; M238-L258 HydrophobicContact CG-CD2 4.21Å; L253-L258 HydrophobicContact CB-CD1 4.15Å; L253-L258 HydrophobicContact CD1-CD1 4.32Å; N256-L258 HydrophobicContact CB-CD1 4.25Å; N256-L258 HydrophobicContact CB-CG 3.93Å; N256-L258 PolarHBondContact O-N 3.5Å; L258-L260 VanDerWaalsContact C-N 3.3Å; L258-V261 WeakPolarHBondContact O-CG2 3.39Å; L258-Y264 HydrophobicContact CD1-CD2 3.96Å; L258-Y264 HydrophobicContact CD1-CE2 3.62Å; L258-Y264 WeakPolarHBondContact O-CD2 3.38Å
259	A	95.6	Very high	96	Very high	15 Å²	15	13.8 Å²	13.8	12%	0.124	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-84.2	-10.1	179.7	0	0	0	0	0	112.3	N256 P257 Y264	N256-A259 WeakPolarHBondContact O-CB 3.45Å; N256-A259 PolarHBondContact O-N 3.07Å; P257-A259 PolarHBondContact O-N 3.02Å; P257-A259 VanDerWaalsContact O-N 3.1Å; A259-Y264 HydrophobicContact CB-CD1 4.18Å; A259-Y264 HydrophobicContact CB-CD2 4.29Å; A259-Y264 HydrophobicContact CB-CE1 4.16Å; A259-Y264 HydrophobicContact CB-CE2 4.25Å; A259-Y264 HydrophobicContact CB-CG 4.27Å
260	L	95.3	Very high	95.9	Very high	3 Å²	3	12.1 Å²	12.1	2%	0.016	6%	0.062	C	C	.	.	G	3₁₀ helix	trans	-84.3	-11.6	179.8	-61	174	0	0	0	113.1	P257 L258 A305 L479 L483 L574 L639	P257-L260 WeakPolarHBondContact O-CB 3.48Å; P257-L260 PolarHBondContact O-N 2.8Å; P257-L260 VanDerWaalsContact O-N 3.07Å; L258-L260 VanDerWaalsContact C-N 3.3Å; L260-A305 HydrophobicContact CB-CB 3.82Å; L260-L479 HydrophobicContact CD1-CD2 3.69Å; L260-L479 HydrophobicContact CD1-CG 3.9Å; L260-L483 HydrophobicContact CD1-CD1 3.75Å; L260-L483 HydrophobicContact CD2-CD1 3.93Å; L260-L574 HydrophobicContact CD1-CD2 4.1Å; L260-L574 HydrophobicContact CD2-CD2 4.12Å; L260-L574 HydrophobicContact CG-CD2 4.4Å; L260-L639 HydrophobicContact CD2-CD1 4.47Å; L260-L639 HydrophobicContact CD2-CD2 3.96Å
261	V	94.4	Very high	95.8	Very high	2 Å²	2	9.7 Å²	9.7	1%	0.012	5%	0.051	C	C	.	.	S	Bend	trans	-73.3	139.5	177.8	-55.5	0	0	0	0	110.4	L235 L258 Y263 Y264 Q303 L476	L235-V261 HydrophobicContact CD2-CG2 3.58Å; L258-V261 WeakPolarHBondContact O-CG2 3.39Å; V261-Y263 VanDerWaalsContact C-N 3.26Å; V261-Y263 HydrophobicContact CB-CE1 4.2Å; V261-Y263 HydrophobicContact CG2-CD2 4.3Å; V261-Y263 HydrophobicContact CG2-CE1 4.32Å; V261-Y263 HydrophobicContact CG2-CE2 4.01Å; V261-Y263 PolarHBondContact O-N 2.85Å; V261-Y263 VanDerWaalsContact O-N 3.1Å; V261-Y264 WeakPolarHBondContact O-CB 3.3Å; V261-Y264 PolarHBondContact O-N 3.35Å; V261-Q303 HydrophobicContact CG1-CG 4.35Å; V261-L476 HydrophobicContact CG1-CD1 3.99Å
262	P	94.5	Very high	95.6	Very high	4 Å²	4	10.3 Å²	10.3	3%	0.026	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-34.3	-170.3	-30.5	35.7	0	0	0	115.4	E304 Q306 N640 Q641 C642 M651	P262-E304 WeakPolarHBondContact CD-O 3.39Å; P262-Q306 HydrophobicContact CG-CB 4.14Å; P262-Q306 HydrophobicContact CG-CG 4.12Å; P262-N640 VanDerWaalsContact CA-O 3.27Å; P262-N640 WeakPolarHBondContact CA-O 3.42Å; P262-N640 WeakPolarHBondContact CB-O 3.47Å; P262-Q641 CarbonylContact O-C 3.57Å; P262-Q641 WeakPolarHBondContact O-CA 3.47Å; P262-C642 PolarHBondContact O-N 3.26Å; P262-M651 HydrophobicContact CB-CE 4.03Å; P262-M651 HydrophobicContact CB-SD 4.35Å; P262-M651 HydrophobicContact CG-CE 3.94Å
263	Y	94.3	Very high	95.2	Very high	10 Å²	10	12.3 Å²	12.3	4%	0.039	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	6.7	-176.9	54.9	-91.9	0	0	0	113.7	L235 V261 R265 G266 L267 L301 A302	L235-Y263 HydrophobicContact CD2-CD2 4.16Å; L235-Y263 HydrophobicContact CD2-CE2 3.93Å; V261-Y263 VanDerWaalsContact C-N 3.26Å; V261-Y263 HydrophobicContact CB-CE1 4.2Å; V261-Y263 HydrophobicContact CG2-CD2 4.3Å; V261-Y263 HydrophobicContact CG2-CE1 4.32Å; V261-Y263 HydrophobicContact CG2-CE2 4.01Å; V261-Y263 PolarHBondContact O-N 2.85Å; V261-Y263 VanDerWaalsContact O-N 3.1Å; Y263-R265 PolarHBondContact O-N 3.03Å; Y263-G266 PolarHBondContact O-N 3.05Å; Y263-L267 HydrophobicContact CD2-CB 4.06Å; Y263-L267 HydrophobicContact CD2-CD2 3.93Å; Y263-L267 HydrophobicContact CE2-CD2 3.88Å; Y263-L267 WeakPolarHBondContact O-CB 3.39Å; Y263-L267 PolarHBondContact O-N 2.91Å; Y263-L301 HydrophobicContact CD1-CB 3.95Å; Y263-L301 HydrophobicContact CD1-CD1 4.01Å; Y263-L301 HydrophobicContact CD1-CG 4.39Å; Y263-L301 HydrophobicContact CD2-CB 4.34Å; Y263-L301 HydrophobicContact CD2-CD1 3.57Å; Y263-L301 HydrophobicContact CE1-CB 3.51Å; Y263-L301 HydrophobicContact CE1-CD1 4.33Å; Y263-L301 HydrophobicContact CE1-CG 4.41Å; Y263-L301 HydrophobicContact CE2-CB 3.9Å; Y263-L301 HydrophobicContact CE2-CD1 3.89Å; Y263-L301 HydrophobicContact CG-CB 4.35Å; Y263-L301 HydrophobicContact CG-CD1 3.63Å; Y263-L301 HydrophobicContact CG-CG 4.47Å; Y263-L301 VanDerWaalsContact CZ-CB 3.46Å; Y263-L301 PolarHBondContact OH-O 3.02Å; Y263-A302 VanDerWaalsContact CE1-O 3.28Å; Y263-A302 WeakPolarHBondContact CE1-O 3.48Å; Y263-A302 PolarHBondContact OH-O 3.43Å
264	Y	95.6	Very high	95	Very high	11 Å²	11	17.8 Å²	17.8	4%	0.043	10%	0.099	C	C	.	.	H	α-helix	trans	-45.9	-59.4	-175.4	162	-105.2	0	0	0	113.1	L235 L253 L258 A259 V261 G266 L267 T268 L278 D279	L235-Y264 HydrophobicContact CD1-CD2 3.67Å; L235-Y264 HydrophobicContact CD1-CE2 4Å; L235-Y264 HydrophobicContact CD2-CD2 4.07Å; L253-Y264 HydrophobicContact CB-CE2 4.31Å; L253-Y264 WeakPolarHBondContact CB-OH 3.44Å; L253-Y264 HydrophobicContact CD1-CE2 4.14Å; L258-Y264 HydrophobicContact CD1-CD2 3.96Å; L258-Y264 HydrophobicContact CD1-CE2 3.62Å; L258-Y264 WeakPolarHBondContact O-CD2 3.38Å; A259-Y264 HydrophobicContact CB-CD1 4.18Å; A259-Y264 HydrophobicContact CB-CD2 4.29Å; A259-Y264 HydrophobicContact CB-CE1 4.16Å; A259-Y264 HydrophobicContact CB-CE2 4.25Å; A259-Y264 HydrophobicContact CB-CG 4.27Å; V261-Y264 WeakPolarHBondContact O-CB 3.3Å; V261-Y264 PolarHBondContact O-N 3.35Å; Y264-G266 PolarHBondContact O-N 2.88Å; Y264-L267 PolarHBondContact O-N 2.84Å; Y264-T268 WeakPolarHBondContact O-CB 3.48Å; Y264-T268 PolarHBondContact O-N 2.96Å; Y264-T268 VanDerWaalsContact O-N 3.1Å; Y264-T268 PolarHBondContact O-OG1 3.14Å; Y264-T268 VanDerWaalsContact O-OG1 3.05Å; Y264-L278 HydrophobicContact CE1-CD2 4.45Å; Y264-L278 WeakPolarHBondContact OH-CD1 3.3Å; Y264-D279 VanDerWaalsContact CE1-OD2 3.23Å; Y264-D279 WeakPolarHBondContact CE1-OD2 3.25Å; Y264-D279 PolarHBondContact OH-OD2 3.41Å
265	R	95.6	Very high	95.1	Very high	38 Å²	38	16 Å²	16	14%	0.143	9%	0.091	C	C	.	.	H	α-helix	trans	-63.4	-44.1	-175.6	-177.5	165.2	-176.3	84.4	9.5	111.5	Y263 I269 L278 E287	Y263-R265 PolarHBondContact O-N 3.03Å; R265-I269 HydrophobicContact CG-CD1 3.63Å; R265-I269 WeakPolarHBondContact O-CB 3.34Å; R265-I269 WeakPolarHBondContact O-CD1 3.45Å; R265-I269 WeakPolarHBondContact O-CG1 3.29Å; R265-I269 PolarHBondContact O-N 2.98Å; R265-L278 HydrophobicContact CG-CD2 4.16Å; R265-L278 PolarHBondContact NH1-O 2.84Å; R265-E287 IonicContact CZ-OE1 3.96Å; R265-E287 IonicContact NE-OE1 3.72Å; R265-E287 PolarHBondContact NE-OE1 3.38Å; R265-E287 IonicContact NH2-OE1 2.78Å; R265-E287 PolarHBondContact NH2-OE1 2.96Å; R265-E287 IonicContact NH2-OE2 2.72Å; R265-E287 PolarHBondContact NH2-OE2 2.88Å
266	G	95.1	Very high	95.2	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-64.5	-46.2	-178.7	0	0	0	0	0	113.1	Y263 Y264 I269 D270	Y263-G266 PolarHBondContact O-N 3.05Å; Y264-G266 PolarHBondContact O-N 2.88Å; G266-I269 PolarHBondContact O-N 3.18Å; G266-D270 WeakPolarHBondContact O-CB 3.26Å; G266-D270 PolarHBondContact O-N 3.36Å
267	L	95.8	Very high	95.2	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.7	-43.4	-179.1	179.7	66	0	0	0	111.5	L235 Y263 Y264 S271 L294	L235-L267 HydrophobicContact CD2-CD2 3.76Å; L235-L267 HydrophobicContact CG-CD2 3.96Å; Y263-L267 HydrophobicContact CD2-CB 4.06Å; Y263-L267 HydrophobicContact CD2-CD2 3.93Å; Y263-L267 HydrophobicContact CE2-CD2 3.88Å; Y263-L267 WeakPolarHBondContact O-CB 3.39Å; Y263-L267 PolarHBondContact O-N 2.91Å; Y264-L267 PolarHBondContact O-N 2.84Å; L267-S271 WeakPolarHBondContact O-CB 3.39Å; L267-S271 PolarHBondContact O-N 2.95Å; L267-S271 PolarHBondContact O-OG 3.31Å; L267-L294 HydrophobicContact CB-CD2 4.31Å
268	T	96.4	Very high	95.4	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62.2	-44.1	176.8	-60	0	0	0	0	111.1	L251 Y264 L272 L275 L278	L251-T268 HydrophobicContact CD2-CG2 3.92Å; Y264-T268 WeakPolarHBondContact O-CB 3.48Å; Y264-T268 PolarHBondContact O-N 2.96Å; Y264-T268 VanDerWaalsContact O-N 3.1Å; Y264-T268 PolarHBondContact O-OG1 3.14Å; Y264-T268 VanDerWaalsContact O-OG1 3.05Å; T268-L272 HydrophobicContact CG2-CD1 3.81Å; T268-L272 HydrophobicContact CG2-CG 4.46Å; T268-L272 VanDerWaalsContact O-CB 3.28Å; T268-L272 WeakPolarHBondContact O-CB 3.21Å; T268-L272 WeakPolarHBondContact O-CG 3.35Å; T268-L272 PolarHBondContact O-N 3.2Å; T268-L275 HydrophobicContact CG2-CD2 4.19Å; T268-L278 HydrophobicContact CG2-CD1 3.93Å; T268-L278 HydrophobicContact CG2-CD2 3.85Å
269	I	96.1	Very high	95.5	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-66.3	-45.5	-179.4	-72.1	168.8	0	0	0	112.3	R265 G266 S271 L278 V283 E287 K288	R265-I269 HydrophobicContact CG-CD1 3.63Å; R265-I269 WeakPolarHBondContact O-CB 3.34Å; R265-I269 WeakPolarHBondContact O-CD1 3.45Å; R265-I269 WeakPolarHBondContact O-CG1 3.29Å; R265-I269 PolarHBondContact O-N 2.98Å; G266-I269 PolarHBondContact O-N 3.18Å; I269-S271 VanDerWaalsContact C-N 3.34Å; I269-L278 HydrophobicContact CG1-CD2 4.13Å; I269-V283 HydrophobicContact CB-CG1 4.47Å; I269-V283 HydrophobicContact CD1-CG1 3.97Å; I269-V283 HydrophobicContact CD1-CG2 4.15Å; I269-V283 HydrophobicContact CG1-CG1 3.95Å; I269-V283 HydrophobicContact CG1-CG2 4.02Å; I269-V283 HydrophobicContact CG2-CG1 3.71Å; I269-E287 HydrophobicContact CD1-CG 3.82Å; I269-E287 WeakPolarHBondContact CD1-OE1 3.47Å; I269-K288 HydrophobicContact CG2-CB 4.41Å; I269-K288 HydrophobicContact CG2-CG 3.66Å
270	D	95.8	Very high	95.5	Very high	34 Å²	34	26.8 Å²	26.8	18%	0.182	15%	0.152	C	C	.	.	H	α-helix	trans	-68.2	-36.5	-179.4	-169.9	47.9	0	0	0	111.5	G266 F291 R292 G293 L294 S295	G266-D270 WeakPolarHBondContact O-CB 3.26Å; G266-D270 PolarHBondContact O-N 3.36Å; D270-F291 HydrophobicContact CB-CB 4.42Å; D270-F291 WeakPolarHBondContact CB-O 3.32Å; D270-R292 VanDerWaalsContact OD1-CA 3.28Å; D270-R292 WeakPolarHBondContact OD1-CA 3.49Å; D270-G293 VanDerWaalsContact CG-N 3.32Å; D270-G293 PolarHBondContact OD1-N 3.48Å; D270-G293 VanDerWaalsContact OD1-N 3.11Å; D270-G293 WeakPolarHBondContact OD2-CA 3.46Å; D270-G293 PolarHBondContact OD2-N 3.02Å; D270-L294 HydrophobicContact CB-CB 4.49Å; D270-L294 PolarHBondContact OD2-N 2.91Å; D270-S295 WeakPolarHBondContact OD2-CB 3.28Å; D270-S295 PolarHBondContact OD2-N 3.29Å; D270-S295 PolarHBondContact OD2-OG 3.15Å
271	S	95.1	Very high	95.5	Very high	21 Å²	21	31.2 Å²	31.2	15%	0.147	18%	0.175	C	C	.	.	H	α-helix	trans	-76.2	-33.4	180	-57.7	0	0	0	0	113.4	V239 L267 I269 S295	V239-S271 VanDerWaalsContact CG1-OG 3.28Å; V239-S271 WeakPolarHBondContact CG1-OG 3.35Å; L267-S271 WeakPolarHBondContact O-CB 3.39Å; L267-S271 PolarHBondContact O-N 2.95Å; L267-S271 PolarHBondContact O-OG 3.31Å; I269-S271 VanDerWaalsContact C-N 3.34Å; S271-S295 VanDerWaalsContact OG-CB 3.3Å; S271-S295 WeakPolarHBondContact OG-CB 3.48Å
272	L	95.4	Very high	95.6	Very high	13 Å²	13	36 Å²	36	7%	0.068	20%	0.204	C	C	.	.			trans	-105.8	71.8	-178.2	-54.9	-178.2	0	0	0	110.9	L242 R243 L248 L251 T268 Q274 L275	L242-L272 HydrophobicContact CB-CD1 4.1Å; L242-L272 HydrophobicContact CB-CD2 3.91Å; L242-L272 HydrophobicContact CD1-CD1 4.34Å; R243-L272 HydrophobicContact CB-CD2 4.17Å; L248-L272 HydrophobicContact CD2-CD1 4.47Å; L251-L272 HydrophobicContact CD2-CD1 3.79Å; T268-L272 HydrophobicContact CG2-CD1 3.81Å; T268-L272 HydrophobicContact CG2-CG 4.46Å; T268-L272 VanDerWaalsContact O-CB 3.28Å; T268-L272 WeakPolarHBondContact O-CB 3.21Å; T268-L272 WeakPolarHBondContact O-CG 3.35Å; T268-L272 PolarHBondContact O-N 3.2Å; L272-Q274 PolarHBondContact O-N 2.96Å; L272-L275 HydrophobicContact CB-CB 3.98Å; L272-L275 HydrophobicContact CB-CD2 4.45Å; L272-L275 HydrophobicContact CD1-CD2 4.37Å; L272-L275 WeakPolarHBondContact O-CB 3.25Å; L272-L275 PolarHBondContact O-N 2.83Å
273	A	90.1	Very high	95.8	Very high	67 Å²	67	36.6 Å²	36.6	55%	0.554	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-29.2	-173.2	0	0	0	0	0	115.3	K288	A273-K288 PolarHBondContact O-NZ 3.22Å
274	Q	93.3	Very high	95.8	Very high	114 Å²	114	38.4 Å²	38.4	53%	0.533	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-6.5	-179.2	-62.2	-66.5	-45.1	0	0	114.1	R249 L272	R249-Q274 WeakPolarHBondContact CD-O 3.19Å; R249-Q274 VanDerWaalsContact NH1-CB 3.28Å; L272-Q274 PolarHBondContact O-N 2.96Å
275	L	96.9	Very high	95.8	Very high	2 Å²	2	43 Å²	43	1%	0.01	25%	0.253	C	S	.	.			trans	-62.7	138	-178.3	-165.4	70.1	0	0	0	111.1	R249 L251 T268 L272 L278 V283 K288	R249-L275 WeakPolarHBondContact O-CD1 3.44Å; L251-L275 HydrophobicContact CB-CD1 3.71Å; T268-L275 HydrophobicContact CG2-CD2 4.19Å; L272-L275 HydrophobicContact CB-CB 3.98Å; L272-L275 HydrophobicContact CB-CD2 4.45Å; L272-L275 HydrophobicContact CD1-CD2 4.37Å; L272-L275 WeakPolarHBondContact O-CB 3.25Å; L272-L275 PolarHBondContact O-N 2.83Å; L275-L278 HydrophobicContact CD2-CB 3.89Å; L275-L278 HydrophobicContact CD2-CD1 4.19Å; L275-L278 HydrophobicContact CD2-CD2 4.47Å; L275-L278 HydrophobicContact CD2-CG 4.42Å; L275-V283 HydrophobicContact CD2-CG2 4.45Å; L275-K288 WeakPolarHBondContact O-CE 3.44Å; L275-K288 PolarHBondContact O-NZ 3.1Å
276	C	97.3	Very high	95.7	Very high	65 Å²	65	47.1 Å²	47.1	44%	0.439	28%	0.278	S	S	.	.			trans	-112.5	-36.1	-179.4	-67.3	0	0	0	0	112.1	R249 V283	R249-C276 HydrophobicContact CB-CB 4.43Å; R249-C276 WeakPolarHBondContact O-CA 3.23Å; R249-C276 WeakPolarHBondContact O-CB 3.47Å; R249-C276 PolarHBondContact O-N 2.75Å; C276-V283 PolarHBondContact O-N 2.97Å
277	V	98.3	Very high	95.7	Very high	30 Å²	30	48.6 Å²	48.6	18%	0.182	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	132.6	-180	-175.9	0	0	0	0	108.6	R249 L250 L251 T282	R249-V277 PolarHBondContact O-N 2.89Å; L250-V277 HydrophobicContact CD2-CB 3.52Å; L250-V277 HydrophobicContact CD2-CG1 4.49Å; L250-V277 HydrophobicContact CD2-CG2 3.41Å; L250-V277 VanDerWaalsContact CD2-CG2 3.41Å; L251-V277 PolarHBondContact N-O 3.14Å; L251-V277 VanDerWaalsContact N-O 3.07Å; V277-T282 HydrophobicContact CG2-CG2 4.43Å
278	L	98.1	Very high	95.6	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	120.7	174.5	-179.9	59.9	0	0	0	108.4	L251 Y264 R265 T268 I269 L275 D280 I281 V283	L251-L278 HydrophobicContact CB-CD1 4.14Å; L251-L278 HydrophobicContact CD2-CD1 3.96Å; L251-L278 HydrophobicContact CG-CD1 4.03Å; L251-L278 CarbonylContact O-C 3.6Å; L251-L278 VanDerWaalsContact O-CA 3.31Å; L251-L278 WeakPolarHBondContact O-CA 3.29Å; Y264-L278 HydrophobicContact CE1-CD2 4.45Å; Y264-L278 WeakPolarHBondContact OH-CD1 3.3Å; R265-L278 HydrophobicContact CG-CD2 4.16Å; R265-L278 PolarHBondContact NH1-O 2.84Å; T268-L278 HydrophobicContact CG2-CD1 3.93Å; T268-L278 HydrophobicContact CG2-CD2 3.85Å; I269-L278 HydrophobicContact CG1-CD2 4.13Å; L275-L278 HydrophobicContact CD2-CB 3.89Å; L275-L278 HydrophobicContact CD2-CD1 4.19Å; L275-L278 HydrophobicContact CD2-CD2 4.47Å; L275-L278 HydrophobicContact CD2-CG 4.42Å; L278-D280 VanDerWaalsContact C-N 3.34Å; L278-D280 PolarHBondContact O-N 2.85Å; L278-I281 PolarHBondContact N-O 2.85Å; L278-I281 WeakPolarHBondContact O-CB 3.45Å; L278-I281 PolarHBondContact O-N 2.89Å; L278-V283 HydrophobicContact CB-CG2 4.09Å
279	D	97.1	Very high	95.6	Very high	19 Å²	19	58.3 Å²	58.3	10%	0.102	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	50.6	-178.8	-54.3	-39.4	0	0	0	112	L251 V252 L253 Q254 Y264 I281	L251-D279 PolarHBondContact O-N 2.93Å; V252-D279 WeakPolarHBondContact CA-OD1 3.39Å; L253-D279 PolarHBondContact N-OD1 3.18Å; Q254-D279 HydrophobicContact CB-CB 4.02Å; Q254-D279 PolarHBondContact N-OD1 3.11Å; Y264-D279 VanDerWaalsContact CE1-OD2 3.23Å; Y264-D279 WeakPolarHBondContact CE1-OD2 3.25Å; Y264-D279 PolarHBondContact OH-OD2 3.41Å; D279-I281 PolarHBondContact O-N 2.86Å
280	D	94.8	Very high	95.5	Very high	128 Å²	128	62.9 Å²	62.9	68%	0.684	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	4.7	-175.8	-60.5	-36.5	0	0	0	116.1	L278	L278-D280 VanDerWaalsContact C-N 3.34Å; L278-D280 PolarHBondContact O-N 2.85Å
281	I	95.9	Very high	95.5	Very high	95 Å²	95	61.5 Å²	61.5	49%	0.487	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.2	176.4	-58.1	166	0	0	0	109.6	L278 D279 V283	L278-I281 PolarHBondContact N-O 2.85Å; L278-I281 WeakPolarHBondContact O-CB 3.45Å; L278-I281 PolarHBondContact O-N 2.89Å; D279-I281 PolarHBondContact O-N 2.86Å; I281-V283 PolarHBondContact O-N 2.99Å
282	T	97.1	Very high	95.5	Very high	104 Å²	104	69.5 Å²	69.5	64%	0.638	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.3	132.1	176.9	58.5	0	0	0	0	111.6	V277	V277-T282 HydrophobicContact CG2-CG2 4.43Å
283	V	97	Very high	95.2	Very high	16 Å²	16	70 Å²	70	10%	0.097	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-83.6	116	177.4	-179.3	0	0	0	0	109.7	I269 L275 C276 L278 I281 K288	I269-V283 HydrophobicContact CB-CG1 4.47Å; I269-V283 HydrophobicContact CD1-CG1 3.97Å; I269-V283 HydrophobicContact CD1-CG2 4.15Å; I269-V283 HydrophobicContact CG1-CG1 3.95Å; I269-V283 HydrophobicContact CG1-CG2 4.02Å; I269-V283 HydrophobicContact CG2-CG1 3.71Å; L275-V283 HydrophobicContact CD2-CG2 4.45Å; C276-V283 PolarHBondContact O-N 2.97Å; L278-V283 HydrophobicContact CB-CG2 4.09Å; I281-V283 PolarHBondContact O-N 2.99Å; V283-K288 HydrophobicContact CG1-CD 4.28Å; V283-K288 VanDerWaalsContact CG1-CE 3.47Å; V283-K288 HydrophobicContact CG1-CG 3.82Å
284	S	95.5	Very high	95.3	Very high	48 Å²	48	66.8 Å²	66.8	34%	0.336	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-84.5	153.8	-179	76.9	0	0	0	0	112.6	N286 E287 K288	S284-N286 VanDerWaalsContact C-N 3.27Å; S284-N286 PolarHBondContact O-N 3.24Å; S284-E287 PolarHBondContact N-OE2 2.81Å; S284-E287 WeakPolarHBondContact O-CB 3.49Å; S284-E287 PolarHBondContact O-N 2.91Å; S284-E287 VanDerWaalsContact OG-CB 3.25Å; S284-E287 WeakPolarHBondContact OG-CB 3.49Å; S284-E287 PolarHBondContact OG-N 3.14Å; S284-E287 VanDerWaalsContact OG-N 3.11Å; S284-K288 PolarHBondContact O-N 3.3Å; S284-K288 VanDerWaalsContact O-N 3.1Å
285	P	94.4	Very high	95.1	Very high	106 Å²	106	63.7 Å²	63.7	69%	0.688	34%	0.344	S	S	*	.	H	α-helix	trans	-60.6	-33.7	173.1	-24.5	34.7	0	0	0	113.7	K288 H289	P285-K288 PolarHBondContact O-N 2.97Å; P285-H289 PolarHBondContact O-N 2.96Å; P285-H289 VanDerWaalsContact O-N 3.12Å
286	N	95.1	Very high	94.7	Very high	126 Å²	126	70.6 Å²	70.6	67%	0.674	38%	0.38	S	S	*	.	H	α-helix	trans	-64.9	-42.8	176	-82.1	44.7	0	0	0	111.4	S284 H289 L290	S284-N286 VanDerWaalsContact C-N 3.27Å; S284-N286 PolarHBondContact O-N 3.24Å; N286-H289 WeakPolarHBondContact O-CB 3.47Å; N286-H289 PolarHBondContact O-N 3.48Å; N286-H289 VanDerWaalsContact O-N 3.11Å; N286-L290 WeakPolarHBondContact O-CG 2.99Å; N286-L290 PolarHBondContact O-N 2.64Å
287	E	93.8	Very high	94	Very high	31 Å²	31	70 Å²	70	15%	0.145	37%	0.373	C	S	.	.	H	α-helix	trans	-62.1	-44.4	176.4	-174.4	176.3	-151.6	0	0	111.5	R265 I269 S284 H289 L290 F291	R265-E287 IonicContact CZ-OE1 3.96Å; R265-E287 IonicContact NE-OE1 3.72Å; R265-E287 PolarHBondContact NE-OE1 3.38Å; R265-E287 IonicContact NH2-OE1 2.78Å; R265-E287 PolarHBondContact NH2-OE1 2.96Å; R265-E287 IonicContact NH2-OE2 2.72Å; R265-E287 PolarHBondContact NH2-OE2 2.88Å; I269-E287 HydrophobicContact CD1-CG 3.82Å; I269-E287 WeakPolarHBondContact CD1-OE1 3.47Å; S284-E287 PolarHBondContact N-OE2 2.81Å; S284-E287 WeakPolarHBondContact O-CB 3.49Å; S284-E287 PolarHBondContact O-N 2.91Å; S284-E287 VanDerWaalsContact OG-CB 3.25Å; S284-E287 WeakPolarHBondContact OG-CB 3.49Å; S284-E287 PolarHBondContact OG-N 3.14Å; S284-E287 VanDerWaalsContact OG-N 3.11Å; E287-H289 PolarHBondContact O-N 3.21Å; E287-L290 PolarHBondContact O-N 3.24Å; E287-L290 VanDerWaalsContact O-N 3.09Å; E287-F291 HydrophobicContact CG-CD2 3.77Å; E287-F291 HydrophobicContact CG-CE2 3.61Å; E287-F291 VanDerWaalsContact O-CD2 3.32Å; E287-F291 WeakPolarHBondContact O-CD2 3.27Å; E287-F291 PolarHBondContact O-N 3.44Å; E287-F291 VanDerWaalsContact O-N 3.13Å
288	K	94.8	Very high	93	Very high	65 Å²	65	68.7 Å²	68.7	28%	0.283	37%	0.365	S	S	.	.	H	α-helix	trans	-56.7	-34.2	172	-70.7	-174.6	177.7	-172.6	0	112.8	I269 A273 L275 V283 S284 P285 R292	I269-K288 HydrophobicContact CG2-CB 4.41Å; I269-K288 HydrophobicContact CG2-CG 3.66Å; A273-K288 PolarHBondContact O-NZ 3.22Å; L275-K288 WeakPolarHBondContact O-CE 3.44Å; L275-K288 PolarHBondContact O-NZ 3.1Å; V283-K288 HydrophobicContact CG1-CD 4.28Å; V283-K288 VanDerWaalsContact CG1-CE 3.47Å; V283-K288 HydrophobicContact CG1-CG 3.82Å; S284-K288 PolarHBondContact O-N 3.3Å; S284-K288 VanDerWaalsContact O-N 3.1Å; P285-K288 PolarHBondContact O-N 2.97Å; K288-R292 PolarHBondContact O-N 3.21Å
289	H	95	Very high	92.2	Very high	139 Å²	139	75.9 Å²	75.9	64%	0.644	40%	0.404	S	S	*	.	H	α-helix	trans	-72.4	-41.1	176	-176	65.6	0	0	0	112.4	P285 N286 E287 F291 R292	P285-H289 PolarHBondContact O-N 2.96Å; P285-H289 VanDerWaalsContact O-N 3.12Å; N286-H289 WeakPolarHBondContact O-CB 3.47Å; N286-H289 PolarHBondContact O-N 3.48Å; N286-H289 VanDerWaalsContact O-N 3.11Å; E287-H289 PolarHBondContact O-N 3.21Å; H289-F291 VanDerWaalsContact C-N 3.33Å; H289-F291 PolarHBondContact O-N 2.91Å; H289-R292 VanDerWaalsContact O-CB 3.29Å; H289-R292 WeakPolarHBondContact O-CB 3.38Å; H289-R292 PolarHBondContact O-N 2.82Å
290	L	95.2	Very high	91.5	Very high	97 Å²	97	79.3 Å²	79.3	51%	0.508	42%	0.422	S	S	.	.	H	α-helix	trans	-64.6	-34.2	-179.4	-72.7	171.8	0	0	0	113.4	N286 E287 A645	N286-L290 WeakPolarHBondContact O-CG 2.99Å; N286-L290 PolarHBondContact O-N 2.64Å; E287-L290 PolarHBondContact O-N 3.24Å; E287-L290 VanDerWaalsContact O-N 3.09Å; L290-A645 PolarHBondContact O-N 2.64Å
291	F	95.2	Very high	91	Very high	6 Å²	6	74 Å²	74	3%	0.026	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	4.2	-179.9	-66.2	-61.9	0	0	0	114.2	D270 E287 H289 G293 L294 C642 R643	D270-F291 HydrophobicContact CB-CB 4.42Å; D270-F291 WeakPolarHBondContact CB-O 3.32Å; E287-F291 HydrophobicContact CG-CD2 3.77Å; E287-F291 HydrophobicContact CG-CE2 3.61Å; E287-F291 VanDerWaalsContact O-CD2 3.32Å; E287-F291 WeakPolarHBondContact O-CD2 3.27Å; E287-F291 PolarHBondContact O-N 3.44Å; E287-F291 VanDerWaalsContact O-N 3.13Å; H289-F291 VanDerWaalsContact C-N 3.33Å; H289-F291 PolarHBondContact O-N 2.91Å; F291-G293 PolarHBondContact O-N 3.28Å; F291-L294 HydrophobicContact CD1-CD2 4.24Å; F291-L294 VanDerWaalsContact O-CB 3.25Å; F291-L294 WeakPolarHBondContact O-CB 3.29Å; F291-L294 PolarHBondContact O-N 3.45Å; F291-L294 VanDerWaalsContact O-N 3.16Å; F291-C642 WeakPolarHBondContact CZ-O 3.31Å; F291-R643 VanDerWaalsContact CE1-C 3.45Å
292	R	94.3	Very high	90.5	Very high	189 Å²	189	72 Å²	72	71%	0.713	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	125.6	-172.6	-171.4	-179.5	-177.3	-145.5	0.2	112.3	D270 K288 H289 L294	D270-R292 VanDerWaalsContact OD1-CA 3.28Å; D270-R292 WeakPolarHBondContact OD1-CA 3.49Å; K288-R292 PolarHBondContact O-N 3.21Å; H289-R292 VanDerWaalsContact O-CB 3.29Å; H289-R292 WeakPolarHBondContact O-CB 3.38Å; H289-R292 PolarHBondContact O-N 2.82Å; R292-L294 VanDerWaalsContact C-N 3.34Å
293	G	90.8	Very high	90.1	Very high	22 Å²	22	71 Å²	71	23%	0.227	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	4.5	175.6	0	0	0	0	0	114.4	D270 F291 S295 L296	D270-G293 VanDerWaalsContact CG-N 3.32Å; D270-G293 PolarHBondContact OD1-N 3.48Å; D270-G293 VanDerWaalsContact OD1-N 3.11Å; D270-G293 WeakPolarHBondContact OD2-CA 3.46Å; D270-G293 PolarHBondContact OD2-N 3.02Å; F291-G293 PolarHBondContact O-N 3.28Å; G293-S295 VanDerWaalsContact C-N 3.27Å; G293-S295 PolarHBondContact O-N 3.28Å; G293-L296 WeakPolarHBondContact O-CB 3.43Å; G293-L296 PolarHBondContact O-N 2.88Å
294	L	91	Very high	89.9	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-63.5	-35.8	171.9	-174.5	58.9	0	0	0	111.5	L267 D270 F291 R292 L296 N297 G298 L301 A645 A648 L649	L267-L294 HydrophobicContact CB-CD2 4.31Å; D270-L294 HydrophobicContact CB-CB 4.49Å; D270-L294 PolarHBondContact OD2-N 2.91Å; F291-L294 HydrophobicContact CD1-CD2 4.24Å; F291-L294 VanDerWaalsContact O-CB 3.25Å; F291-L294 WeakPolarHBondContact O-CB 3.29Å; F291-L294 PolarHBondContact O-N 3.45Å; F291-L294 VanDerWaalsContact O-N 3.16Å; R292-L294 VanDerWaalsContact C-N 3.34Å; L294-L296 PolarHBondContact O-N 3.13Å; L294-L296 VanDerWaalsContact O-N 3.1Å; L294-N297 PolarHBondContact O-N 2.68Å; L294-G298 PolarHBondContact O-N 2.74Å; L294-L301 HydrophobicContact CD1-CD1 3.81Å; L294-L301 HydrophobicContact CG-CD1 4.37Å; L294-A645 HydrophobicContact CB-CB 4.03Å; L294-A645 HydrophobicContact CD1-CB 4.48Å; L294-A648 HydrophobicContact CD1-CB 3.72Å; L294-A648 HydrophobicContact CD2-CB 4.38Å; L294-L649 HydrophobicContact CD1-CG 4.5Å
295	S	90	Very high	89.8	Confident	50 Å²	50	69.5 Å²	69.5	35%	0.35	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-63.1	-18.2	179.4	79.1	0	0	0	0	113.6	D270 S271 G293 N297	D270-S295 WeakPolarHBondContact OD2-CB 3.28Å; D270-S295 PolarHBondContact OD2-N 3.29Å; D270-S295 PolarHBondContact OD2-OG 3.15Å; S271-S295 VanDerWaalsContact OG-CB 3.3Å; S271-S295 WeakPolarHBondContact OG-CB 3.48Å; G293-S295 VanDerWaalsContact C-N 3.27Å; G293-S295 PolarHBondContact O-N 3.28Å; S295-N297 VanDerWaalsContact C-N 3.29Å
296	L	87.5	Confident	89.8	Confident	146 Å²	146	65.5 Å²	65.5	76%	0.764	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-75.2	-20.7	176.7	-64.5	171.5	0	0	0	112.6	G293 L294	G293-L296 WeakPolarHBondContact O-CB 3.43Å; G293-L296 PolarHBondContact O-N 2.88Å; L294-L296 PolarHBondContact O-N 3.13Å; L294-L296 VanDerWaalsContact O-N 3.1Å
297	N	83.7	Confident	89.8	Confident	53 Å²	53	59.5 Å²	59.5	28%	0.283	31%	0.306	S	S	.	.	S	Bend	trans	-117.1	14.6	-178	-58.6	-70.1	0	0	0	111.7	L294 S295 D299 L300 L649	L294-N297 PolarHBondContact O-N 2.68Å; S295-N297 VanDerWaalsContact C-N 3.29Å; N297-D299 VanDerWaalsContact C-N 3.28Å; N297-D299 PolarHBondContact O-N 3.5Å; N297-L300 HydrophobicContact CB-CD1 4.39Å; N297-L300 WeakPolarHBondContact O-CB 3.25Å; N297-L300 PolarHBondContact O-N 3.32Å; N297-L649 HydrophobicContact CB-CD2 3.62Å
298	G	77.6	Confident	89.9	Confident	2 Å²	2	58.9 Å²	58.9	2%	0.021	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-52.5	-47	-176.2	0	0	0	0	0	112.4	Q236 L294 L300 L301	Q236-G298 PolarHBondContact NE2-O 3.12Å; L294-G298 PolarHBondContact O-N 2.74Å; G298-L300 PolarHBondContact O-N 3.24Å; G298-L300 VanDerWaalsContact O-N 3.11Å; G298-L301 PolarHBondContact O-N 3.24Å; G298-L301 VanDerWaalsContact O-N 3.1Å
299	D	80.2	Confident	90	Very high	152 Å²	152	55.8 Å²	55.8	81%	0.813	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-63.8	-17.5	-178.2	-55.8	-23.6	0	0	0	114.2	N297	N297-D299 VanDerWaalsContact C-N 3.28Å; N297-D299 PolarHBondContact O-N 3.5Å
300	L	82.6	Confident	90.1	Very high	90 Å²	90	50.6 Å²	50.6	47%	0.471	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-89.6	-18.7	179.8	-61.7	177.6	0	0	0	112.3	N297 G298 F652	N297-L300 HydrophobicContact CB-CD1 4.39Å; N297-L300 WeakPolarHBondContact O-CB 3.25Å; N297-L300 PolarHBondContact O-N 3.32Å; G298-L300 PolarHBondContact O-N 3.24Å; G298-L300 VanDerWaalsContact O-N 3.11Å; L300-F652 HydrophobicContact CB-CD2 4.03Å; L300-F652 HydrophobicContact CB-CE1 4.47Å; L300-F652 HydrophobicContact CB-CE2 3.68Å; L300-F652 HydrophobicContact CB-CZ 3.92Å; L300-F652 HydrophobicContact CD1-CE1 4.3Å; L300-F652 HydrophobicContact CD1-CZ 4.22Å; L300-F652 HydrophobicContact CD2-CE2 4.46Å; L300-F652 HydrophobicContact CD2-CZ 4.18Å; L300-F652 HydrophobicContact CG-CZ 4.33Å; L300-F652 WeakPolarHBondContact O-CD2 3.38Å; L300-F652 WeakPolarHBondContact O-CE2 3.41Å
301	L	85.2	Confident	90.1	Very high	16 Å²	16	46.1 Å²	46.1	8%	0.084	25%	0.245	C	C	.	.	S	Bend	trans	-77.7	130.8	-175.3	-60.8	169.3	0	0	0	110.4	Y263 L294 G298 Q303	Y263-L301 HydrophobicContact CD1-CB 3.95Å; Y263-L301 HydrophobicContact CD1-CD1 4.01Å; Y263-L301 HydrophobicContact CD1-CG 4.39Å; Y263-L301 HydrophobicContact CD2-CB 4.34Å; Y263-L301 HydrophobicContact CD2-CD1 3.57Å; Y263-L301 HydrophobicContact CE1-CB 3.51Å; Y263-L301 HydrophobicContact CE1-CD1 4.33Å; Y263-L301 HydrophobicContact CE1-CG 4.41Å; Y263-L301 HydrophobicContact CE2-CB 3.9Å; Y263-L301 HydrophobicContact CE2-CD1 3.89Å; Y263-L301 HydrophobicContact CG-CB 4.35Å; Y263-L301 HydrophobicContact CG-CD1 3.63Å; Y263-L301 HydrophobicContact CG-CG 4.47Å; Y263-L301 VanDerWaalsContact CZ-CB 3.46Å; Y263-L301 PolarHBondContact OH-O 3.02Å; L294-L301 HydrophobicContact CD1-CD1 3.81Å; L294-L301 HydrophobicContact CG-CD1 4.37Å; G298-L301 PolarHBondContact O-N 3.24Å; G298-L301 VanDerWaalsContact O-N 3.1Å; L301-Q303 PolarHBondContact O-N 3.12Å
302	A	85.5	Confident	90.1	Very high	55 Å²	55	46.8 Å²	46.8	46%	0.455	25%	0.254	S	S	.	.			trans	-66.8	127.5	179.4	0	0	0	0	0	111	Y263 E304	Y263-A302 VanDerWaalsContact CE1-O 3.28Å; Y263-A302 WeakPolarHBondContact CE1-O 3.48Å; Y263-A302 PolarHBondContact OH-O 3.43Å; A302-E304 HydrophobicContact CB-CG 3.96Å; A302-E304 PolarHBondContact O-N 3.32Å
303	Q	87.5	Confident	90.1	Very high	83 Å²	83	40 Å²	40	39%	0.388	23%	0.232	S	C	.	.			trans	-80.5	67	177.5	-169.4	179.1	-8.5	0	0	110.6	T233 V261 L301 L476	T233-Q303 PolarHBondContact O-NE2 3.42Å; V261-Q303 HydrophobicContact CG1-CG 4.35Å; L301-Q303 PolarHBondContact O-N 3.12Å; Q303-L476 HydrophobicContact CG-CD1 4.32Å
304	E	92.1	Very high	90.2	Very high	32 Å²	32	38.9 Å²	38.9	15%	0.15	22%	0.221	C	C	.	.			trans	-129.9	144	178.3	58.6	177.6	-139.7	0	0	110.9	P262 A302 Q306 L473 R474	P262-E304 WeakPolarHBondContact CD-O 3.39Å; A302-E304 HydrophobicContact CB-CG 3.96Å; A302-E304 PolarHBondContact O-N 3.32Å; E304-Q306 HydrophobicContact CG-CG 4.48Å; E304-Q306 PolarHBondContact OE1-NE2 3.1Å; E304-L473 CarbonylContact C-O 3.57Å; E304-L473 WeakPolarHBondContact CA-O 3.46Å; E304-L473 WeakPolarHBondContact CB-O 3.45Å; E304-R474 HydrophobicContact CB-CG 4.1Å
305	A	94	Very high	90.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	140.8	169.6	0	0	0	0	0	109.3	L260 F307 S472 L473 L476 L479	L260-A305 HydrophobicContact CB-CB 3.82Å; A305-F307 HydrophobicContact CB-CE2 3.67Å; A305-F307 HydrophobicContact CB-CZ 4.3Å; A305-S472 WeakPolarHBondContact O-CA 3.41Å; A305-L473 PolarHBondContact N-O 3.07Å; A305-L473 PolarHBondContact O-N 3.29Å; A305-L476 HydrophobicContact CB-CD2 3.75Å; A305-L479 HydrophobicContact CB-CD2 3.49Å; A305-L479 VanDerWaalsContact CB-CD2 3.49Å
306	Q	94.5	Very high	90.1	Very high	22 Å²	22	40.5 Å²	40.5	10%	0.103	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.3	-176.7	-65.4	-176.7	1.3	0	0	110.6	P262 E304 H471 N640 M651	P262-Q306 HydrophobicContact CG-CB 4.14Å; P262-Q306 HydrophobicContact CG-CG 4.12Å; E304-Q306 HydrophobicContact CG-CG 4.48Å; E304-Q306 PolarHBondContact OE1-NE2 3.1Å; Q306-H471 CarbonylContact C-O 3.5Å; Q306-H471 WeakPolarHBondContact CA-O 3.39Å; Q306-N640 HydrophobicContact CB-CB 3.98Å; Q306-N640 WeakPolarHBondContact O-CB 3.22Å; Q306-N640 PolarHBondContact O-N 3.08Å; Q306-M651 VanDerWaalsContact CD-CE 3.45Å; Q306-M651 VanDerWaalsContact NE2-CE 3.3Å
307	F	95.5	Very high	90.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	149.9	-179.1	-60.7	-95.5	0	0	0	111.2	A305 F344 Q470 H471 L479 L483 L573 I637 Q638 L639	A305-F307 HydrophobicContact CB-CE2 3.67Å; A305-F307 HydrophobicContact CB-CZ 4.3Å; F307-F344 HydrophobicContact CB-CZ 3.98Å; F307-F344 HydrophobicContact CD2-CZ 4Å; F307-F344 AromaticContact CG-CZ 3.96Å; F307-F344 HydrophobicContact CG-CZ 3.96Å; F307-Q470 CarbonylContact O-C 3.58Å; F307-Q470 WeakPolarHBondContact O-CA 3.48Å; F307-H471 HydrophobicContact CB-CB 4.46Å; F307-H471 PolarHBondContact N-O 3.16Å; F307-H471 PolarHBondContact O-N 3.34Å; F307-L479 HydrophobicContact CE2-CD1 3.84Å; F307-L479 HydrophobicContact CE2-CD2 3.66Å; F307-L479 HydrophobicContact CE2-CG 4.34Å; F307-L479 HydrophobicContact CZ-CD1 3.95Å; F307-L479 HydrophobicContact CZ-CD2 3.99Å; F307-L479 HydrophobicContact CZ-CG 4.41Å; F307-L483 HydrophobicContact CE1-CD2 4.3Å; F307-L483 HydrophobicContact CZ-CD1 4.19Å; F307-L573 HydrophobicContact CD1-CD1 4.4Å; F307-L573 HydrophobicContact CE1-CD1 4.14Å; F307-I637 HydrophobicContact CD1-CG2 4.36Å; F307-Q638 CarbonylContact C-O 3.58Å; F307-Q638 WeakPolarHBondContact CA-O 3.28Å; F307-L639 HydrophobicContact CD1-CB 4.35Å; F307-L639 HydrophobicContact CD1-CD1 4.07Å; F307-L639 HydrophobicContact CE1-CB 4.19Å; F307-L639 HydrophobicContact CE1-CD1 3.56Å; F307-L639 HydrophobicContact CE1-CG 4.42Å; F307-L639 HydrophobicContact CE2-CD1 4.24Å; F307-L639 HydrophobicContact CZ-CD1 3.65Å
308	V	96.1	Very high	90.2	Very high	17 Å²	17	32.7 Å²	32.7	10%	0.103	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	116.8	168.9	-174.6	0	0	0	0	108.4	T310 E468 M469 I637 Q638	V308-T310 HydrophobicContact CG1-CG2 4.14Å; V308-E468 HydrophobicContact CG1-CG 3.61Å; V308-M469 WeakPolarHBondContact CA-O 3.3Å; V308-I637 WeakPolarHBondContact O-CA 3.18Å; V308-Q638 HydrophobicContact CB-CB 4.46Å; V308-Q638 PolarHBondContact N-O 3.14Å; V308-Q638 PolarHBondContact O-N 3.38Å
309	V	96.6	Very high	90.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	124.1	174.8	-178.5	0	0	0	0	108.3	I311 Y342 F344 E468 M469 I637	V309-I311 HydrophobicContact CG1-CD1 4.29Å; V309-Y342 HydrophobicContact CB-CE2 4.15Å; V309-Y342 HydrophobicContact CG1-CD1 4.47Å; V309-Y342 HydrophobicContact CG1-CD2 4.16Å; V309-Y342 HydrophobicContact CG1-CE1 4.15Å; V309-Y342 HydrophobicContact CG1-CE2 3.8Å; V309-Y342 HydrophobicContact CG1-CG 4.49Å; V309-Y342 HydrophobicContact CG2-CE2 4.01Å; V309-F344 HydrophobicContact CG2-CD2 4.25Å; V309-F344 HydrophobicContact CG2-CE2 4.1Å; V309-E468 CarbonylContact O-C 3.57Å; V309-E468 WeakPolarHBondContact O-CA 3.06Å; V309-M469 PolarHBondContact N-O 2.73Å; V309-M469 PolarHBondContact O-N 3.23Å; V309-I637 HydrophobicContact CG1-CG1 4.22Å; V309-I637 HydrophobicContact CG2-CG1 4.18Å; V309-I637 HydrophobicContact CG2-CG2 4.42Å
310	T	96.5	Very high	90.6	Very high	31 Å²	31	26.5 Å²	26.5	19%	0.19	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.3	178.2	50.4	0	0	0	0	110.2	V308 Y467 E468 Q636	V308-T310 HydrophobicContact CG1-CG2 4.14Å; T310-Y467 CarbonylContact C-O 3.41Å; T310-Y467 VanDerWaalsContact CA-O 3.25Å; T310-Y467 WeakPolarHBondContact CA-O 3.44Å; T310-E468 HydrophobicContact CG2-CB 4.18Å; T310-E468 HydrophobicContact CG2-CG 3.91Å; T310-Q636 PolarHBondContact N-O 2.87Å; T310-Q636 PolarHBondContact O-N 2.9Å; T310-Q636 WeakPolarHBondContact OG1-CB 3.48Å; T310-Q636 WeakPolarHBondContact OG1-CG 3.26Å; T310-Q636 PolarHBondContact OG1-O 2.98Å
311	I	96.3	Very high	90.5	Very high	2 Å²	2	24 Å²	24	1%	0.01	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	114.6	174.4	-51.2	-63.6	0	0	0	107.8	V309 V340 Y342 T454 C465 G466 Y467 V633 V635	V309-I311 HydrophobicContact CG1-CD1 4.29Å; I311-V340 HydrophobicContact CG2-CB 4.02Å; I311-V340 HydrophobicContact CG2-CG1 4.11Å; I311-V340 HydrophobicContact CG2-CG2 3.96Å; I311-Y342 HydrophobicContact CD1-CD1 4.43Å; I311-T454 HydrophobicContact CB-CG2 4.04Å; I311-T454 HydrophobicContact CG1-CG2 4.07Å; I311-T454 HydrophobicContact CG2-CG2 4.15Å; I311-C465 HydrophobicContact CB-CB 4.4Å; I311-C465 HydrophobicContact CG2-CB 4.07Å; I311-C465 WeakPolarHBondContact O-CB 3.4Å; I311-G466 PolarHBondContact O-N 3.25Å; I311-Y467 HydrophobicContact CB-CD1 4.21Å; I311-Y467 HydrophobicContact CG1-CD1 3.81Å; I311-Y467 HydrophobicContact CG1-CE1 4.44Å; I311-Y467 PolarHBondContact N-O 3.16Å; I311-Y467 PolarHBondContact O-N 2.98Å; I311-V633 HydrophobicContact CG2-CG2 3.79Å; I311-V635 HydrophobicContact CD1-CB 4.33Å; I311-V635 HydrophobicContact CD1-CG1 3.92Å; I311-V635 HydrophobicContact CD1-CG2 3.82Å
312	G	94.1	Very high	90.3	Very high	21 Å²	21	24.5 Å²	24.5	22%	0.216	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-134.3	-175.6	0	0	0	0	0	112.8	C465 E634	G312-C465 VanDerWaalsContact O-CB 3.23Å; G312-C465 WeakPolarHBondContact O-CB 3.47Å; G312-C465 PolarHBondContact O-N 2.8Å; G312-C465 VanDerWaalsContact O-N 3.12Å; G312-E634 PolarHBondContact N-O 3.05Å
313	N	94.9	Very high	89.9	Confident	45 Å²	45	27.1 Å²	27.1	24%	0.241	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	141.2	-175.7	-57.2	-62.1	0	0	0	112.1	V462 P464 E634	N313-V462 HydrophobicContact CB-CG1 3.81Å; N313-P464 WeakPolarHBondContact OD1-CA 3.4Å; N313-E634 PolarHBondContact N-OE2 3.33Å; N313-E634 PolarHBondContact ND2-OE2 2.85Å; N313-E634 PolarHBondContact O-N 2.64Å
314	I	93.6	Very high	89.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	132.5	163	-41.7	173.1	0	0	0	108.5	V317 V340 I463 I491 L631 T632 V633	I314-V317 HydrophobicContact CB-CG2 4.32Å; I314-V317 HydrophobicContact CG2-CG2 3.45Å; I314-V317 VanDerWaalsContact CG2-CG2 3.45Å; I314-V340 HydrophobicContact CD1-CG2 3.48Å; I314-V340 VanDerWaalsContact CD1-CG2 3.48Å; I314-V340 HydrophobicContact CG1-CG2 3.89Å; I314-I463 HydrophobicContact CB-CB 4.19Å; I314-I463 HydrophobicContact CD1-CG2 4.48Å; I314-I463 PolarHBondContact N-O 3.29Å; I314-I463 PolarHBondContact O-N 2.97Å; I314-I491 HydrophobicContact CG2-CD1 3.72Å; I314-I491 HydrophobicContact CG2-CG2 4.48Å; I314-L631 HydrophobicContact CG2-CD1 4.25Å; I314-T632 CarbonylContact C-O 3.58Å; I314-T632 VanDerWaalsContact CA-O 3.31Å; I314-T632 WeakPolarHBondContact CA-O 3.28Å; I314-V633 HydrophobicContact CG1-CG2 4.32Å
315	R	92.3	Very high	88.6	Confident	83 Å²	83	29.2 Å²	29.2	31%	0.313	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	160.9	177	-60.1	176.9	178.6	-88.7	-4.8	110.3	V317 V462 L631 T632	R315-V317 VanDerWaalsContact C-N 3.29Å; R315-V317 PolarHBondContact O-N 3.19Å; R315-V462 HydrophobicContact CG-CG1 4.28Å; R315-V462 HydrophobicContact CG-CG2 4.42Å; R315-V462 VanDerWaalsContact NH1-CG2 3.32Å; R315-L631 VanDerWaalsContact O-CA 3.31Å; R315-L631 WeakPolarHBondContact O-CA 3.19Å; R315-T632 PolarHBondContact N-O 3.27Å; R315-T632 PolarHBondContact O-N 3.31Å
316	G	86.5	Confident	87.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.204	C	C	.	.	S	Bend	trans	71.8	16.3	175.5	0	0	0	0	0	115.5	P630	G316-P630 WeakPolarHBondContact CA-O 3.31Å
317	V	88.3	Confident	86.4	Confident	4 Å²	4	39.5 Å²	39.5	2%	0.024	22%	0.22	C	C	.	.			trans	-71.2	130.4	176.6	-174.5	0	0	0	0	110.6	I314 R315 Y338 W459 I463 L563 L631	I314-V317 HydrophobicContact CB-CG2 4.32Å; I314-V317 HydrophobicContact CG2-CG2 3.45Å; I314-V317 VanDerWaalsContact CG2-CG2 3.45Å; R315-V317 VanDerWaalsContact C-N 3.29Å; R315-V317 PolarHBondContact O-N 3.19Å; V317-Y338 HydrophobicContact CG1-CD1 3.49Å; V317-Y338 VanDerWaalsContact CG1-CD1 3.49Å; V317-Y338 HydrophobicContact CG1-CE1 3.33Å; V317-Y338 HydrophobicContact CG1-CG 4.15Å; V317-W459 PolarHBondContact O-NE1 2.69Å; V317-I463 HydrophobicContact CB-CD1 4.37Å; V317-I463 HydrophobicContact CG1-CD1 4.45Å; V317-I463 HydrophobicContact CG2-CD1 4.05Å; V317-L563 HydrophobicContact CG1-CD1 4.06Å; V317-L631 HydrophobicContact CB-CD1 4.4Å; V317-L631 HydrophobicContact CG2-CD1 3.7Å
318	L	84.2	Confident	85.2	Confident	32 Å²	32	41.2 Å²	41.2	17%	0.168	24%	0.238	C	C	.	.			trans	-70.9	130.8	172.9	172.7	62.2	0	0	0	110.6	T320 Y338 V589 S594	L318-T320 PolarHBondContact O-N 3.45Å; L318-Y338 PolarHBondContact O-OH 3.09Å; L318-V589 HydrophobicContact CB-CG1 4.19Å; L318-S594 WeakPolarHBondContact CD1-OG 3.4Å
319	D	83.7	Confident	84.1	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.016	27%	0.268	C	S	.	.			trans	-76.6	88.3	170	-169.4	-10.5	0	0	0	110.2	S321 V322 W459 T598 R601	D319-S321 PolarHBondContact O-N 3.03Å; D319-S321 VanDerWaalsContact OD1-CB 3.3Å; D319-S321 WeakPolarHBondContact OD1-CB 3.47Å; D319-S321 PolarHBondContact OD1-N 3.31Å; D319-S321 PolarHBondContact OD1-OG 2.99Å; D319-S321 PolarHBondContact OD2-OG 3.43Å; D319-V322 HydrophobicContact CB-CG1 4.07Å; D319-V322 WeakPolarHBondContact O-CG2 3.18Å; D319-V322 PolarHBondContact O-N 3.48Å; D319-W459 HydrophobicContact CB-CD2 3.59Å; D319-W459 VanDerWaalsContact CB-CE2 3.46Å; D319-W459 HydrophobicContact CB-CE3 4.1Å; D319-W459 HydrophobicContact CB-CG 3.96Å; D319-W459 HydrophobicContact CB-CH2 4.34Å; D319-W459 HydrophobicContact CB-CZ2 3.86Å; D319-W459 HydrophobicContact CB-CZ3 4.44Å; D319-T598 HydrophobicContact CB-CG2 4.27Å; D319-R601 IonicContact OD1-NH1 3.92Å; D319-R601 IonicContact OD2-CZ 3.94Å; D319-R601 IonicContact OD2-NE 3.48Å; D319-R601 IonicContact OD2-NH1 3.21Å; D319-R601 PolarHBondContact OD2-NH1 3.37Å; D319-R601 IonicContact OD2-NH2 3.47Å; D319-R601 PolarHBondContact OD2-NH2 3.35Å
320	T	82.7	Confident	83.1	Confident	20 Å²	20	53.4 Å²	53.4	12%	0.123	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-65.7	-21.2	-177.7	-49.5	0	0	0	0	112.4	L318 V322 L323 Y336 E493	L318-T320 PolarHBondContact O-N 3.45Å; T320-V322 PolarHBondContact O-N 3.11Å; T320-V322 VanDerWaalsContact O-N 3.1Å; T320-L323 HydrophobicContact CG2-CD1 4.28Å; T320-L323 WeakPolarHBondContact O-CB 3.28Å; T320-L323 PolarHBondContact O-N 3.41Å; T320-Y336 HydrophobicContact CG2-CE1 3.83Å; T320-Y336 WeakPolarHBondContact CG2-OH 3.45Å; T320-E493 VanDerWaalsContact CB-OE2 3.27Å; T320-E493 WeakPolarHBondContact CB-OE2 3.49Å; T320-E493 PolarHBondContact OG1-OE2 3.22Å
321	S	81.4	Confident	82.2	Confident	38 Å²	38	52.7 Å²	52.7	27%	0.266	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-63.3	-19.3	178.6	78.1	0	0	0	0	113.8	D319 L323 D324 R601	D319-S321 PolarHBondContact O-N 3.03Å; D319-S321 VanDerWaalsContact OD1-CB 3.3Å; D319-S321 WeakPolarHBondContact OD1-CB 3.47Å; D319-S321 PolarHBondContact OD1-N 3.31Å; D319-S321 PolarHBondContact OD1-OG 2.99Å; D319-S321 PolarHBondContact OD2-OG 3.43Å; S321-L323 PolarHBondContact O-N 3Å; S321-D324 PolarHBondContact O-N 3.31Å; S321-R601 PolarHBondContact OG-NH1 3.1Å
322	V	79.3	Confident	81.5	Confident	27 Å²	27	54.6 Å²	54.6	16%	0.164	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-73.3	-15.9	176.2	-51.7	0	0	0	0	113	D319 T320 L597	D319-V322 HydrophobicContact CB-CG1 4.07Å; D319-V322 WeakPolarHBondContact O-CG2 3.18Å; D319-V322 PolarHBondContact O-N 3.48Å; T320-V322 PolarHBondContact O-N 3.11Å; T320-V322 VanDerWaalsContact O-N 3.1Å; V322-L597 HydrophobicContact CB-CB 4.02Å; V322-L597 HydrophobicContact CG2-CB 3.78Å; V322-L597 HydrophobicContact CG2-CD1 4.19Å
323	L	77.7	Confident	80.9	Confident	109 Å²	109	56.8 Å²	56.8	57%	0.571	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-20.8	178.4	-56.3	179.4	0	0	0	112.1	T320 S321 L597	T320-L323 HydrophobicContact CG2-CD1 4.28Å; T320-L323 WeakPolarHBondContact O-CB 3.28Å; T320-L323 PolarHBondContact O-N 3.41Å; S321-L323 PolarHBondContact O-N 3Å; L323-L597 HydrophobicContact CD2-CD1 4.18Å
324	D	79.3	Confident	80.5	Confident	48 Å²	48	57 Å²	57	26%	0.257	32%	0.321	S	S	.	.	S	Bend	trans	-81.6	141.3	178.4	-74.4	-36	0	0	0	111.5	S321 Y336 K495	S321-D324 PolarHBondContact O-N 3.31Å; D324-Y336 VanDerWaalsContact OD2-CE2 3.22Å; D324-Y336 WeakPolarHBondContact OD2-CE2 3.46Å; D324-Y336 PolarHBondContact OD2-OH 3.27Å; D324-K495 IonicContact OD1-NZ 2.75Å; D324-K495 PolarHBondContact OD1-NZ 3.16Å; D324-K495 IonicContact OD2-NZ 3.93Å; D324-K495 PolarHBondContact OD2-NZ 2.99Å
325	P	73.5	Confident	80.1	Confident	112 Å²	112	59.4 Å²	59.4	73%	0.727	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-64.8	148.7	175.4	26.2	-32.6	0	0	0	111.7	P327	P325-P327 WeakPolarHBondContact O-CD 3.45Å
326	E	71.5	Confident	80	Confident	168 Å²	168	56.7 Å²	56.7	79%	0.785	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-59.1	123.8	175.7	-74.7	-170	-176.1	0	0	109.9	G328	E326-G328 PolarHBondContact O-N 2.93Å
327	P	70.1	Confident	80.3	Confident	70 Å²	70	57.4 Å²	57.4	46%	0.455	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-69	136.1	-173.6	25.9	-33.4	0	0	0	111.5	P325 P332 F333	P325-P327 WeakPolarHBondContact O-CD 3.45Å; P327-P332 VanDerWaalsContact CB-O 3.25Å; P327-P332 WeakPolarHBondContact CB-O 3.18Å; P327-F333 HydrophobicContact CB-CD1 4.32Å; P327-F333 HydrophobicContact CG-CD1 4.18Å
328	G	71.1	Confident	80.5	Confident	36 Å²	36	57.3 Å²	57.3	37%	0.371	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-68.5	173.4	171.9	0	0	0	0	0	112.3	E326 E330 G331	E326-G328 PolarHBondContact O-N 2.93Å; G328-E330 PolarHBondContact O-N 2.91Å; G328-G331 PolarHBondContact O-N 2.89Å; G328-G331 VanDerWaalsContact O-N 3.15Å
329	P	72.9	Confident	80.9	Confident	113 Å²	113	56.5 Å²	56.5	73%	0.734	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-15.5	-179.4	25.6	-33.8	0	0	0	114.4
330	E	76.4	Confident	81.5	Confident	159 Å²	159	56.4 Å²	56.4	74%	0.743	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-2.4	-177.3	-65.1	174.3	-175.4	0	0	113.3	G328 P500	G328-E330 PolarHBondContact O-N 2.91Å; E330-P500 WeakPolarHBondContact O-CD 3.19Å
331	G	76.8	Confident	82	Confident	16 Å²	16	55.5 Å²	55.5	17%	0.165	32%	0.324	C	S	.	.			trans	88.8	-173.8	-178	0	0	0	0	0	114.2	G328	G328-G331 PolarHBondContact O-N 2.89Å; G328-G331 VanDerWaalsContact O-N 3.15Å
332	P	80.6	Confident	82.6	Confident	42 Å²	42	53.9 Å²	53.9	27%	0.273	31%	0.312	S	S	.	.	P	Polyproline II helix	cis	-75.4	141.7	0.6	28.6	-30.3	0	0	0	112.3	P327 L497 S498 W499	P327-P332 VanDerWaalsContact CB-O 3.25Å; P327-P332 WeakPolarHBondContact CB-O 3.18Å; P332-L497 HydrophobicContact CB-CB 4.48Å; P332-L497 HydrophobicContact CB-CD2 4.43Å; P332-S498 CarbonylContact C-O 3.53Å; P332-S498 WeakPolarHBondContact CA-O 3.28Å; P332-W499 HydrophobicContact CB-CD2 4.08Å; P332-W499 HydrophobicContact CB-CE3 4.25Å; P332-W499 HydrophobicContact CB-CH2 3.85Å; P332-W499 HydrophobicContact CB-CZ2 3.63Å; P332-W499 HydrophobicContact CB-CZ3 4.14Å; P332-W499 VanDerWaalsContact CD-CH2 3.49Å; P332-W499 HydrophobicContact CG-CH2 3.83Å; P332-W499 HydrophobicContact CG-CZ2 3.91Å; P332-W499 HydrophobicContact CG-CZ3 4.36Å
333	F	83.2	Confident	83.3	Confident	67 Å²	67	52.8 Å²	52.8	29%	0.294	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	119.8	166.9	-55.1	-80.2	0	0	0	108.7	P327 S498 P500 L553	P327-F333 HydrophobicContact CB-CD1 4.32Å; P327-F333 HydrophobicContact CG-CD1 4.18Å; F333-S498 WeakPolarHBondContact CB-OG 3.38Å; F333-S498 PolarHBondContact N-O 3.04Å; F333-S498 PolarHBondContact O-N 3.02Å; F333-S498 PolarHBondContact O-OG 3.19Å; F333-P500 HydrophobicContact CE2-CG 4.06Å; F333-L553 HydrophobicContact CD2-CD1 4.27Å; F333-L553 HydrophobicContact CD2-CD2 4.18Å; F333-L553 HydrophobicContact CE2-CD2 4.21Å
334	V	84.9	Confident	84	Confident	50 Å²	50	47.6 Å²	47.6	30%	0.303	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	129.5	179.4	-167.6	0	0	0	0	109.8	Y336 K495 L497	V334-Y336 HydrophobicContact CB-CE2 4.44Å; V334-Y336 HydrophobicContact CG1-CD2 3.87Å; V334-Y336 HydrophobicContact CG1-CE2 3.44Å; V334-Y336 VanDerWaalsContact CG1-CE2 3.44Å; V334-K495 HydrophobicContact CG1-CD 4.21Å; V334-K495 HydrophobicContact CG1-CG 3.79Å; V334-L497 HydrophobicContact CB-CD2 4.3Å; V334-L497 HydrophobicContact CG1-CD2 4.1Å; V334-L497 HydrophobicContact CG2-CD2 3.67Å
335	A	86.6	Confident	84.6	Confident	50 Å²	50	45.9 Å²	45.9	41%	0.413	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	136.3	169	0	0	0	0	0	109.5	K495 I496	A335-K495 WeakPolarHBondContact O-CA 3.45Å; A335-I496 PolarHBondContact N-O 3.34Å; A335-I496 PolarHBondContact O-N 3.12Å
336	Y	89.6	Confident	85	Confident	27 Å²	27	45.5 Å²	45.5	11%	0.106	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130.4	174.7	-76.5	-88.2	0	0	0	109.8	T320 D324 V334 E493 E494 K495	T320-Y336 HydrophobicContact CG2-CE1 3.83Å; T320-Y336 WeakPolarHBondContact CG2-OH 3.45Å; D324-Y336 VanDerWaalsContact OD2-CE2 3.22Å; D324-Y336 WeakPolarHBondContact OD2-CE2 3.46Å; D324-Y336 PolarHBondContact OD2-OH 3.27Å; V334-Y336 HydrophobicContact CB-CE2 4.44Å; V334-Y336 HydrophobicContact CG1-CD2 3.87Å; V334-Y336 HydrophobicContact CG1-CE2 3.44Å; V334-Y336 VanDerWaalsContact CG1-CE2 3.44Å; Y336-E493 HydrophobicContact CD1-CG 3.83Å; Y336-E493 HydrophobicContact CE1-CG 4.27Å; Y336-E493 WeakPolarHBondContact CE1-OE1 3.42Å; Y336-E494 WeakPolarHBondContact CA-O 3.38Å; Y336-K495 HydrophobicContact CD1-CB 4.11Å; Y336-K495 HydrophobicContact CD1-CG 4.43Å; Y336-K495 HydrophobicContact CE1-CB 3.84Å; Y336-K495 HydrophobicContact CE1-CD 3.89Å; Y336-K495 HydrophobicContact CE1-CG 3.91Å; Y336-K495 WeakPolarHBondContact OH-CD 3.22Å; Y336-K495 PolarHBondContact OH-NZ 3.29Å
337	S	91.8	Very high	85.1	Confident	15 Å²	15	39.2 Å²	39.2	11%	0.105	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	145.4	175	19	0	0	0	0	109.3	K457 E494	S337-K457 CarbonylContact C-O 3.58Å; S337-K457 WeakPolarHBondContact CA-O 3.46Å; S337-E494 PolarHBondContact N-O 2.7Å; S337-E494 PolarHBondContact O-N 3.34Å; S337-E494 WeakPolarHBondContact OG-CB 3.41Å; S337-E494 WeakPolarHBondContact OG-CG 3.38Å; S337-E494 PolarHBondContact OG-O 2.84Å; S337-E494 PolarHBondContact OG-OE2 2.78Å
338	Y	93.1	Very high	84.6	Confident	1 Å²	1	45.3 Å²	45.3	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	134.6	177.5	-58.7	-91.2	0	0	0	108.4	V317 L318 K457 W459 I463 V492 E493 L563	V317-Y338 HydrophobicContact CG1-CD1 3.49Å; V317-Y338 VanDerWaalsContact CG1-CD1 3.49Å; V317-Y338 HydrophobicContact CG1-CE1 3.33Å; V317-Y338 HydrophobicContact CG1-CG 4.15Å; L318-Y338 PolarHBondContact O-OH 3.09Å; Y338-K457 PolarHBondContact N-O 2.9Å; Y338-K457 PolarHBondContact O-N 3.2Å; Y338-W459 HydrophobicContact CD2-CB 4.24Å; Y338-W459 HydrophobicContact CE2-CB 3.62Å; Y338-W459 HydrophobicContact CE2-CG 4.29Å; Y338-I463 HydrophobicContact CD2-CD1 4Å; Y338-I463 HydrophobicContact CG-CD1 3.93Å; Y338-V492 WeakPolarHBondContact CA-O 3.45Å; Y338-E493 HydrophobicContact CD1-CB 4Å; Y338-E493 HydrophobicContact CD1-CG 4.18Å; Y338-E493 HydrophobicContact CE1-CB 3.77Å; Y338-E493 HydrophobicContact CE1-CG 3.57Å; Y338-E493 WeakPolarHBondContact CE1-OE2 3.33Å; Y338-E493 VanDerWaalsContact CZ-OE2 3.28Å; Y338-E493 PolarHBondContact OH-OE2 3.46Å; Y338-L563 HydrophobicContact CD1-CD1 3.89Å; Y338-L563 HydrophobicContact CE1-CD1 3.91Å
339	Y	93.6	Very high	83.3	Confident	16 Å²	16	52.8 Å²	52.8	6%	0.063	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	164.5	177.6	64.8	-81.1	0	0	0	110.2	T341 N453 H456 V492 E494	Y339-T341 HydrophobicContact CD2-CG2 3.73Å; Y339-T341 HydrophobicContact CE2-CG2 3.4Å; Y339-T341 VanDerWaalsContact CE2-CG2 3.4Å; Y339-N453 HydrophobicContact CD2-CB 3.9Å; Y339-N453 HydrophobicContact CE2-CB 4.11Å; Y339-H456 AromaticContact CD1-CD2 4Å; Y339-H456 AromaticContact CD1-CE1 3.42Å; Y339-H456 VanDerWaalsContact CD1-CE1 3.42Å; Y339-H456 WeakPolarHBondContact CD1-CE1 3.33Å; Y339-H456 AromaticContact CD1-CG 3.94Å; Y339-H456 AromaticContact CD1-ND1 3.58Å; Y339-H456 AromaticContact CD1-NE2 3.68Å; Y339-H456 AromaticContact CD2-NE2 3.98Å; Y339-H456 AromaticContact CE1-CE1 3.37Å; Y339-H456 WeakPolarHBondContact CE1-CE1 3.44Å; Y339-H456 AromaticContact CE1-ND1 3.85Å; Y339-H456 AromaticContact CE1-NE2 3.88Å; Y339-H456 AromaticContact CG-CD2 3.92Å; Y339-H456 AromaticContact CG-CE1 3.97Å; Y339-H456 AromaticContact CG-NE2 3.73Å; Y339-H456 AromaticContact CZ-CE1 3.85Å; Y339-V492 HydrophobicContact CD1-CB 4.18Å; Y339-V492 HydrophobicContact CD2-CB 4.35Å; Y339-V492 HydrophobicContact CE1-CB 3.71Å; Y339-V492 HydrophobicContact CE1-CG1 3.7Å; Y339-V492 HydrophobicContact CE2-CB 3.93Å; Y339-V492 HydrophobicContact CE2-CG1 4.39Å; Y339-V492 HydrophobicContact CE2-CG2 4.08Å; Y339-V492 HydrophobicContact CG-CB 4.48Å; Y339-V492 PolarHBondContact N-O 3.09Å; Y339-V492 VanDerWaalsContact N-O 3.08Å; Y339-V492 PolarHBondContact O-N 3.13Å; Y339-V492 WeakPolarHBondContact OH-CG1 3.37Å; Y339-E494 HydrophobicContact CE1-CB 4.05Å
340	V	94.8	Very high	81.7	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	141.2	177.2	-175.7	0	0	0	0	108.3	I311 I314 N453 T454 V489 T490 I491 V633	I311-V340 HydrophobicContact CG2-CB 4.02Å; I311-V340 HydrophobicContact CG2-CG1 4.11Å; I311-V340 HydrophobicContact CG2-CG2 3.96Å; I314-V340 HydrophobicContact CD1-CG2 3.48Å; I314-V340 VanDerWaalsContact CD1-CG2 3.48Å; I314-V340 HydrophobicContact CG1-CG2 3.89Å; V340-N453 CarbonylContact O-C 3.37Å; V340-N453 WeakPolarHBondContact O-CA 3.27Å; V340-T454 HydrophobicContact CB-CG2 3.99Å; V340-T454 PolarHBondContact N-OG1 2.85Å; V340-T454 PolarHBondContact O-N 2.81Å; V340-V489 HydrophobicContact CG1-CG1 3.5Å; V340-V489 VanDerWaalsContact CG1-CG1 3.5Å; V340-T490 CarbonylContact C-O 3.55Å; V340-T490 VanDerWaalsContact CA-O 3.32Å; V340-T490 WeakPolarHBondContact CA-O 3.25Å; V340-I491 HydrophobicContact CG2-CG1 4.4Å; V340-V633 HydrophobicContact CG1-CG2 4.41Å; V340-V633 HydrophobicContact CG2-CG2 4Å
341	T	94.1	Very high	79.7	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	149.6	169.2	68.2	0	0	0	0	111.4	Y339 L451 F452 N453 V489 T490 V492	Y339-T341 HydrophobicContact CD2-CG2 3.73Å; Y339-T341 HydrophobicContact CE2-CG2 3.4Å; Y339-T341 VanDerWaalsContact CE2-CG2 3.4Å; T341-L451 HydrophobicContact CG2-CD2 4.22Å; T341-L451 HydrophobicContact CG2-CG 4.42Å; T341-F452 CarbonylContact C-O 3.54Å; T341-F452 WeakPolarHBondContact CA-O 3.17Å; T341-F452 WeakPolarHBondContact CB-O 3.5Å; T341-N453 HydrophobicContact CG2-CB 4.01Å; T341-V489 CarbonylContact O-C 3.6Å; T341-V489 WeakPolarHBondContact O-CA 3.23Å; T341-T490 PolarHBondContact N-O 3.27Å; T341-T490 PolarHBondContact O-N 3.49Å; T341-T490 WeakPolarHBondContact OG1-CB 3.41Å; T341-V492 HydrophobicContact CG2-CG2 4.18Å
342	Y	94.3	Very high	77.8	Confident	3 Å²	3	53.6 Å²	53.6	1%	0.012	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	151.3	173.2	69.2	-82.9	0	0	0	111.6	V309 I311 F344 F452 Y467 M469 H471 T488	V309-Y342 HydrophobicContact CB-CE2 4.15Å; V309-Y342 HydrophobicContact CG1-CD1 4.47Å; V309-Y342 HydrophobicContact CG1-CD2 4.16Å; V309-Y342 HydrophobicContact CG1-CE1 4.15Å; V309-Y342 HydrophobicContact CG1-CE2 3.8Å; V309-Y342 HydrophobicContact CG1-CG 4.49Å; V309-Y342 HydrophobicContact CG2-CE2 4.01Å; I311-Y342 HydrophobicContact CD1-CD1 4.43Å; Y342-F344 HydrophobicContact CD2-CB 4.27Å; Y342-F344 HydrophobicContact CE2-CB 3.98Å; Y342-F344 HydrophobicContact CE2-CD2 4.39Å; Y342-F344 HydrophobicContact CE2-CG 4.44Å; Y342-F452 HydrophobicContact CD1-CB 3.96Å; Y342-F452 HydrophobicContact CD2-CB 4.45Å; Y342-F452 HydrophobicContact CE1-CB 3.41Å; Y342-F452 VanDerWaalsContact CE1-CB 3.41Å; Y342-F452 HydrophobicContact CE1-CG 4.32Å; Y342-F452 HydrophobicContact CE2-CB 3.98Å; Y342-F452 HydrophobicContact CE2-CD2 4.07Å; Y342-F452 HydrophobicContact CE2-CG 4.15Å; Y342-F452 HydrophobicContact CG-CB 4.44Å; Y342-F452 VanDerWaalsContact CZ-CB 3.42Å; Y342-F452 AromaticContact CZ-CG 3.83Å; Y342-F452 PolarHBondContact N-O 3.41Å; Y342-F452 PolarHBondContact O-N 3.02Å; Y342-Y467 AromaticContact CE1-CE1 3.57Å; Y342-Y467 HydrophobicContact CE1-CE1 3.57Å; Y342-Y467 AromaticContact CE1-CZ 3.98Å; Y342-Y467 PolarHBondContact OH-OH 3.29Å; Y342-Y467 VanDerWaalsContact OH-OH 3.14Å; Y342-M469 WeakPolarHBondContact OH-CB 3.44Å; Y342-M469 WeakPolarHBondContact OH-CG 3.4Å; Y342-H471 AromaticContact CE2-NE2 3.76Å; Y342-H471 AromaticContact CZ-NE2 3.84Å; Y342-H471 PolarHBondContact OH-NE2 3.1Å; Y342-T488 VanDerWaalsContact CA-O 3.28Å; Y342-T488 WeakPolarHBondContact CA-O 3.3Å
343	D	92.8	Very high	75.6	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.021	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	135.6	176.9	-68.8	-17.5	0	0	0	110.4	S446 L451 F482 T487 T488	D343-S446 PolarHBondContact OD2-N 3.1Å; D343-S446 PolarHBondContact OD2-OG 2.92Å; D343-L451 VanDerWaalsContact OD1-CD1 3.22Å; D343-L451 WeakPolarHBondContact OD1-CD1 3.42Å; D343-F482 WeakPolarHBondContact O-CZ 3.37Å; D343-T487 PolarHBondContact N-OG1 3.45Å; D343-T487 PolarHBondContact O-OG1 2.69Å; D343-T488 PolarHBondContact N-O 3.33Å
344	F	92.9	Very high	73.2	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	151	171.9	-150.3	-98.1	0	0	0	111.8	F307 V309 Y342 T449 V450 F452 H471 L473 F482	F307-F344 HydrophobicContact CB-CZ 3.98Å; F307-F344 HydrophobicContact CD2-CZ 4Å; F307-F344 AromaticContact CG-CZ 3.96Å; F307-F344 HydrophobicContact CG-CZ 3.96Å; V309-F344 HydrophobicContact CG2-CD2 4.25Å; V309-F344 HydrophobicContact CG2-CE2 4.1Å; Y342-F344 HydrophobicContact CD2-CB 4.27Å; Y342-F344 HydrophobicContact CE2-CB 3.98Å; Y342-F344 HydrophobicContact CE2-CD2 4.39Å; Y342-F344 HydrophobicContact CE2-CG 4.44Å; F344-T449 CarbonylContact O-C 3.57Å; F344-T449 WeakPolarHBondContact O-CA 3.48Å; F344-T449 WeakPolarHBondContact O-CB 3.44Å; F344-V450 PolarHBondContact N-O 3.2Å; F344-V450 PolarHBondContact O-N 3.45Å; F344-F452 HydrophobicContact CB-CD2 3.9Å; F344-F452 HydrophobicContact CB-CE2 3.71Å; F344-H471 HydrophobicContact CD1-CB 3.88Å; F344-H471 AromaticContact CD1-CD2 3.91Å; F344-H471 AromaticContact CD1-CE1 3.74Å; F344-H471 AromaticContact CD1-CG 3.45Å; F344-H471 VanDerWaalsContact CD1-CG 3.45Å; F344-H471 AromaticContact CD1-ND1 3.36Å; F344-H471 WeakPolarHBondContact CD1-ND1 2.97Å; F344-H471 HydrophobicContact CE1-CB 3.34Å; F344-H471 AromaticContact CE1-CD2 3.89Å; F344-H471 AromaticContact CE1-CG 3.39Å; F344-H471 AromaticContact CE1-ND1 3.81Å; F344-H471 AromaticContact CG-CE1 3.95Å; F344-H471 HydrophobicContact CZ-CB 4.03Å; F344-L473 HydrophobicContact CE1-CD1 3.76Å; F344-L473 HydrophobicContact CZ-CD1 4.45Å; F344-F482 AromaticContact CD2-CE1 3.81Å; F344-F482 HydrophobicContact CD2-CE1 3.81Å; F344-F482 AromaticContact CD2-CZ 3.76Å; F344-F482 HydrophobicContact CD2-CZ 3.76Å; F344-F482 AromaticContact CE2-CE1 3.79Å; F344-F482 HydrophobicContact CE2-CE1 3.79Å; F344-F482 HydrophobicContact CE2-CZ 4.22Å; F344-F482 HydrophobicContact CG-CE1 4.48Å; F344-F482 HydrophobicContact CG-CZ 4.34Å; F344-F482 HydrophobicContact CZ-CE1 4.43Å
345	V	91.6	Very high	70.8	Confident	13 Å²	13	69.6 Å²	69.6	8%	0.079	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	150.8	178.3	-178.4	0	0	0	0	110	T449 L473 F482	V345-T449 HydrophobicContact CG2-CG2 4.27Å; V345-L473 HydrophobicContact CB-CD1 4.31Å; V345-L473 HydrophobicContact CG1-CD2 4.36Å; V345-F482 HydrophobicContact CG2-CB 3.35Å; V345-F482 HydrophobicContact CG2-CD1 3.87Å; V345-F482 HydrophobicContact CG2-CD2 3.67Å; V345-F482 HydrophobicContact CG2-CE2 4.4Å; V345-F482 HydrophobicContact CG2-CG 3.35Å
346	R	82.5	Confident	68.2	Low	103 Å²	103	72.9 Å²	72.9	39%	0.389	38%	0.381	S	S	.	.			trans	-128.7	142.7	173.3	177.2	-180	-93.5	-154.6	-11.5	109.4	V450	R346-V450 HydrophobicContact CB-CG2 3.84Å
347	D	74.4	Confident	65.3	Low	37 Å²	37	74.2 Å²	74.2	20%	0.198	40%	0.403	C	S	.	.			trans	-65.6	129.7	170.4	-73.6	-16.1	0	0	0	110.2	E349 L473 R474 D475	D347-E349 PolarHBondContact O-N 3.18Å; D347-E349 VanDerWaalsContact O-N 3.16Å; D347-L473 WeakPolarHBondContact OD1-CD2 3.28Å; D347-L473 WeakPolarHBondContact OD2-CA 3.14Å; D347-R474 PolarHBondContact OD1-N 2.55Å; D347-R474 VanDerWaalsContact OD1-N 3.14Å; D347-R474 PolarHBondContact OD2-N 3.31Å; D347-D475 PolarHBondContact OD1-N 2.95Å
348	E	57.8	Low	62.5	Low	198 Å²	198	83.2 Å²	83.2	93%	0.925	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-12.2	-176.5	-63.2	-167.1	152.8	0	0	113.6
349	E	45.3	Very low	59.9	Low	193 Å²	193	88.8 Å²	88.8	90%	0.902	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	4.9	-168.2	-70.4	-177.3	156	0	0	116	D347 E351	D347-E349 PolarHBondContact O-N 3.18Å; D347-E349 VanDerWaalsContact O-N 3.16Å; E349-E351 PolarHBondContact O-N 3.3Å
350	G	37.9	Very low	57	Low	55 Å²	55	89.9 Å²	89.9	57%	0.567	49%	0.485	S	S	*	.			trans	-84	104.2	174.7	0	0	0	0	0	111.9	A352	G350-A352 PolarHBondContact O-N 3.06Å
351	E	35.8	Very low	54.2	Low	191 Å²	191	96.6 Å²	96.6	89%	0.893	52%	0.516	S	S	*	.			trans	-48.8	126	154	-78	-167.3	160.1	0	0	107.2	E349 D353	E349-E351 PolarHBondContact O-N 3.3Å; E351-D353 PolarHBondContact O-N 2.85Å
352	A	36	Very low	51.6	Low	58 Å²	58	99.1 Å²	99.1	48%	0.479	53%	0.529	S	S	.	.			trans	-63.3	102.4	178.8	0	0	0	0	0	107.7	G350 E354	G350-A352 PolarHBondContact O-N 3.06Å; A352-E354 PolarHBondContact O-N 2.84Å
353	D	33.8	Very low	48.9	Very low	142 Å²	142	103.9 Å²	103.9	76%	0.759	56%	0.558	S	S	*	*			trans	-55.1	111.2	160.9	-106.9	-22.7	0	0	0	106.2	E351 D355	E351-D353 PolarHBondContact O-N 2.85Å; D353-D355 PolarHBondContact O-N 2.96Å
354	E	34.4	Very low	45.8	Very low	192 Å²	192	110.3 Å²	110.3	90%	0.897	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	7.4	-178.2	-74.3	-172.5	146.3	0	0	113.1	A352	A352-E354 PolarHBondContact O-N 2.84Å
355	D	33.3	Very low	42.7	Very low	161 Å²	161	116 Å²	116	86%	0.861	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	9.9	-174.3	-98.8	-17.5	0	0	0	115.4	D353 G357	D353-D355 PolarHBondContact O-N 2.96Å; D355-G357 PolarHBondContact O-N 2.77Å
356	T	31.5	Very low	39.5	Very low	119 Å²	119	120.3 Å²	120.3	73%	0.73	65%	0.654	S	S	*	*	S	Bend	trans	-89.9	85.6	167.1	-35.3	0	0	0	0	109.9
357	G	30	Very low	36.9	Very low	56 Å²	56	121.1 Å²	121.1	58%	0.577	67%	0.673	S	S	*	*			trans	-49.3	134	-166.6	0	0	0	0	0	118.3	D355 L359	D355-G357 PolarHBondContact O-N 2.77Å; G357-L359 VanDerWaalsContact C-N 3.27Å; G357-L359 PolarHBondContact O-N 2.94Å
358	E	33.1	Very low	34.7	Very low	203 Å²	203	124.8 Å²	124.8	95%	0.949	70%	0.701	S	S	*	*	S	Bend	trans	42.5	7.3	143.9	-71	-168.6	154.4	0	0	122
359	L	38.1	Very low	33.2	Very low	119 Å²	119	121.3 Å²	121.3	62%	0.623	70%	0.699	S	S	*	*	S	Bend	trans	-120	-1.9	-175.7	-65.9	178.2	0	0	0	116.4	G357 T455	G357-L359 VanDerWaalsContact C-N 3.27Å; G357-L359 PolarHBondContact O-N 2.94Å; L359-T455 HydrophobicContact CD2-CG2 3.84Å
360	A	32.5	Very low	32.3	Very low	38 Å²	38	120.6 Å²	120.6	31%	0.314	70%	0.695	S	S	.	*			trans	-136.1	103.8	171.6	0	0	0	0	0	110.3	I362	A360-I362 PolarHBondContact O-N 2.91Å; A360-I362 VanDerWaalsContact O-N 3.08Å
361	E	36.2	Very low	31.8	Very low	141 Å²	141	126.4 Å²	126.4	66%	0.659	71%	0.713	S	S	*	*			trans	-76.5	95.9	168.5	-167.4	175	-178.3	0	0	107.3	V363 N453	E361-V363 PolarHBondContact O-N 2.9Å; E361-N453 PolarHBondContact O-ND2 3.29Å; E361-N453 VanDerWaalsContact O-ND2 3.09Å
362	I	40.5	Very low	31.3	Very low	55 Å²	55	125 Å²	125	28%	0.282	71%	0.71	S	S	.	*			trans	-53.6	125.8	163.2	-59.8	158	0	0	0	105.4	A360 K364	A360-I362 PolarHBondContact O-N 2.91Å; A360-I362 VanDerWaalsContact O-N 3.08Å; I362-K364 HydrophobicContact CG2-CG 4.27Å; I362-K364 PolarHBondContact O-N 2.91Å
363	V	36.6	Very low	30.8	Very low	103 Å²	103	129.1 Å²	129.1	62%	0.624	73%	0.729	S	S	*	*			trans	-64	88.4	176.1	-177.8	0	0	0	0	108.7	E361	E361-V363 PolarHBondContact O-N 2.9Å
364	K	28.6	Very low	30.4	Very low	139 Å²	139	130.3 Å²	130.3	60%	0.604	73%	0.73	S	S	*	*			trans	-109.8	123.9	164.7	-80.2	-174.3	178	179	0	107	I362 S366	I362-K364 HydrophobicContact CG2-CG 4.27Å; I362-K364 PolarHBondContact O-N 2.91Å; K364-S366 PolarHBondContact O-N 3.33Å
365	P	26.5	Very low	30	Very low	120 Å²	120	130.6 Å²	130.6	78%	0.779	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-66.6	120.2	179.6	27	-32	0	0	0	109.6
366	S	25	Very low	29.6	Very low	103 Å²	103	127.4 Å²	127.4	72%	0.72	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-69.9	128.5	170.8	-41.4	0	0	0	0	109.8	K364 S368	K364-S366 PolarHBondContact O-N 3.33Å; S366-S368 PolarHBondContact O-N 3.4Å
367	P	28.3	Very low	29.5	Very low	121 Å²	121	127.7 Å²	127.7	79%	0.786	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-76.3	119.5	164.7	29.5	-28.2	0	0	0	108.6
368	S	26.6	Very low	29.3	Very low	114 Å²	114	133.7 Å²	133.7	80%	0.797	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-65.5	133.7	173.7	36.6	0	0	0	0	111.3	S366 E370	S366-S368 PolarHBondContact O-N 3.4Å; S368-E370 PolarHBondContact O-N 3.05Å
369	S	26.8	Very low	29.1	Very low	125 Å²	125	133.1 Å²	133.1	87%	0.874	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-60.4	118.2	172.9	-47	0	0	0	0	111.4
370	E	27.3	Very low	28.5	Very low	177 Å²	177	134.6 Å²	134.6	83%	0.827	75%	0.75	S	S	*	*			trans	-108.9	124.8	154.8	-77.9	-169.1	162.4	0	0	108.7	S368 L372	S368-E370 PolarHBondContact O-N 3.05Å; E370-L372 PolarHBondContact O-N 2.91Å
371	L	26.2	Very low	28.2	Very low	178 Å²	178	135.9 Å²	135.9	93%	0.932	77%	0.766	S	S	*	*			trans	-60.1	109.7	170.4	-78.7	155.5	0	0	0	109.5
372	L	25.2	Very low	27.9	Very low	160 Å²	160	137.6 Å²	137.6	84%	0.838	77%	0.774	S	S	*	*			trans	-113.8	120.9	157.5	-71.6	176.6	0	0	0	108.5	E370	E370-L372 PolarHBondContact O-N 2.91Å
373	V	25.7	Very low	27.2	Very low	146 Å²	146	141.6 Å²	141.6	89%	0.885	80%	0.796	S	S	*	*			trans	-59.8	134.5	173.9	173.3	0	0	0	0	109
374	E	26.8	Very low	26.8	Very low	166 Å²	166	141.8 Å²	141.8	78%	0.776	80%	0.798	S	S	*	*			trans	-52.5	146.5	173.8	-61.6	-162.8	151.7	0	0	113.6
375	E	24.3	Very low	26.8	Very low	199 Å²	199	141.8 Å²	141.8	93%	0.93	80%	0.803	S	S	*	*				-140.5	123.2	126	-78.7	-165.6	156.6	0	0	109
376	S	26.7	Very low	26.9	Very low	93 Å²	93	144.6 Å²	144.6	65%	0.65	80%	0.803	S	S	*	*			trans	-79.4	169.8	173.8	53	0	0	0	0	111.6
377	P	28.8	Very low	27	Very low	125 Å²	125	145.7 Å²	145.7	81%	0.812	80%	0.8	S	S	*	*				-139.3	125.9	114.9	28	-10.7	0	0	0	114.5
378	E	25.6	Very low	27	Very low	183 Å²	183	148.1 Å²	148.1	86%	0.855	81%	0.805	S	S	*	*			trans	29.6	117.2	137.7	-61.2	-176.2	166.6	0	0	120.3
379	E	28.2	Very low	27	Very low	190 Å²	190	149.2 Å²	149.2	89%	0.888	81%	0.807	S	S	*	*			trans	-66.5	146.9	158.3	-63.2	-178.9	148.6	0	0	112.3
380	V	26.1	Very low	27	Very low	151 Å²	151	146.5 Å²	146.5	92%	0.915	80%	0.798	S	S	*	*			trans	-132.1	119.3	145.2	178.2	0	0	0	0	107.2
381	G	26.4	Very low	26.9	Very low	64 Å²	64	141.4 Å²	141.4	66%	0.66	79%	0.794	S	S	*	*			trans	-94.5	-174	-177.3	0	0	0	0	0	115.5
382	E	29.2	Very low	26.9	Very low	177 Å²	177	138.9 Å²	138.9	83%	0.827	79%	0.786	S	S	*	*			trans	81.7	108.4	159.4	-66.7	-175.6	169.4	0	0	119.2
383	D	26.1	Very low	27	Very low	139 Å²	139	136.8 Å²	136.8	74%	0.743	78%	0.78	S	S	*	*				119.5	130.9	107.4	-91.6	-4	0	0	0	120.6
384	V	29.4	Very low	27.2	Very low	108 Å²	108	137.1 Å²	137.1	66%	0.655	77%	0.771	S	S	*	*			trans	98	108.5	133	163.3	0	0	0	0	121.4
385	I	28.4	Very low	27.2	Very low	139 Å²	139	137 Å²	137	71%	0.713	77%	0.771	S	S	*	*			trans	64.7	115.9	130.2	-54.6	176.3	0	0	0	120.1
386	K	27.9	Very low	27.4	Very low	178 Å²	178	134.4 Å²	134.4	77%	0.774	77%	0.768	S	S	*	*				159.6	139.4	93	-137.5	161.1	-172.8	177.9	0	114.3
387	D	26.5	Very low	27.4	Very low	126 Å²	126	139.1 Å²	139.1	67%	0.674	78%	0.78	S	S	*	*			trans	-6.8	142.2	150.1	-49.7	-45.2	0	0	0	118.8
388	I	28.8	Very low	27.3	Very low	173 Å²	173	136.3 Å²	136.3	89%	0.887	77%	0.773	S	S	*	*				-155.7	126.4	114	-90.9	146.1	0	0	0	109.8
389	V	26.8	Very low	27.4	Very low	136 Å²	136	132.8 Å²	132.8	82%	0.824	77%	0.769	S	S	*	*			trans	-70.5	147.8	171.7	167.5	0	0	0	0	111.1
390	G	26.4	Very low	27.3	Very low	68 Å²	68	130.3 Å²	130.3	70%	0.701	76%	0.761	S	S	*	*			trans	119.7	97.5	136.3	0	0	0	0	0	116.9
391	G	25.6	Very low	27.4	Very low	71 Å²	71	131 Å²	131	73%	0.732	75%	0.754	S	S	*	*				96.9	121.1	101.4	0	0	0	0	0	119.5
392	V	27	Very low	27.6	Very low	125 Å²	125	132.8 Å²	132.8	76%	0.758	76%	0.757	S	S	*	*				88.5	125.7	123.5	-176	0	0	0	0	118.8
393	T	26.2	Very low	27.4	Very low	116 Å²	116	133.2 Å²	133.2	71%	0.712	76%	0.759	S	S	*	*			trans	65.3	150.6	152.4	58.3	0	0	0	0	118.1
394	E	29.2	Very low	27.5	Very low	153 Å²	153	131.9 Å²	131.9	72%	0.715	76%	0.756	S	S	*	*			cis	-167.5	154.7	-7.3	-112.5	176.7	-174	0	0	105
395	E	26.8	Very low	27.3	Very low	163 Å²	163	135 Å²	135	76%	0.762	76%	0.763	S	S	*	*			trans	42.8	131.8	141.9	-55.3	-171.6	178.3	0	0	121.4
396	V	29	Very low	27.1	Very low	145 Å²	145	135.8 Å²	135.8	88%	0.879	76%	0.764	S	S	*	*				-166.4	130.4	116.1	150.6	0	0	0	0	109.4
397	E	27.6	Very low	27.1	Very low	192 Å²	192	132.5 Å²	132.5	90%	0.897	76%	0.763	S	S	*	*			trans	-60.2	163.8	174.2	-59	175.6	130.2	0	0	113.9
398	G	25.7	Very low	27	Very low	65 Å²	65	130.1 Å²	130.1	67%	0.67	77%	0.768	S	S	*	*				133.9	102.9	127	0	0	0	0	0	118
399	S	27.4	Very low	26.8	Very low	109 Å²	109	130.5 Å²	130.5	76%	0.762	77%	0.766	S	S	*	*				87.4	114.6	123.9	-66.3	0	0	0	0	122.2
400	L	27.8	Very low	26.8	Very low	138 Å²	138	128.9 Å²	128.9	72%	0.723	76%	0.761	S	S	*	*				76.5	114.1	117.8	-62.9	167.4	0	0	0	120.9
401	E	27	Very low	26.7	Very low	166 Å²	166	133.4 Å²	133.4	78%	0.776	76%	0.764	S	S	*	*				83.8	144.8	118.3	-74.5	-176.3	177.5	0	0	123.8
402	S	30.2	Very low	26.7	Very low	102 Å²	102	136.8 Å²	136.8	71%	0.713	76%	0.764	S	S	*	*			trans	81.5	108.3	155.7	67.4	0	0	0	0	116.8
403	E	25.1	Very low	26.6	Very low	186 Å²	186	135.3 Å²	135.3	87%	0.869	76%	0.76	S	S	*	*				88.8	145.6	66.2	-82.4	-165	146.8	0	0	113.3
404	V	28.2	Very low	26.7	Very low	111 Å²	111	135.2 Å²	135.2	67%	0.673	76%	0.759	S	S	*	*			trans	96.1	103.4	155.5	-165.5	0	0	0	0	117.7
405	E	25.6	Very low	26.5	Very low	173 Å²	173	135.2 Å²	135.2	81%	0.808	76%	0.762	S	S	*	*				48	151.9	122.9	-64.5	178.6	173.5	0	0	119.7
406	E	25.5	Very low	26.5	Very low	156 Å²	156	132.5 Å²	132.5	73%	0.729	76%	0.761	S	S	*	*			cis	178.1	150.3	-1.9	173.8	-166	-170.4	0	0	104.4
407	S	26.1	Very low	26.2	Very low	109 Å²	109	129 Å²	129	76%	0.762	75%	0.754	S	S	*	*			trans	64.1	148.1	152.6	63.7	0	0	0	0	122
408	G	24.9	Very low	26.6	Very low	76 Å²	76	125.6 Å²	125.6	78%	0.784	75%	0.749	S	S	*	*			trans	139.6	94.5	141.9	0	0	0	0	0	115.2
409	E	25.6	Very low	26.5	Very low	180 Å²	180	127.7 Å²	127.7	84%	0.841	75%	0.753	S	S	*	*			trans	-72.9	164.4	177.6	-49.4	176.8	131.1	0	0	114.1
410	S	25.8	Very low	26.4	Very low	103 Å²	103	129 Å²	129	72%	0.72	76%	0.757	S	S	*	*			trans	73.4	148	145.4	-57.1	0	0	0	0	117.7
411	E	25.6	Very low	26.5	Very low	163 Å²	163	128.1 Å²	128.1	76%	0.762	76%	0.757	S	S	*	*			cis	-174.2	166.3	-4.1	-113	-166.3	162.7	0	0	106.9
412	L	24.6	Very low	26.5	Very low	141 Å²	141	128.5 Å²	128.5	74%	0.738	76%	0.763	S	S	*	*			trans	77.7	102	155	-68.9	158.7	0	0	0	119.4
413	S	25.2	Very low	26.3	Very low	95 Å²	95	132.1 Å²	132.1	66%	0.664	77%	0.769	S	S	*	*				81.1	132.1	88.9	73.2	0	0	0	0	114.3
414	V	27.9	Very low	26.4	Very low	114 Å²	114	129.4 Å²	129.4	69%	0.691	77%	0.765	S	S	*	*				173.3	122.3	101.8	152.5	0	0	0	0	111.3
415	I	25.9	Very low	26.5	Very low	153 Å²	153	129.7 Å²	129.7	79%	0.785	77%	0.769	S	S	*	*			trans	70	139	138.7	-53	176.8	0	0	0	118.6
416	S	26.3	Very low	26.9	Very low	105 Å²	105	133.5 Å²	133.5	73%	0.734	78%	0.777	S	S	*	*			cis	-166.2	137.8	17.9	30.1	0	0	0	0	107.4
417	G	23.2	Very low	27.4	Very low	72 Å²	72	130 Å²	130	74%	0.742	77%	0.774	S	S	*	*				74.8	137.6	72	0	0	0	0	0	113
418	P	35.5	Very low	28.1	Very low	120 Å²	120	128.4 Å²	128.4	78%	0.779	76%	0.763	S	S	*	*			cis	-146.2	167.8	31.7	40.5	-19.8	0	0	0	119.5
419	S	23.8	Very low	28.7	Very low	109 Å²	109	128.8 Å²	128.8	76%	0.762	76%	0.759	S	S	*	*			trans	67.4	138.1	147.6	-65.5	0	0	0	0	119.9
420	T	25.4	Very low	29.2	Very low	137 Å²	137	128.2 Å²	128.2	84%	0.84	76%	0.756	S	S	*	*			cis	-165.2	151.4	22.2	-4.7	0	0	0	0	111.3
421	V	30.2	Very low	29.9	Very low	120 Å²	120	128.6 Å²	128.6	73%	0.727	75%	0.746	S	S	*	*			trans	-38.4	135.2	176.7	179	0	0	0	0	117.9	Q423	V421-Q423 HydrophobicContact CG1-CG 4.44Å
422	L	25.7	Very low	30.4	Very low	173 Å²	173	126.1 Å²	126.1	91%	0.906	74%	0.738	S	S	*	*			trans	-150.1	127.4	139.7	-106.2	157.9	0	0	0	109.9
423	Q	26.2	Very low	30.9	Very low	179 Å²	179	122 Å²	122	84%	0.836	72%	0.724	S	S	*	*			trans	-73.1	132.8	-170	-65.9	167.1	-21.7	0	0	111.8	V421	V421-Q423 HydrophobicContact CG1-CG 4.44Å
424	T	27.7	Very low	31.5	Very low	128 Å²	128	124.8 Å²	124.8	79%	0.785	72%	0.724	S	S	*	*			trans	-83.4	134.6	167.7	29.7	0	0	0	0	110.6	R426	T424-R426 PolarHBondContact O-N 2.97Å; T424-R426 VanDerWaalsContact O-N 3.09Å
425	P	29.1	Very low	31.7	Very low	117 Å²	117	126.1 Å²	126.1	76%	0.76	73%	0.727	S	S	*	*			trans	-76.9	98.4	167.2	29.8	-28.2	0	0	0	108.6	A427	P425-A427 PolarHBondContact O-N 2.96Å
426	R	34.4	Very low	32.4	Very low	254 Å²	254	128.2 Å²	128.2	96%	0.958	73%	0.725	S	S	*	*			trans	-73.8	71.3	165.6	-164.5	179	-171.9	163.1	1.7	108.6	T424	T424-R426 PolarHBondContact O-N 2.97Å; T424-R426 VanDerWaalsContact O-N 3.09Å
427	A	35.6	Very low	32.9	Very low	83 Å²	83	129.4 Å²	129.4	69%	0.686	72%	0.722	S	S	*	*			trans	-149.2	65.6	176	0	0	0	0	0	109.7	P425	P425-A427 PolarHBondContact O-N 2.96Å
428	S	42.4	Very low	33.8	Very low	74 Å²	74	138 Å²	138	52%	0.517	73%	0.732	S	S	.	*	S	Bend	trans	-152.6	-18.8	170.4	57.8	0	0	0	0	114.3	L432	S428-L432 VanDerWaalsContact O-CB 3.28Å; S428-L432 WeakPolarHBondContact O-CB 3.45Å; S428-L432 WeakPolarHBondContact O-CD1 3.32Å; S428-L432 WeakPolarHBondContact O-CG 3.18Å; S428-L432 PolarHBondContact O-N 2.88Å; S428-L432 VanDerWaalsContact O-N 3.14Å
429	A	36.4	Very low	34.5	Very low	84 Å²	84	136.9 Å²	136.9	69%	0.694	72%	0.719	S	S	*	*	H	α-helix	trans	-75.1	-34.1	176.8	0	0	0	0	0	113.5	A433	A429-A433 PolarHBondContact O-N 2.91Å
430	E	37.4	Very low	36	Very low	168 Å²	168	133 Å²	133	79%	0.785	69%	0.69	S	S	*	*	H	α-helix	trans	-80.1	-30.1	179	-112.3	174.4	172.6	0	0	113.1
431	E	38.5	Very low	37.5	Very low	111 Å²	111	131.7 Å²	131.7	52%	0.519	68%	0.683	S	S	.	*	H	α-helix	trans	-78.6	-32.8	174.7	-75.8	-66.2	122.4	0	0	111.9	A433 K434	E431-A433 VanDerWaalsContact C-N 3.28Å; E431-A433 PolarHBondContact O-N 2.86Å; E431-K434 PolarHBondContact O-N 2.79Å; E431-K434 IonicContact OE1-NZ 3.4Å; E431-K434 PolarHBondContact OE1-NZ 2.69Å
432	L	37.2	Very low	38.9	Very low	111 Å²	111	131.5 Å²	131.5	58%	0.581	67%	0.669	S	S	*	*	H	α-helix	trans	-71.1	-22.5	170.5	-71	171.6	0	0	0	112.9	S428 K434 L435	S428-L432 VanDerWaalsContact O-CB 3.28Å; S428-L432 WeakPolarHBondContact O-CB 3.45Å; S428-L432 WeakPolarHBondContact O-CD1 3.32Å; S428-L432 WeakPolarHBondContact O-CG 3.18Å; S428-L432 PolarHBondContact O-N 2.88Å; S428-L432 VanDerWaalsContact O-N 3.14Å; L432-K434 VanDerWaalsContact C-N 3.33Å; L432-L435 PolarHBondContact O-N 2.61Å
433	A	35.3	Very low	40.7	Very low	55 Å²	55	124 Å²	124	46%	0.455	63%	0.63	S	S	.	*	H	α-helix	trans	-73.8	-21.7	171.7	0	0	0	0	0	113.1	A429 E431 L435	A429-A433 PolarHBondContact O-N 2.91Å; E431-A433 VanDerWaalsContact C-N 3.28Å; E431-A433 PolarHBondContact O-N 2.86Å; A433-L435 VanDerWaalsContact C-N 3.3Å
434	K	36.9	Very low	42.7	Very low	154 Å²	154	119.1 Å²	119.1	67%	0.67	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-12.9	172.8	-71.6	176.1	-174.9	165.7	0	113.6	E431 L432	E431-K434 PolarHBondContact O-N 2.79Å; E431-K434 IonicContact OE1-NZ 3.4Å; E431-K434 PolarHBondContact OE1-NZ 2.69Å; L432-K434 VanDerWaalsContact C-N 3.33Å
435	L	33.6	Very low	44.8	Very low	142 Å²	142	115.9 Å²	115.9	74%	0.743	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	2.1	179.7	-69.1	172.6	0	0	0	113.7	L432 A433 L437	L432-L435 PolarHBondContact O-N 2.61Å; A433-L435 VanDerWaalsContact C-N 3.3Å; L435-L437 PolarHBondContact O-N 3.08Å
436	R	38.8	Very low	46.9	Very low	197 Å²	197	112.2 Å²	112.2	74%	0.743	57%	0.574	S	S	*	*	S	Bend	trans	-74.4	122	167.6	-75.6	179.1	173.4	150.2	-1.9	108.7	R438	R436-R438 PolarHBondContact O-N 2.87Å; R436-R438 VanDerWaalsContact O-N 3.15Å
437	L	38.7	Very low	48.8	Very low	129 Å²	129	106.6 Å²	106.6	68%	0.675	57%	0.57	S	S	*	*			trans	-41.8	122.4	167.2	-78.7	157.5	0	0	0	108.7	L435 I439	L435-L437 PolarHBondContact O-N 3.08Å; L437-I439 HydrophobicContact CB-CD1 4.47Å; L437-I439 HydrophobicContact CB-CG1 3.98Å; L437-I439 PolarHBondContact O-N 2.8Å
438	R	42	Very low	50.7	Low	252 Å²	252	106 Å²	106	95%	0.951	57%	0.571	S	S	*	*			trans	-73.9	70.6	169.2	-70.2	-174.7	179.2	168.8	-0.1	107.9	R436 D440	R436-R438 PolarHBondContact O-N 2.87Å; R436-R438 VanDerWaalsContact O-N 3.15Å; R438-D440 PolarHBondContact O-N 3.07Å
439	I	50.1	Low	52.8	Low	97 Å²	97	103.3 Å²	103.3	50%	0.497	55%	0.552	S	S	.	*			trans	-62.8	123.4	166.7	-58.9	170.9	0	0	0	105.2	L437 P441 L443	L437-I439 HydrophobicContact CB-CD1 4.47Å; L437-I439 HydrophobicContact CB-CG1 3.98Å; L437-I439 PolarHBondContact O-N 2.8Å; I439-P441 WeakPolarHBondContact O-CD 3.49Å; I439-L443 HydrophobicContact CG2-CB 4.24Å
440	D	54.6	Low	55.2	Low	28 Å²	28	101.2 Å²	101.2	15%	0.15	53%	0.531	C	S	.	.			trans	-55.9	124.3	173.5	-170.8	-33.2	0	0	0	107.8	R438 R442 L443	R438-D440 PolarHBondContact O-N 3.07Å; D440-R442 PolarHBondContact O-N 3.05Å; D440-R442 VanDerWaalsContact OD1-CB 3.25Å; D440-R442 WeakPolarHBondContact OD1-CB 3.49Å; D440-R442 VanDerWaalsContact OD1-CG 3.24Å; D440-R442 WeakPolarHBondContact OD1-CG 3.43Å; D440-R442 IonicContact OD1-CZ 3.85Å; D440-R442 PolarHBondContact OD1-N 3.14Å; D440-R442 IonicContact OD1-NE 3.26Å; D440-R442 PolarHBondContact OD1-NE 2.86Å; D440-R442 IonicContact OD2-CZ 3.57Å; D440-R442 IonicContact OD2-NE 2.7Å; D440-R442 PolarHBondContact OD2-NE 2.81Å; D440-R442 IonicContact OD2-NH2 2.74Å; D440-R442 PolarHBondContact OD2-NH2 2.8Å; D440-L443 HydrophobicContact CB-CD1 4.1Å; D440-L443 HydrophobicContact CB-CG 4.19Å; D440-L443 WeakPolarHBondContact O-CB 3.3Å; D440-L443 PolarHBondContact O-N 3.01Å
441	P	56.4	Low	57.7	Low	109 Å²	109	94.5 Å²	94.5	71%	0.708	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-54.9	-18.2	178.9	-24.9	33.1	0	0	0	113.6	I439 L443 C444	I439-P441 WeakPolarHBondContact O-CD 3.49Å; P441-L443 VanDerWaalsContact C-N 3.26Å; P441-L443 PolarHBondContact O-N 2.9Å; P441-C444 PolarHBondContact O-N 2.97Å
442	R	60.6	Low	60.2	Low	116 Å²	116	89.9 Å²	89.9	44%	0.438	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-75.8	-9.1	174.8	-58.9	178.2	-68.5	169.1	-1.4	114	D440 V562	D440-R442 PolarHBondContact O-N 3.05Å; D440-R442 VanDerWaalsContact OD1-CB 3.25Å; D440-R442 WeakPolarHBondContact OD1-CB 3.49Å; D440-R442 VanDerWaalsContact OD1-CG 3.24Å; D440-R442 WeakPolarHBondContact OD1-CG 3.43Å; D440-R442 IonicContact OD1-CZ 3.85Å; D440-R442 PolarHBondContact OD1-N 3.14Å; D440-R442 IonicContact OD1-NE 3.26Å; D440-R442 PolarHBondContact OD1-NE 2.86Å; D440-R442 IonicContact OD2-CZ 3.57Å; D440-R442 IonicContact OD2-NE 2.7Å; D440-R442 PolarHBondContact OD2-NE 2.81Å; D440-R442 IonicContact OD2-NH2 2.74Å; D440-R442 PolarHBondContact OD2-NH2 2.8Å; R442-V562 HydrophobicContact CB-CG2 4.24Å
443	L	64	Low	62.8	Low	15 Å²	15	85.5 Å²	85.5	8%	0.079	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-103.2	13.5	174.4	-61.9	174.1	0	0	0	112.1	I439 D440 P441 T490 V492 L560 V562	I439-L443 HydrophobicContact CG2-CB 4.24Å; D440-L443 HydrophobicContact CB-CD1 4.1Å; D440-L443 HydrophobicContact CB-CG 4.19Å; D440-L443 WeakPolarHBondContact O-CB 3.3Å; D440-L443 PolarHBondContact O-N 3.01Å; P441-L443 VanDerWaalsContact C-N 3.26Å; P441-L443 PolarHBondContact O-N 2.9Å; L443-T490 HydrophobicContact CD2-CG2 4.24Å; L443-V492 HydrophobicContact CD2-CG2 3.65Å; L443-L560 HydrophobicContact CD1-CB 4.32Å; L443-L560 HydrophobicContact CD1-CD1 3.86Å; L443-V562 HydrophobicContact CD2-CG2 3.97Å; L443-V562 HydrophobicContact CG-CG2 4.11Å
444	C	67.5	Low	65.6	Low	77 Å²	77	82.9 Å²	82.9	52%	0.52	43%	0.434	S	S	.	.	S	Bend	trans	-79.3	128.7	168.1	-63.5	0	0	0	0	109	P441	P441-C444 PolarHBondContact O-N 2.97Å
445	P	71.6	Confident	68.2	Low	61 Å²	61	78 Å²	78	40%	0.396	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-64	153.8	177.3	27.6	-33.8	0	0	0	110.6	T449 L451	P445-T449 WeakPolarHBondContact CB-O 3.5Å; P445-L451 HydrophobicContact CB-CB 4.37Å
446	S	73.7	Confident	71	Confident	40 Å²	40	74.9 Å²	74.9	28%	0.28	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-60	147.9	171.5	-58	0	0	0	0	110.5	D343 G448 T449	D343-S446 PolarHBondContact OD2-N 3.1Å; D343-S446 PolarHBondContact OD2-OG 2.92Å; S446-G448 PolarHBondContact O-N 2.89Å; S446-T449 WeakPolarHBondContact CA-OG1 3.35Å; S446-T449 WeakPolarHBondContact CB-OG1 3.1Å; S446-T449 PolarHBondContact N-OG1 3.43Å; S446-T449 VanDerWaalsContact N-OG1 3.13Å; S446-T449 PolarHBondContact O-N 3.48Å; S446-T449 PolarHBondContact O-OG1 2.92Å
447	P	74	Confident	73.5	Confident	136 Å²	136	68.2 Å²	68.2	88%	0.883	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	129.7	-179.9	-24.9	33.5	0	0	0	111.8	T449	P447-T449 VanDerWaalsContact C-N 3.34Å
448	G	75.4	Confident	76	Confident	69 Å²	69	66.8 Å²	66.8	71%	0.711	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	8.7	-177.2	0	0	0	0	0	115.4	S446	S446-G448 PolarHBondContact O-N 2.89Å
449	T	85.6	Confident	78.3	Confident	19 Å²	19	56.9 Å²	56.9	12%	0.117	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	162.1	177.2	68.8	0	0	0	0	112.2	F344 V345 P445 S446 P447 F482	F344-T449 CarbonylContact O-C 3.57Å; F344-T449 WeakPolarHBondContact O-CA 3.48Å; F344-T449 WeakPolarHBondContact O-CB 3.44Å; V345-T449 HydrophobicContact CG2-CG2 4.27Å; P445-T449 WeakPolarHBondContact CB-O 3.5Å; S446-T449 WeakPolarHBondContact CA-OG1 3.35Å; S446-T449 WeakPolarHBondContact CB-OG1 3.1Å; S446-T449 PolarHBondContact N-OG1 3.43Å; S446-T449 VanDerWaalsContact N-OG1 3.13Å; S446-T449 PolarHBondContact O-N 3.48Å; S446-T449 PolarHBondContact O-OG1 2.92Å; P447-T449 VanDerWaalsContact C-N 3.34Å; T449-F482 HydrophobicContact CG2-CD2 3.76Å; T449-F482 HydrophobicContact CG2-CE2 3.92Å
450	V	88.1	Confident	80.1	Confident	40 Å²	40	54 Å²	54	24%	0.242	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	144	173.8	-177	0	0	0	0	109	F344 R346 F452	F344-V450 PolarHBondContact N-O 3.2Å; F344-V450 PolarHBondContact O-N 3.45Å; R346-V450 HydrophobicContact CB-CG2 3.84Å; V450-F452 HydrophobicContact CB-CE2 4.15Å; V450-F452 HydrophobicContact CG1-CE2 4.41Å; V450-F452 WeakPolarHBondContact O-CD2 3.36Å
451	L	89.1	Confident	81.5	Confident	27 Å²	27	58.9 Å²	58.9	14%	0.141	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	124.5	177.5	-165.9	73.1	0	0	0	110.5	T341 D343 P445	T341-L451 HydrophobicContact CG2-CD2 4.22Å; T341-L451 HydrophobicContact CG2-CG 4.42Å; D343-L451 VanDerWaalsContact OD1-CD1 3.22Å; D343-L451 WeakPolarHBondContact OD1-CD1 3.42Å; P445-L451 HydrophobicContact CB-CB 4.37Å
452	F	91.6	Very high	83.2	Confident	13 Å²	13	56 Å²	56	6%	0.057	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	147.4	171.5	-67.7	-96	0	0	0	109.6	T341 Y342 F344 V450 M469 H471	T341-F452 CarbonylContact C-O 3.54Å; T341-F452 WeakPolarHBondContact CA-O 3.17Å; T341-F452 WeakPolarHBondContact CB-O 3.5Å; Y342-F452 HydrophobicContact CD1-CB 3.96Å; Y342-F452 HydrophobicContact CD2-CB 4.45Å; Y342-F452 HydrophobicContact CE1-CB 3.41Å; Y342-F452 VanDerWaalsContact CE1-CB 3.41Å; Y342-F452 HydrophobicContact CE1-CG 4.32Å; Y342-F452 HydrophobicContact CE2-CB 3.98Å; Y342-F452 HydrophobicContact CE2-CD2 4.07Å; Y342-F452 HydrophobicContact CE2-CG 4.15Å; Y342-F452 HydrophobicContact CG-CB 4.44Å; Y342-F452 VanDerWaalsContact CZ-CB 3.42Å; Y342-F452 AromaticContact CZ-CG 3.83Å; Y342-F452 PolarHBondContact N-O 3.41Å; Y342-F452 PolarHBondContact O-N 3.02Å; F344-F452 HydrophobicContact CB-CD2 3.9Å; F344-F452 HydrophobicContact CB-CE2 3.71Å; V450-F452 HydrophobicContact CB-CE2 4.15Å; V450-F452 HydrophobicContact CG1-CE2 4.41Å; V450-F452 WeakPolarHBondContact O-CD2 3.36Å; F452-M469 HydrophobicContact CE1-CE 4.13Å; F452-H471 AromaticContact CE1-CE1 3.72Å; F452-H471 AromaticContact CE2-CE1 3.74Å; F452-H471 AromaticContact CZ-CE1 3.52Å; F452-H471 AromaticContact CZ-ND1 3.93Å
453	N	92.2	Very high	84.6	Confident	19 Å²	19	50.6 Å²	50.6	10%	0.102	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	151.4	176.5	59.4	35.6	0	0	0	111.3	Y339 V340 T341 E361	Y339-N453 HydrophobicContact CD2-CB 3.9Å; Y339-N453 HydrophobicContact CE2-CB 4.11Å; V340-N453 CarbonylContact O-C 3.37Å; V340-N453 WeakPolarHBondContact O-CA 3.27Å; T341-N453 HydrophobicContact CG2-CB 4.01Å; E361-N453 PolarHBondContact O-ND2 3.29Å; E361-N453 VanDerWaalsContact O-ND2 3.09Å
454	T	93.3	Very high	86	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-84.6	164.3	169.7	66.1	0	0	0	0	110.7	I311 V340 H456 C465 Y467	I311-T454 HydrophobicContact CB-CG2 4.04Å; I311-T454 HydrophobicContact CG1-CG2 4.07Å; I311-T454 HydrophobicContact CG2-CG2 4.15Å; V340-T454 HydrophobicContact CB-CG2 3.99Å; V340-T454 PolarHBondContact N-OG1 2.85Å; V340-T454 PolarHBondContact O-N 2.81Å; T454-H456 PolarHBondContact O-N 3.04Å; T454-C465 HydrophobicContact CG2-CB 4.45Å; T454-Y467 HydrophobicContact CG2-CD1 4.11Å; T454-Y467 HydrophobicContact CG2-CD2 3.98Å; T454-Y467 HydrophobicContact CG2-CG 3.71Å
455	T	91.4	Very high	87	Confident	53 Å²	53	49.8 Å²	49.8	33%	0.325	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-53.4	138.8	169.1	54.8	0	0	0	0	112.3	L359 K457	L359-T455 HydrophobicContact CD2-CG2 3.84Å; T455-K457 PolarHBondContact O-N 3.44Å; T455-K457 WeakPolarHBondContact OG1-CE 3.38Å
456	H	92.7	Very high	87.8	Confident	76 Å²	76	50.4 Å²	50.4	35%	0.352	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-77.3	120.7	-178.2	-70.6	-137	0	0	0	109.7	Y339 T454 E494	Y339-H456 AromaticContact CD1-CD2 4Å; Y339-H456 AromaticContact CD1-CE1 3.42Å; Y339-H456 VanDerWaalsContact CD1-CE1 3.42Å; Y339-H456 WeakPolarHBondContact CD1-CE1 3.33Å; Y339-H456 AromaticContact CD1-CG 3.94Å; Y339-H456 AromaticContact CD1-ND1 3.58Å; Y339-H456 AromaticContact CD1-NE2 3.68Å; Y339-H456 AromaticContact CD2-NE2 3.98Å; Y339-H456 AromaticContact CE1-CE1 3.37Å; Y339-H456 WeakPolarHBondContact CE1-CE1 3.44Å; Y339-H456 AromaticContact CE1-ND1 3.85Å; Y339-H456 AromaticContact CE1-NE2 3.88Å; Y339-H456 AromaticContact CG-CD2 3.92Å; Y339-H456 AromaticContact CG-CE1 3.97Å; Y339-H456 AromaticContact CG-NE2 3.73Å; Y339-H456 AromaticContact CZ-CE1 3.85Å; T454-H456 PolarHBondContact O-N 3.04Å; H456-E494 IonicContact CE1-OE1 2.65Å; H456-E494 IonicContact CE1-OE2 3.88Å; H456-E494 PolarHBondContact CE1-OE2 2.52Å; H456-E494 IonicContact CG-OE2 3.74Å; H456-E494 IonicContact ND1-OE1 2.71Å; H456-E494 IonicContact ND1-OE2 3.42Å; H456-E494 PolarHBondContact ND1-OE2 3.5Å
457	K	91.4	Very high	88.7	Confident	57 Å²	57	49.3 Å²	49.3	25%	0.248	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-119.1	145.3	-175.9	-62.9	-164.8	-173.6	-168.9	0	112.3	S337 Y338 T455 I463 P464 C465	S337-K457 CarbonylContact C-O 3.58Å; S337-K457 WeakPolarHBondContact CA-O 3.46Å; Y338-K457 PolarHBondContact N-O 2.9Å; Y338-K457 PolarHBondContact O-N 3.2Å; T455-K457 PolarHBondContact O-N 3.44Å; T455-K457 WeakPolarHBondContact OG1-CE 3.38Å; K457-I463 HydrophobicContact CB-CG2 3.74Å; K457-I463 HydrophobicContact CD-CG2 4.24Å; K457-I463 HydrophobicContact CG-CG2 4.49Å; K457-P464 VanDerWaalsContact CD-O 3.26Å; K457-P464 WeakPolarHBondContact CD-O 3.34Å; K457-P464 WeakPolarHBondContact CE-O 3.22Å; K457-P464 PolarHBondContact NZ-O 3.14Å; K457-C465 PolarHBondContact NZ-O 3.39Å
458	P	91.4	Very high	89.7	Confident	99 Å²	99	49.8 Å²	49.8	64%	0.643	30%	0.301	S	S	*	.			trans	-68.1	163.3	174.6	31	-36	0	0	0	111	A460	P458-A460 PolarHBondContact O-N 3Å
459	W	90.7	Very high	90.6	Very high	44 Å²	44	48.4 Å²	48.4	17%	0.167	28%	0.277	C	S	.	.			trans	-58.8	136.9	177.1	-176.2	83.2	0	0	0	112.9	V317 D319 Y338 E461 T598	V317-W459 PolarHBondContact O-NE1 2.69Å; D319-W459 HydrophobicContact CB-CD2 3.59Å; D319-W459 VanDerWaalsContact CB-CE2 3.46Å; D319-W459 HydrophobicContact CB-CE3 4.1Å; D319-W459 HydrophobicContact CB-CG 3.96Å; D319-W459 HydrophobicContact CB-CH2 4.34Å; D319-W459 HydrophobicContact CB-CZ2 3.86Å; D319-W459 HydrophobicContact CB-CZ3 4.44Å; Y338-W459 HydrophobicContact CD2-CB 4.24Å; Y338-W459 HydrophobicContact CE2-CB 3.62Å; Y338-W459 HydrophobicContact CE2-CG 4.29Å; W459-E461 HydrophobicContact CH2-CG 4.25Å; W459-T598 HydrophobicContact CH2-CG2 3.4Å; W459-T598 VanDerWaalsContact CH2-CG2 3.4Å; W459-T598 HydrophobicContact CZ2-CG2 4.02Å; W459-T598 HydrophobicContact CZ3-CG2 3.93Å
460	A	86.6	Confident	91	Very high	37 Å²	37	52.9 Å²	52.9	31%	0.306	30%	0.296	S	S	.	.			trans	-149.3	163	168.5	0	0	0	0	0	109.6	P458 V462 I463	P458-A460 PolarHBondContact O-N 3Å; A460-V462 WeakPolarHBondContact CB-O 3.16Å; A460-V462 PolarHBondContact O-N 3.37Å; A460-I463 HydrophobicContact CB-CG1 4.23Å
461	E	84.9	Confident	91.2	Very high	129 Å²	129	51.6 Å²	51.6	60%	0.603	29%	0.288	S	S	*	.	S	Bend	trans	-59.1	-37.1	175.5	-69.1	-173.8	161.4	0	0	112.2	W459	W459-E461 HydrophobicContact CH2-CG 4.25Å
462	V	90.8	Very high	91.4	Very high	50 Å²	50	52.7 Å²	52.7	30%	0.303	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	120.2	169.4	-175.8	0	0	0	0	106.6	N313 R315 A460 P464	N313-V462 HydrophobicContact CB-CG1 3.81Å; R315-V462 HydrophobicContact CG-CG1 4.28Å; R315-V462 HydrophobicContact CG-CG2 4.42Å; R315-V462 VanDerWaalsContact NH1-CG2 3.32Å; A460-V462 WeakPolarHBondContact CB-O 3.16Å; A460-V462 PolarHBondContact O-N 3.37Å; V462-P464 WeakPolarHBondContact O-CD 3.37Å
463	I	91.2	Very high	91.4	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	102.1	177.3	-54.4	179.4	0	0	0	107.1	I314 V317 Y338 K457 A460 C465	I314-I463 HydrophobicContact CB-CB 4.19Å; I314-I463 HydrophobicContact CD1-CG2 4.48Å; I314-I463 PolarHBondContact N-O 3.29Å; I314-I463 PolarHBondContact O-N 2.97Å; V317-I463 HydrophobicContact CB-CD1 4.37Å; V317-I463 HydrophobicContact CG1-CD1 4.45Å; V317-I463 HydrophobicContact CG2-CD1 4.05Å; Y338-I463 HydrophobicContact CD2-CD1 4Å; Y338-I463 HydrophobicContact CG-CD1 3.93Å; K457-I463 HydrophobicContact CB-CG2 3.74Å; K457-I463 HydrophobicContact CD-CG2 4.24Å; K457-I463 HydrophobicContact CG-CG2 4.49Å; A460-I463 HydrophobicContact CB-CG1 4.23Å; I463-C465 PolarHBondContact O-N 2.97Å
464	P	92.3	Very high	91.3	Very high	70 Å²	70	59.9 Å²	59.9	46%	0.455	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	112.3	177.5	29.4	-32.4	0	0	0	108.6	N313 K457 V462	N313-P464 WeakPolarHBondContact OD1-CA 3.4Å; K457-P464 VanDerWaalsContact CD-O 3.26Å; K457-P464 WeakPolarHBondContact CD-O 3.34Å; K457-P464 WeakPolarHBondContact CE-O 3.22Å; K457-P464 PolarHBondContact NZ-O 3.14Å; V462-P464 WeakPolarHBondContact O-CD 3.37Å
465	C	90	Very high	91.2	Very high	5 Å²	5	63.8 Å²	63.8	3%	0.034	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	-50.2	172.3	-64.6	0	0	0	0	109.7	I311 G312 T454 K457 I463 Y467	I311-C465 HydrophobicContact CB-CB 4.4Å; I311-C465 HydrophobicContact CG2-CB 4.07Å; I311-C465 WeakPolarHBondContact O-CB 3.4Å; G312-C465 VanDerWaalsContact O-CB 3.23Å; G312-C465 WeakPolarHBondContact O-CB 3.47Å; G312-C465 PolarHBondContact O-N 2.8Å; G312-C465 VanDerWaalsContact O-N 3.12Å; T454-C465 HydrophobicContact CG2-CB 4.45Å; K457-C465 PolarHBondContact NZ-O 3.39Å; I463-C465 PolarHBondContact O-N 2.97Å; C465-Y467 PolarHBondContact O-N 3.36Å
466	G	87.3	Confident	91.1	Very high	74 Å²	74	61.5 Å²	61.5	76%	0.763	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	57.5	35.9	-178	0	0	0	0	0	111.3	I311	I311-G466 PolarHBondContact O-N 3.25Å
467	Y	92.7	Very high	90.9	Very high	17 Å²	17	60.6 Å²	60.6	7%	0.067	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	135.2	-174.5	173	-87.9	0	0	0	109.1	T310 I311 Y342 T454 C465 M469	T310-Y467 CarbonylContact C-O 3.41Å; T310-Y467 VanDerWaalsContact CA-O 3.25Å; T310-Y467 WeakPolarHBondContact CA-O 3.44Å; I311-Y467 HydrophobicContact CB-CD1 4.21Å; I311-Y467 HydrophobicContact CG1-CD1 3.81Å; I311-Y467 HydrophobicContact CG1-CE1 4.44Å; I311-Y467 PolarHBondContact N-O 3.16Å; I311-Y467 PolarHBondContact O-N 2.98Å; Y342-Y467 AromaticContact CE1-CE1 3.57Å; Y342-Y467 HydrophobicContact CE1-CE1 3.57Å; Y342-Y467 AromaticContact CE1-CZ 3.98Å; Y342-Y467 PolarHBondContact OH-OH 3.29Å; Y342-Y467 VanDerWaalsContact OH-OH 3.14Å; T454-Y467 HydrophobicContact CG2-CD1 4.11Å; T454-Y467 HydrophobicContact CG2-CD2 3.98Å; T454-Y467 HydrophobicContact CG2-CG 3.71Å; C465-Y467 PolarHBondContact O-N 3.36Å; Y467-M469 HydrophobicContact CE1-CB 3.54Å; Y467-M469 WeakPolarHBondContact OH-CB 3.42Å
468	E	94.8	Very high	90.9	Very high	145 Å²	145	60.5 Å²	60.5	68%	0.678	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.9	130.2	176.4	-175.6	174.3	151.9	0	0	107.5	V308 V309 T310	V308-E468 HydrophobicContact CG1-CG 3.61Å; V309-E468 CarbonylContact O-C 3.57Å; V309-E468 WeakPolarHBondContact O-CA 3.06Å; T310-E468 HydrophobicContact CG2-CB 4.18Å; T310-E468 HydrophobicContact CG2-CG 3.91Å
469	M	93.6	Very high	91	Very high	41 Å²	41	55.8 Å²	55.8	20%	0.202	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	128.6	179.1	-175.7	67.5	-172.6	0	0	109.8	V308 V309 Y342 F452 Y467 H471	V308-M469 WeakPolarHBondContact CA-O 3.3Å; V309-M469 PolarHBondContact N-O 2.73Å; V309-M469 PolarHBondContact O-N 3.23Å; Y342-M469 WeakPolarHBondContact OH-CB 3.44Å; Y342-M469 WeakPolarHBondContact OH-CG 3.4Å; F452-M469 HydrophobicContact CE1-CE 4.13Å; Y467-M469 HydrophobicContact CE1-CB 3.54Å; Y467-M469 WeakPolarHBondContact OH-CB 3.42Å; M469-H471 WeakPolarHBondContact CG-NE2 3.23Å
470	Q	94	Very high	91.1	Very high	113 Å²	113	54.4 Å²	54.4	53%	0.528	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	135.8	174.5	-174.8	174.7	-21.6	0	0	109.9	F307	F307-Q470 CarbonylContact O-C 3.58Å; F307-Q470 WeakPolarHBondContact O-CA 3.48Å
471	H	93.2	Very high	91.4	Very high	13 Å²	13	55.4 Å²	55.4	6%	0.06	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.9	173.9	-60.4	-88	0	0	0	109.1	Q306 F307 Y342 F344 F452 M469	Q306-H471 CarbonylContact C-O 3.5Å; Q306-H471 WeakPolarHBondContact CA-O 3.39Å; F307-H471 HydrophobicContact CB-CB 4.46Å; F307-H471 PolarHBondContact N-O 3.16Å; F307-H471 PolarHBondContact O-N 3.34Å; Y342-H471 AromaticContact CE2-NE2 3.76Å; Y342-H471 AromaticContact CZ-NE2 3.84Å; Y342-H471 PolarHBondContact OH-NE2 3.1Å; F344-H471 HydrophobicContact CD1-CB 3.88Å; F344-H471 AromaticContact CD1-CD2 3.91Å; F344-H471 AromaticContact CD1-CE1 3.74Å; F344-H471 AromaticContact CD1-CG 3.45Å; F344-H471 VanDerWaalsContact CD1-CG 3.45Å; F344-H471 AromaticContact CD1-ND1 3.36Å; F344-H471 WeakPolarHBondContact CD1-ND1 2.97Å; F344-H471 HydrophobicContact CE1-CB 3.34Å; F344-H471 AromaticContact CE1-CD2 3.89Å; F344-H471 AromaticContact CE1-CG 3.39Å; F344-H471 AromaticContact CE1-ND1 3.81Å; F344-H471 AromaticContact CG-CE1 3.95Å; F344-H471 HydrophobicContact CZ-CB 4.03Å; F452-H471 AromaticContact CE1-CE1 3.72Å; F452-H471 AromaticContact CE2-CE1 3.74Å; F452-H471 AromaticContact CZ-CE1 3.52Å; F452-H471 AromaticContact CZ-ND1 3.93Å; M469-H471 WeakPolarHBondContact CG-NE2 3.23Å
472	S	92.4	Very high	91.8	Very high	49 Å²	49	50 Å²	50	34%	0.343	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.6	169.8	-68.7	0	0	0	0	108.3	A305	A305-S472 WeakPolarHBondContact O-CA 3.41Å
473	L	92.8	Very high	92	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	123.9	-175.8	-68.8	169.6	0	0	0	110.7	E304 A305 F344 V345 D347 L479	E304-L473 CarbonylContact C-O 3.57Å; E304-L473 WeakPolarHBondContact CA-O 3.46Å; E304-L473 WeakPolarHBondContact CB-O 3.45Å; A305-L473 PolarHBondContact N-O 3.07Å; A305-L473 PolarHBondContact O-N 3.29Å; F344-L473 HydrophobicContact CE1-CD1 3.76Å; F344-L473 HydrophobicContact CZ-CD1 4.45Å; V345-L473 HydrophobicContact CB-CD1 4.31Å; V345-L473 HydrophobicContact CG1-CD2 4.36Å; D347-L473 WeakPolarHBondContact OD1-CD2 3.28Å; D347-L473 WeakPolarHBondContact OD2-CA 3.14Å; L473-L479 HydrophobicContact CB-CD2 4.33Å; L473-L479 HydrophobicContact CD1-CB 4.42Å; L473-L479 HydrophobicContact CD1-CD1 3.64Å; L473-L479 HydrophobicContact CD1-CD2 4.09Å; L473-L479 HydrophobicContact CD1-CG 4.25Å
474	R	90.8	Very high	92.2	Very high	181 Å²	181	51.9 Å²	51.9	68%	0.683	29%	0.29	S	S	*	.	S	Bend	trans	-89.8	-33.2	175.4	-66.4	180	-179.4	-178.4	3.4	112.2	E304 D347 L476	E304-R474 HydrophobicContact CB-CG 4.1Å; D347-R474 PolarHBondContact OD1-N 2.55Å; D347-R474 VanDerWaalsContact OD1-N 3.14Å; D347-R474 PolarHBondContact OD2-N 3.31Å; R474-L476 PolarHBondContact O-N 2.82Å; R474-L476 VanDerWaalsContact O-N 3.16Å
475	D	89.4	Confident	92.2	Very high	82 Å²	82	51.8 Å²	51.8	44%	0.439	30%	0.295	S	S	.	.			trans	-82.9	96.7	177.2	-165.9	-3	0	0	0	111.1	D347 V477 P478	D347-D475 PolarHBondContact OD1-N 2.95Å; D475-V477 PolarHBondContact OD1-N 3.15Å; D475-P478 HydrophobicContact CB-CG 4.46Å; D475-P478 WeakPolarHBondContact OD1-CD 3.42Å; D475-P478 VanDerWaalsContact OD2-CD 3.3Å; D475-P478 WeakPolarHBondContact OD2-CD 3.4Å; D475-P478 VanDerWaalsContact OD2-CG 3.23Å; D475-P478 WeakPolarHBondContact OD2-CG 3.35Å
476	L	90.8	Very high	92.4	Very high	5 Å²	5	52 Å²	52	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-80.7	-17.6	-172.7	-50.8	180	0	0	0	113.2	P257 V261 Q303 A305 R474 L479 K480	P257-L476 HydrophobicContact CB-CB 3.52Å; V261-L476 HydrophobicContact CG1-CD1 3.99Å; Q303-L476 HydrophobicContact CG-CD1 4.32Å; A305-L476 HydrophobicContact CB-CD2 3.75Å; R474-L476 PolarHBondContact O-N 2.82Å; R474-L476 VanDerWaalsContact O-N 3.16Å; L476-L479 HydrophobicContact CD2-CD2 4.14Å; L476-K480 PolarHBondContact O-N 3.14Å; L476-K480 VanDerWaalsContact O-N 3.12Å
477	V	88.8	Confident	92.7	Very high	57 Å²	57	48.6 Å²	48.6	35%	0.345	26%	0.263	S	S	.	.	H	α-helix	trans	-73.8	-53.2	-177.2	179.3	0	0	0	0	111.5	T233 D475 L479 K480 A481	T233-V477 HydrophobicContact CG2-CG2 3.4Å; T233-V477 VanDerWaalsContact CG2-CG2 3.4Å; D475-V477 PolarHBondContact OD1-N 3.15Å; V477-L479 PolarHBondContact O-N 3.43Å; V477-K480 PolarHBondContact O-N 2.94Å; V477-A481 PolarHBondContact O-N 3.08Å
478	P	90.4	Very high	92.7	Very high	55 Å²	55	48.4 Å²	48.4	36%	0.357	26%	0.263	S	S	.	.	H	α-helix	trans	-61.2	-33	173	-21.1	33.8	0	0	0	112.2	D475 K480 A481 F482	D475-P478 HydrophobicContact CB-CG 4.46Å; D475-P478 WeakPolarHBondContact OD1-CD 3.42Å; D475-P478 VanDerWaalsContact OD2-CD 3.3Å; D475-P478 WeakPolarHBondContact OD2-CD 3.4Å; D475-P478 VanDerWaalsContact OD2-CG 3.23Å; D475-P478 WeakPolarHBondContact OD2-CG 3.35Å; P478-K480 PolarHBondContact O-N 3.4Å; P478-A481 PolarHBondContact O-N 3.24Å; P478-F482 WeakPolarHBondContact O-CB 3.42Å; P478-F482 PolarHBondContact O-N 3.01Å
479	L	92.9	Very high	92.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-59.5	-46.4	175.7	172.4	58.6	0	0	0	111.8	L260 A305 F307 L473 L476 V477 A481 F482 L483	L260-L479 HydrophobicContact CD1-CD2 3.69Å; L260-L479 HydrophobicContact CD1-CG 3.9Å; A305-L479 HydrophobicContact CB-CD2 3.49Å; A305-L479 VanDerWaalsContact CB-CD2 3.49Å; F307-L479 HydrophobicContact CE2-CD1 3.84Å; F307-L479 HydrophobicContact CE2-CD2 3.66Å; F307-L479 HydrophobicContact CE2-CG 4.34Å; F307-L479 HydrophobicContact CZ-CD1 3.95Å; F307-L479 HydrophobicContact CZ-CD2 3.99Å; F307-L479 HydrophobicContact CZ-CG 4.41Å; L473-L479 HydrophobicContact CB-CD2 4.33Å; L473-L479 HydrophobicContact CD1-CB 4.42Å; L473-L479 HydrophobicContact CD1-CD1 3.64Å; L473-L479 HydrophobicContact CD1-CD2 4.09Å; L473-L479 HydrophobicContact CD1-CG 4.25Å; L476-L479 HydrophobicContact CD2-CD2 4.14Å; V477-L479 PolarHBondContact O-N 3.43Å; L479-A481 VanDerWaalsContact C-N 3.33Å; L479-A481 PolarHBondContact O-N 3.46Å; L479-F482 HydrophobicContact CD1-CD1 4.35Å; L479-F482 WeakPolarHBondContact O-CB 3.33Å; L479-F482 PolarHBondContact O-N 3.26Å; L479-L483 HydrophobicContact CD1-CD1 4.08Å; L479-L483 HydrophobicContact CD1-CD2 4.45Å; L479-L483 HydrophobicContact CD1-CG 4Å; L479-L483 HydrophobicContact CG-CD1 4.19Å; L479-L483 WeakPolarHBondContact O-CG 3.2Å; L479-L483 PolarHBondContact O-N 3.46Å
480	K	93.5	Very high	92.7	Very high	14 Å²	14	39.7 Å²	39.7	6%	0.061	22%	0.222	C	C	.	.	H	α-helix	trans	-59.3	-45.9	175.3	176.3	178.6	170.3	-162.9	0	111.3	N230 D231 G255 P257 L476 V477 P478 F482 L483 L484 L574	N230-K480 PolarHBondContact O-NZ 3.13Å; D231-K480 WeakPolarHBondContact OD1-CD 3.45Å; D231-K480 WeakPolarHBondContact OD1-CE 3.37Å; D231-K480 IonicContact OD1-NZ 2.95Å; D231-K480 PolarHBondContact OD1-NZ 3.34Å; G255-K480 WeakPolarHBondContact O-CE 3.46Å; P257-K480 HydrophobicContact CG-CB 4.16Å; P257-K480 HydrophobicContact CG-CD 4.02Å; L476-K480 PolarHBondContact O-N 3.14Å; L476-K480 VanDerWaalsContact O-N 3.12Å; V477-K480 PolarHBondContact O-N 2.94Å; P478-K480 PolarHBondContact O-N 3.4Å; K480-F482 VanDerWaalsContact C-N 3.28Å; K480-F482 PolarHBondContact O-N 2.82Å; K480-L483 PolarHBondContact O-N 3Å; K480-L484 HydrophobicContact CG-CD1 4.28Å; K480-L484 WeakPolarHBondContact O-CG 3.41Å; K480-L484 PolarHBondContact O-N 3.24Å; K480-L574 HydrophobicContact CB-CD2 4.42Å; K480-L574 HydrophobicContact CG-CD1 4.09Å; K480-L574 HydrophobicContact CG-CD2 4.03Å
481	A	92.4	Very high	92.7	Very high	59 Å²	59	34.3 Å²	34.3	49%	0.488	20%	0.197	S	C	.	.	H	α-helix	trans	-59.6	-40.5	178.3	0	0	0	0	0	111.9	V477 P478 L479 L484 A485	V477-A481 PolarHBondContact O-N 3.08Å; P478-A481 PolarHBondContact O-N 3.24Å; L479-A481 VanDerWaalsContact C-N 3.33Å; L479-A481 PolarHBondContact O-N 3.46Å; A481-L484 PolarHBondContact O-N 2.99Å; A481-A485 WeakPolarHBondContact O-CB 3.32Å; A481-A485 PolarHBondContact O-N 3.35Å
482	F	94.4	Very high	92.6	Very high	14 Å²	14	33.7 Å²	33.7	6%	0.061	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-44.7	174.2	168.4	-101.8	0	0	0	112.8	D343 F344 V345 T449 P478 L479 K480 L484 A485 G486 L570	D343-F482 WeakPolarHBondContact O-CZ 3.37Å; F344-F482 AromaticContact CD2-CE1 3.81Å; F344-F482 HydrophobicContact CD2-CE1 3.81Å; F344-F482 AromaticContact CD2-CZ 3.76Å; F344-F482 HydrophobicContact CD2-CZ 3.76Å; F344-F482 AromaticContact CE2-CE1 3.79Å; F344-F482 HydrophobicContact CE2-CE1 3.79Å; F344-F482 HydrophobicContact CE2-CZ 4.22Å; F344-F482 HydrophobicContact CG-CE1 4.48Å; F344-F482 HydrophobicContact CG-CZ 4.34Å; F344-F482 HydrophobicContact CZ-CE1 4.43Å; V345-F482 HydrophobicContact CG2-CB 3.35Å; V345-F482 HydrophobicContact CG2-CD1 3.87Å; V345-F482 HydrophobicContact CG2-CD2 3.67Å; V345-F482 HydrophobicContact CG2-CE2 4.4Å; V345-F482 HydrophobicContact CG2-CG 3.35Å; T449-F482 HydrophobicContact CG2-CD2 3.76Å; T449-F482 HydrophobicContact CG2-CE2 3.92Å; P478-F482 WeakPolarHBondContact O-CB 3.42Å; P478-F482 PolarHBondContact O-N 3.01Å; L479-F482 HydrophobicContact CD1-CD1 4.35Å; L479-F482 WeakPolarHBondContact O-CB 3.33Å; L479-F482 PolarHBondContact O-N 3.26Å; K480-F482 VanDerWaalsContact C-N 3.28Å; K480-F482 PolarHBondContact O-N 2.82Å; F482-L484 VanDerWaalsContact C-N 3.29Å; F482-L484 PolarHBondContact O-N 3.11Å; F482-A485 PolarHBondContact O-N 3.1Å; F482-A485 VanDerWaalsContact O-N 3.11Å; F482-G486 PolarHBondContact O-N 3.12Å; F482-L570 HydrophobicContact CD1-CD1 4.42Å; F482-L570 HydrophobicContact CE1-CD1 3.7Å; F482-L570 HydrophobicContact CZ-CD1 4.05Å
483	L	95.3	Very high	92.6	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-63.6	-35.6	178.8	-68.2	174.1	0	0	0	112	L260 F307 L479 K480 L570 E571 L573 L574	L260-L483 HydrophobicContact CD1-CD1 3.75Å; L260-L483 HydrophobicContact CD2-CD1 3.93Å; F307-L483 HydrophobicContact CE1-CD2 4.3Å; F307-L483 HydrophobicContact CZ-CD1 4.19Å; L479-L483 HydrophobicContact CD1-CD1 4.08Å; L479-L483 HydrophobicContact CD1-CD2 4.45Å; L479-L483 HydrophobicContact CD1-CG 4Å; L479-L483 HydrophobicContact CG-CD1 4.19Å; L479-L483 WeakPolarHBondContact O-CG 3.2Å; L479-L483 PolarHBondContact O-N 3.46Å; K480-L483 PolarHBondContact O-N 3Å; L483-L570 HydrophobicContact CB-CB 4.42Å; L483-L570 HydrophobicContact CD2-CB 3.78Å; L483-L570 HydrophobicContact CD2-CD1 3.93Å; L483-L570 HydrophobicContact CD2-CG 4.49Å; L483-L570 CarbonylContact O-C 3.53Å; L483-L570 WeakPolarHBondContact O-CB 3.5Å; L483-E571 PolarHBondContact O-N 2.84Å; L483-E571 VanDerWaalsContact O-N 3.17Å; L483-L573 HydrophobicContact CD2-CD1 4.13Å; L483-L574 HydrophobicContact CB-CD1 3.61Å; L483-L574 HydrophobicContact CB-CD2 4.37Å; L483-L574 HydrophobicContact CB-CG 3.75Å; L483-L574 HydrophobicContact CD1-CD2 3.79Å; L483-L574 HydrophobicContact CD1-CG 3.84Å; L483-L574 HydrophobicContact CG-CG 4.46Å
484	L	94.1	Very high	92.5	Very high	91 Å²	91	32.5 Å²	32.5	48%	0.476	18%	0.183	S	C	.	.	H	α-helix	trans	-68.2	-36.5	172.3	-69.6	173	0	0	0	112.6	K480 A481 F482 E571 L574	K480-L484 HydrophobicContact CG-CD1 4.28Å; K480-L484 WeakPolarHBondContact O-CG 3.41Å; K480-L484 PolarHBondContact O-N 3.24Å; A481-L484 PolarHBondContact O-N 2.99Å; F482-L484 VanDerWaalsContact C-N 3.29Å; F482-L484 PolarHBondContact O-N 3.11Å; L484-E571 HydrophobicContact CD2-CG 4.38Å; L484-L574 HydrophobicContact CD2-CD1 3.65Å; L484-L574 HydrophobicContact CG-CD1 3.63Å
485	A	92.6	Very high	92.5	Very high	69 Å²	69	25.8 Å²	25.8	57%	0.57	16%	0.159	S	C	*	.	H	α-helix	trans	-74.6	-30.9	177.9	0	0	0	0	0	113.1	A481 F482	A481-A485 WeakPolarHBondContact O-CB 3.32Å; A481-A485 PolarHBondContact O-N 3.35Å; F482-A485 PolarHBondContact O-N 3.1Å; F482-A485 VanDerWaalsContact O-N 3.11Å
486	G	93.8	Very high	92.4	Very high	10 Å²	10	23.2 Å²	23.2	10%	0.103	15%	0.145	C	C	.	.			trans	83.5	175.7	-172.5	0	0	0	0	0	113.3	F482 V568	F482-G486 PolarHBondContact O-N 3.12Å; G486-V568 CarbonylContact C-O 3.41Å; G486-V568 VanDerWaalsContact CA-O 3.26Å; G486-V568 WeakPolarHBondContact CA-O 3.47Å
487	T	93.6	Very high	92.2	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	143.9	177.9	-178.7	0	0	0	0	111.7	D343 V568 L570 I637	D343-T487 PolarHBondContact N-OG1 3.45Å; D343-T487 PolarHBondContact O-OG1 2.69Å; T487-V568 HydrophobicContact CG2-CB 3.82Å; T487-V568 HydrophobicContact CG2-CG1 4.45Å; T487-V568 HydrophobicContact CG2-CG2 4.46Å; T487-V568 PolarHBondContact N-O 3.16Å; T487-V568 PolarHBondContact O-N 3.33Å; T487-L570 HydrophobicContact CG2-CD1 3.89Å; T487-L570 HydrophobicContact CG2-CD2 4.3Å; T487-L570 HydrophobicContact CG2-CG 4.28Å; T487-I637 HydrophobicContact CG2-CD1 3.75Å
488	T	92.9	Very high	92.1	Very high	13 Å²	13	22.6 Å²	22.6	8%	0.08	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	132	172.8	-64	0	0	0	0	109.6	Y342 D343 R565 G566	Y342-T488 VanDerWaalsContact CA-O 3.28Å; Y342-T488 WeakPolarHBondContact CA-O 3.3Å; D343-T488 PolarHBondContact N-O 3.33Å; T488-R565 HydrophobicContact CG2-CG 3.63Å; T488-G566 WeakPolarHBondContact CA-O 3.3Å
489	V	94.2	Very high	91.7	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.2	171.7	-180	0	0	0	0	109.6	V340 T341 R565 G566 V568 V633 V635	V340-V489 HydrophobicContact CG1-CG1 3.5Å; V340-V489 VanDerWaalsContact CG1-CG1 3.5Å; T341-V489 CarbonylContact O-C 3.6Å; T341-V489 WeakPolarHBondContact O-CA 3.23Å; V489-R565 WeakPolarHBondContact O-CA 3.28Å; V489-G566 PolarHBondContact N-O 2.91Å; V489-G566 PolarHBondContact O-N 2.85Å; V489-V568 HydrophobicContact CG2-CG2 3.71Å; V489-V633 HydrophobicContact CG1-CG1 3.99Å; V489-V635 HydrophobicContact CG1-CG2 4.03Å; V489-V635 HydrophobicContact CG2-CG1 4.38Å; V489-V635 HydrophobicContact CG2-CG2 4.13Å
490	T	93.6	Very high	91.2	Very high	4 Å²	4	26.2 Å²	26.2	3%	0.025	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	132	-175.9	-51.9	0	0	0	0	111.1	V340 T341 L443 V492 V562 G564 R565	V340-T490 CarbonylContact C-O 3.55Å; V340-T490 VanDerWaalsContact CA-O 3.32Å; V340-T490 WeakPolarHBondContact CA-O 3.25Å; T341-T490 PolarHBondContact N-O 3.27Å; T341-T490 PolarHBondContact O-N 3.49Å; T341-T490 WeakPolarHBondContact OG1-CB 3.41Å; L443-T490 HydrophobicContact CD2-CG2 4.24Å; T490-V492 HydrophobicContact CG2-CG2 4.14Å; T490-V562 HydrophobicContact CG2-CB 4.18Å; T490-V562 HydrophobicContact CG2-CG1 3.36Å; T490-V562 HydrophobicContact CG2-CG2 3.88Å; T490-G564 CarbonylContact C-O 3.25Å; T490-G564 VanDerWaalsContact CA-O 3.3Å; T490-G564 WeakPolarHBondContact CA-O 3.4Å; T490-G564 WeakPolarHBondContact CG2-O 3.17Å; T490-R565 HydrophobicContact CG2-CB 4.42Å
491	I	93.9	Very high	90.2	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	126.8	169.9	-58.3	171.7	0	0	0	108.3	I314 V340 L563 G564 F586 L631 V633	I314-I491 HydrophobicContact CG2-CD1 3.72Å; I314-I491 HydrophobicContact CG2-CG2 4.48Å; V340-I491 HydrophobicContact CG2-CG1 4.4Å; I491-L563 HydrophobicContact CB-CB 4.35Å; I491-L563 HydrophobicContact CG2-CB 4.2Å; I491-L563 HydrophobicContact CG2-CD1 4.03Å; I491-L563 HydrophobicContact CG2-CG 4.49Å; I491-L563 PolarHBondContact O-N 3.14Å; I491-G564 PolarHBondContact N-O 2.91Å; I491-F586 HydrophobicContact CD1-CD2 3.64Å; I491-F586 HydrophobicContact CD1-CE2 3.42Å; I491-F586 VanDerWaalsContact CD1-CE2 3.42Å; I491-F586 HydrophobicContact CG1-CD2 4.37Å; I491-F586 HydrophobicContact CG1-CE2 3.81Å; I491-L631 HydrophobicContact CD1-CD1 3.77Å; I491-L631 HydrophobicContact CD1-CD2 4.05Å; I491-L631 HydrophobicContact CD1-CG 3.77Å; I491-V633 HydrophobicContact CD1-CB 4.15Å; I491-V633 HydrophobicContact CD1-CG1 4.31Å; I491-V633 HydrophobicContact CG1-CB 4.42Å; I491-V633 HydrophobicContact CG1-CG1 4.37Å
492	V	91.9	Very high	88.7	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.1	-178.4	-170	0	0	0	0	110.1	Y338 Y339 T341 L443 T490 L560	Y338-V492 WeakPolarHBondContact CA-O 3.45Å; Y339-V492 HydrophobicContact CD1-CB 4.18Å; Y339-V492 HydrophobicContact CD2-CB 4.35Å; Y339-V492 HydrophobicContact CE1-CB 3.71Å; Y339-V492 HydrophobicContact CE1-CG1 3.7Å; Y339-V492 HydrophobicContact CE2-CB 3.93Å; Y339-V492 HydrophobicContact CE2-CG1 4.39Å; Y339-V492 HydrophobicContact CE2-CG2 4.08Å; Y339-V492 HydrophobicContact CG-CB 4.48Å; Y339-V492 PolarHBondContact N-O 3.09Å; Y339-V492 VanDerWaalsContact N-O 3.08Å; Y339-V492 PolarHBondContact O-N 3.13Å; Y339-V492 WeakPolarHBondContact OH-CG1 3.37Å; T341-V492 HydrophobicContact CG2-CG2 4.18Å; L443-V492 HydrophobicContact CD2-CG2 3.65Å; T490-V492 HydrophobicContact CG2-CG2 4.14Å; V492-L560 HydrophobicContact CG1-CB 4.24Å; V492-L560 HydrophobicContact CG1-CD2 4.37Å
493	E	92.3	Very high	86.5	Confident	3 Å²	3	38.6 Å²	38.6	1%	0.014	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	129	163.8	178.8	179.4	91	0	0	108.6	T320 Y336 Y338 L560 Q561 L563	T320-E493 VanDerWaalsContact CB-OE2 3.27Å; T320-E493 WeakPolarHBondContact CB-OE2 3.49Å; T320-E493 PolarHBondContact OG1-OE2 3.22Å; Y336-E493 HydrophobicContact CD1-CG 3.83Å; Y336-E493 HydrophobicContact CE1-CG 4.27Å; Y336-E493 WeakPolarHBondContact CE1-OE1 3.42Å; Y338-E493 HydrophobicContact CD1-CB 4Å; Y338-E493 HydrophobicContact CD1-CG 4.18Å; Y338-E493 HydrophobicContact CE1-CB 3.77Å; Y338-E493 HydrophobicContact CE1-CG 3.57Å; Y338-E493 WeakPolarHBondContact CE1-OE2 3.33Å; Y338-E493 VanDerWaalsContact CZ-OE2 3.28Å; Y338-E493 PolarHBondContact OH-OE2 3.46Å; E493-L560 CarbonylContact O-C 3.28Å; E493-L560 WeakPolarHBondContact O-CA 3.44Å; E493-Q561 HydrophobicContact CB-CB 4.4Å; E493-Q561 PolarHBondContact N-O 3.42Å; E493-Q561 PolarHBondContact O-N 2.75Å; E493-L563 HydrophobicContact CB-CD1 4.09Å; E493-L563 HydrophobicContact CB-CD2 4.05Å; E493-L563 HydrophobicContact CB-CG 4Å
494	E	91.1	Very high	83.9	Confident	24 Å²	24	43.9 Å²	43.9	11%	0.112	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	127.4	172.7	170.2	-179.2	-113	0	0	109.2	Y336 S337 Y339 H456 I496 P558 L560	Y336-E494 WeakPolarHBondContact CA-O 3.38Å; S337-E494 PolarHBondContact N-O 2.7Å; S337-E494 PolarHBondContact O-N 3.34Å; S337-E494 WeakPolarHBondContact OG-CB 3.41Å; S337-E494 WeakPolarHBondContact OG-CG 3.38Å; S337-E494 PolarHBondContact OG-O 2.84Å; S337-E494 PolarHBondContact OG-OE2 2.78Å; Y339-E494 HydrophobicContact CE1-CB 4.05Å; H456-E494 IonicContact CE1-OE1 2.65Å; H456-E494 IonicContact CE1-OE2 3.88Å; H456-E494 PolarHBondContact CE1-OE2 2.52Å; H456-E494 IonicContact CG-OE2 3.74Å; H456-E494 IonicContact ND1-OE1 2.71Å; H456-E494 IonicContact ND1-OE2 3.42Å; H456-E494 PolarHBondContact ND1-OE2 3.5Å; E494-I496 HydrophobicContact CG-CD1 4.25Å; E494-I496 HydrophobicContact CG-CG1 4.03Å; E494-P558 HydrophobicContact CG-CB 3.71Å; E494-P558 VanDerWaalsContact OE1-CB 3.29Å; E494-P558 WeakPolarHBondContact OE1-CB 3.09Å; E494-L560 HydrophobicContact CB-CD2 3.8Å; E494-L560 HydrophobicContact CG-CD2 3.93Å
495	K	90.3	Very high	81.5	Confident	39 Å²	39	43.9 Å²	43.9	17%	0.17	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	119.7	175.6	178	179.1	-179.5	140.3	0	109.5	D324 V334 A335 Y336 I559	D324-K495 IonicContact OD1-NZ 2.75Å; D324-K495 PolarHBondContact OD1-NZ 3.16Å; D324-K495 IonicContact OD2-NZ 3.93Å; D324-K495 PolarHBondContact OD2-NZ 2.99Å; V334-K495 HydrophobicContact CG1-CD 4.21Å; V334-K495 HydrophobicContact CG1-CG 3.79Å; A335-K495 WeakPolarHBondContact O-CA 3.45Å; Y336-K495 HydrophobicContact CD1-CB 4.11Å; Y336-K495 HydrophobicContact CD1-CG 4.43Å; Y336-K495 HydrophobicContact CE1-CB 3.84Å; Y336-K495 HydrophobicContact CE1-CD 3.89Å; Y336-K495 HydrophobicContact CE1-CG 3.91Å; Y336-K495 WeakPolarHBondContact OH-CD 3.22Å; Y336-K495 PolarHBondContact OH-NZ 3.29Å; K495-I559 HydrophobicContact CB-CB 4.3Å; K495-I559 PolarHBondContact N-O 2.62Å; K495-I559 PolarHBondContact O-N 2.9Å
496	I	87.3	Confident	78.7	Confident	28 Å²	28	46.9 Å²	46.9	14%	0.144	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	127.6	176.6	-60.9	172	0	0	0	109.1	A335 E494 Q555 P558	A335-I496 PolarHBondContact N-O 3.34Å; A335-I496 PolarHBondContact O-N 3.12Å; E494-I496 HydrophobicContact CG-CD1 4.25Å; E494-I496 HydrophobicContact CG-CG1 4.03Å; I496-Q555 HydrophobicContact CG2-CB 3.98Å; I496-Q555 HydrophobicContact CG2-CG 4.21Å; I496-P558 HydrophobicContact CG1-CB 4.02Å
497	L	86.9	Confident	75.9	Confident	39 Å²	39	53.6 Å²	53.6	20%	0.204	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	134.6	171.6	-59.5	178.5	0	0	0	109	P332 V334 Q555 D556	P332-L497 HydrophobicContact CB-CB 4.48Å; P332-L497 HydrophobicContact CB-CD2 4.43Å; V334-L497 HydrophobicContact CB-CD2 4.3Å; V334-L497 HydrophobicContact CG1-CD2 4.1Å; V334-L497 HydrophobicContact CG2-CD2 3.67Å; L497-Q555 WeakPolarHBondContact O-CA 3.34Å; L497-D556 HydrophobicContact CB-CB 4.27Å; L497-D556 PolarHBondContact O-N 2.73Å
498	S	86.3	Confident	73.1	Confident	11 Å²	11	58.8 Å²	58.8	8%	0.077	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	141.4	-179.4	62	0	0	0	0	112.7	P332 F333 R554	P332-S498 CarbonylContact C-O 3.53Å; P332-S498 WeakPolarHBondContact CA-O 3.28Å; F333-S498 WeakPolarHBondContact CB-OG 3.38Å; F333-S498 PolarHBondContact N-O 3.04Å; F333-S498 PolarHBondContact O-N 3.02Å; F333-S498 PolarHBondContact O-OG 3.19Å; S498-R554 CarbonylContact C-O 3.52Å; S498-R554 VanDerWaalsContact CA-O 3.26Å; S498-R554 WeakPolarHBondContact CA-O 3.22Å
499	W	83.4	Confident	70.4	Confident	104 Å²	104	64 Å²	64	39%	0.394	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136.8	-172.9	-59.7	91	0	0	0	110.7	P332 V501 L553 R554 D556	P332-W499 HydrophobicContact CB-CD2 4.08Å; P332-W499 HydrophobicContact CB-CE3 4.25Å; P332-W499 HydrophobicContact CB-CH2 3.85Å; P332-W499 HydrophobicContact CB-CZ2 3.63Å; P332-W499 HydrophobicContact CB-CZ3 4.14Å; P332-W499 VanDerWaalsContact CD-CH2 3.49Å; P332-W499 HydrophobicContact CG-CH2 3.83Å; P332-W499 HydrophobicContact CG-CZ2 3.91Å; P332-W499 HydrophobicContact CG-CZ3 4.36Å; W499-V501 PolarHBondContact O-N 3.41Å; W499-L553 CarbonylContact O-C 3.27Å; W499-L553 VanDerWaalsContact O-CA 3.28Å; W499-L553 WeakPolarHBondContact O-CA 3.35Å; W499-R554 PolarHBondContact N-O 2.94Å; W499-R554 PolarHBondContact O-N 2.89Å; W499-D556 PolarHBondContact NE1-OD2 3.02Å; W499-D556 VanDerWaalsContact NE1-OD2 3.12Å
500	P	80.7	Confident	67.3	Low	27 Å²	27	71.9 Å²	71.9	18%	0.175	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	126.9	174.6	17.4	-18	0	0	0	111	E330 F333 V502 L553	E330-P500 WeakPolarHBondContact O-CD 3.19Å; F333-P500 HydrophobicContact CE2-CG 4.06Å; P500-V502 PolarHBondContact O-N 2.82Å; P500-L553 HydrophobicContact CB-CD2 4.03Å
501	V	73.1	Confident	64.4	Low	73 Å²	73	77.9 Å²	77.9	44%	0.442	46%	0.462	S	S	.	.			trans	-69	105.7	175.1	178.7	0	0	0	0	108.3	W499 L503 E552 R554	W499-V501 PolarHBondContact O-N 3.41Å; V501-L503 PolarHBondContact O-N 3.44Å; V501-E552 WeakPolarHBondContact CB-O 3.27Å; V501-E552 VanDerWaalsContact CG2-O 3.28Å; V501-E552 WeakPolarHBondContact CG2-O 3.5Å; V501-E552 PolarHBondContact N-O 2.9Å; V501-R554 HydrophobicContact CG2-CB 4.05Å
502	V	60.8	Low	61.4	Low	128 Å²	128	82.8 Å²	82.8	78%	0.776	50%	0.502	S	S	*	.			trans	-76.7	103.9	171.1	-177.9	0	0	0	0	107.4	P500	P500-V502 PolarHBondContact O-N 2.82Å
503	L	48.5	Very low	58.4	Low	145 Å²	145	92.4 Å²	92.4	76%	0.759	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-62.5	126.1	166.8	-71	169.4	0	0	0	108.2	V501 A505	V501-L503 PolarHBondContact O-N 3.44Å; L503-A505 PolarHBondContact O-N 3.21Å
504	P	40.3	Very low	55.3	Low	112 Å²	112	104.2 Å²	104.2	73%	0.727	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-62.1	132.4	177.5	23	-29.5	0	0	0	109.4	V506	P504-V506 PolarHBondContact O-N 2.98Å
505	A	44.1	Very low	52.2	Low	91 Å²	91	106.5 Å²	106.5	75%	0.752	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-58.1	121.2	175.3	0	0	0	0	0	109.1	L503 D507	L503-A505 PolarHBondContact O-N 3.21Å; A505-D507 PolarHBondContact O-N 3.5Å
506	V	34.2	Very low	49.1	Very low	133 Å²	133	115.2 Å²	115.2	81%	0.806	66%	0.656	S	S	*	*			trans	-67.2	107.4	170.2	179.8	0	0	0	0	107.4	P504 S508	P504-V506 PolarHBondContact O-N 2.98Å; V506-S508 PolarHBondContact O-N 2.9Å; V506-S508 VanDerWaalsContact O-N 3.08Å
507	D	35.2	Very low	46.1	Very low	150 Å²	150	117.3 Å²	117.3	80%	0.802	68%	0.684	S	S	*	*			trans	-53.6	112.8	167.6	-80.3	-40.5	0	0	0	109.2	A505 P509	A505-D507 PolarHBondContact O-N 3.5Å; D507-P509 WeakPolarHBondContact O-CD 3.36Å
508	S	34.5	Very low	43.2	Very low	110 Å²	110	122.9 Å²	122.9	77%	0.769	71%	0.71	S	S	*	*			trans	-78.3	121.5	173	-60.1	0	0	0	0	109.3	V506 L510	V506-S508 PolarHBondContact O-N 2.9Å; V506-S508 VanDerWaalsContact O-N 3.08Å; S508-L510 PolarHBondContact O-N 2.77Å
509	P	35.8	Very low	40.3	Very low	122 Å²	122	130.1 Å²	130.1	79%	0.792	74%	0.74	S	S	*	*			trans	-81.2	117.2	176.2	-5.6	23.3	0	0	0	111.4	D507	D507-P509 WeakPolarHBondContact O-CD 3.36Å
510	L	29.8	Very low	37.7	Very low	167 Å²	167	130.8 Å²	130.8	87%	0.874	75%	0.751	S	S	*	*			trans	36.7	110.3	135.2	-61.9	168	0	0	0	118.8	S508 A512	S508-L510 PolarHBondContact O-N 2.77Å; L510-A512 PolarHBondContact O-N 2.78Å
511	S	31.3	Very low	35.3	Very low	130 Å²	130	137.4 Å²	137.4	91%	0.909	78%	0.777	S	S	*	*			trans	-62.7	116.6	163.9	58.1	0	0	0	0	112.3
512	A	30.8	Very low	33	Very low	102 Å²	102	143.8 Å²	143.8	84%	0.843	80%	0.799	S	S	*	*			trans	-99.3	140	167.4	0	0	0	0	0	112.2	L510	L510-A512 PolarHBondContact O-N 2.78Å
513	K	30.1	Very low	31.5	Very low	203 Å²	203	141.7 Å²	141.7	88%	0.883	80%	0.803	S	S	*	*			trans	-41.7	137	-176.9	-78.6	164.3	170.9	170	0	118.6
514	R	26.3	Very low	30.5	Very low	251 Å²	251	143.9 Å²	143.9	95%	0.947	81%	0.806	S	S	*	*				34.6	125.3	128.3	-79.9	-171	176.5	-161.4	0.4	120.7
515	G	26	Very low	29.9	Very low	72 Å²	72	148.1 Å²	148.1	74%	0.742	82%	0.817	S	S	*	*			trans	177.6	96.3	141.2	0	0	0	0	0	109.7
516	K	25.2	Very low	29.1	Very low	222 Å²	222	151.1 Å²	151.1	97%	0.965	81%	0.813	S	S	*	*				80.2	119.7	85.8	-160.3	-176.5	-173.7	-174.4	0	114
517	G	25.7	Very low	28.8	Very low	71 Å²	71	150.7 Å²	150.7	73%	0.732	81%	0.806	S	S	*	*			trans	127.6	83	164	0	0	0	0	0	112.6
518	E	25.8	Very low	28.5	Very low	157 Å²	157	155.6 Å²	155.6	73%	0.734	81%	0.813	S	S	*	*				84.5	113.5	78.6	-164.2	169.7	-158.7	0	0	115
519	K	25.1	Very low	28.1	Very low	163 Å²	163	160.7 Å²	160.7	71%	0.709	82%	0.821	S	S	*	*			trans	40.4	137.1	149.5	-64.1	174.4	-168.8	139.7	0	118.8
520	D	28.6	Very low	27.7	Very low	117 Å²	117	158.8 Å²	158.8	63%	0.626	82%	0.824	S	S	*	*				-171.3	152.1	63	-127.1	-17.8	0	0	0	113.7
521	K	29.5	Very low	27.5	Very low	167 Å²	167	160.7 Å²	160.7	73%	0.726	83%	0.828	S	S	*	*			trans	33.4	120.3	146.2	-75.2	163.1	-168.2	151.9	0	121.1
522	K	26.4	Very low	27.2	Very low	206 Å²	206	157.9 Å²	157.9	90%	0.896	82%	0.819	S	S	*	*				78.2	103.6	78.3	-163.7	-174	-170.3	-176.5	0	113
523	G	27.8	Very low	26.9	Very low	84 Å²	84	161.2 Å²	161.2	87%	0.866	82%	0.817	S	S	*	*			trans	-152.6	107.3	163.9	0	0	0	0	0	109.5
524	K	28.3	Very low	26.8	Very low	191 Å²	191	160.6 Å²	160.6	83%	0.83	82%	0.815	S	S	*	*			trans	-113.6	122.1	-176.8	-177.9	-171.8	-170.4	-179.7	0	105.4
525	E	27.6	Very low	26.7	Very low	202 Å²	202	157.2 Å²	157.2	94%	0.944	81%	0.81	S	S	*	*			trans	-144.9	149	159.4	-151.6	165.9	-163.7	0	0	111.4
526	K	27	Very low	27.1	Very low	154 Å²	154	159.2 Å²	159.2	67%	0.67	81%	0.81	S	S	*	*			trans	-130.6	144.1	-148.6	-140.8	-166.9	174.6	-156.2	0	107.5
527	D	28.6	Very low	27.2	Very low	123 Å²	123	153.3 Å²	153.3	66%	0.658	80%	0.802	S	S	*	*			trans	62.2	118.9	151.1	-59.2	-30.7	0	0	0	119.5
528	R	29.3	Very low	27.2	Very low	254 Å²	254	160.1 Å²	160.1	96%	0.958	81%	0.812	S	S	*	*				-171.1	147.2	103.2	-101	172.9	177.1	-175.7	-0.5	114.2
529	K	25.8	Very low	27.2	Very low	216 Å²	216	161.4 Å²	161.4	94%	0.939	82%	0.818	S	S	*	*			trans	-62.3	149.1	-175.2	-79.3	169.7	162.6	176.4	0	114.9
530	G	27.4	Very low	27.4	Very low	82 Å²	82	165 Å²	165	85%	0.845	83%	0.827	S	S	*	*			trans	-156.8	139.2	155.6	0	0	0	0	0	109.5
531	Q	25	Very low	27.2	Very low	208 Å²	208	169.5 Å²	169.5	97%	0.972	84%	0.841	S	S	*	*			trans	-104.1	149	-156.3	-154.8	175.7	-0.3	0	0	110.4
532	G	24.5	Very low	27.1	Very low	70 Å²	70	167.5 Å²	167.5	72%	0.722	84%	0.842	S	S	*	*			trans	161.4	82.5	167.9	0	0	0	0	0	118.5
533	E	25.9	Very low	27.1	Very low	172 Å²	172	163.3 Å²	163.3	80%	0.804	84%	0.836	S	S	*	*			trans	76.2	129.2	138.9	-68.8	-165.4	176.1	0	0	125
534	K	27.3	Very low	27	Very low	190 Å²	190	169.1 Å²	169.1	83%	0.826	84%	0.838	S	S	*	*			trans	92.8	99.2	147.8	-72.5	170.5	-173.1	172.8	0	120.9
535	E	24.2	Very low	27	Very low	181 Å²	181	169.7 Å²	169.7	85%	0.846	84%	0.84	S	S	*	*			trans	-57.1	178	151.4	-86.6	-168	165.1	0	0	114.2
536	P	34.8	Very low	27	Very low	113 Å²	113	169.6 Å²	169.6	73%	0.734	84%	0.837	S	S	*	*			cis	-136.6	156.5	-22	29.1	-9.3	0	0	0	113.9
537	A	26	Very low	27.2	Very low	98 Å²	98	171.9 Å²	171.9	81%	0.81	85%	0.847	S	S	*	*			trans	-157.6	106.8	149.5	0	0	0	0	0	111.1	E539	A537-E539 PolarHBondContact O-N 2.97Å
538	K	27.2	Very low	27.3	Very low	214 Å²	214	173.9 Å²	173.9	93%	0.93	85%	0.852	S	S	*	*			trans	-84	93.5	168.3	-80.3	177.5	177	170.2	0	109
539	E	26	Very low	27.5	Very low	185 Å²	185	169.1 Å²	169.1	86%	0.864	85%	0.845	S	S	*	*			trans	-86.5	120.2	159.9	-81.4	-170.4	157.1	0	0	110.3	A537 K541	A537-E539 PolarHBondContact O-N 2.97Å; E539-K541 PolarHBondContact O-N 2.91Å
540	R	28.7	Very low	28.3	Very low	238 Å²	238	164.6 Å²	164.6	90%	0.898	84%	0.837	S	S	*	*			trans	-65.8	121.6	170.5	-75.8	173.9	165.9	177.8	-4.2	108.9	V542	R540-V542 PolarHBondContact O-N 2.96Å
541	K	23.9	Very low	29.7	Very low	212 Å²	212	167.1 Å²	167.1	92%	0.922	83%	0.825	S	S	*	*			trans	-56.1	107.7	167	-71.1	-179.4	175.5	180	0	110.2	E539	E539-K541 PolarHBondContact O-N 2.91Å
542	V	27.9	Very low	31.7	Very low	124 Å²	124	164.7 Å²	164.7	75%	0.752	81%	0.814	S	S	*	*			trans	-89.6	131.4	158.9	178	0	0	0	0	107	R540 K544	R540-V542 PolarHBondContact O-N 2.96Å; V542-K544 PolarHBondContact O-N 2.84Å
543	P	26.7	Very low	34.3	Very low	118 Å²	118	164.6 Å²	164.6	77%	0.766	80%	0.796	S	S	*	*			trans	-66.8	121.1	176.8	26.4	-30.5	0	0	0	109.1	K545	P543-K545 PolarHBondContact O-N 2.88Å
544	K	25.9	Very low	36.9	Very low	207 Å²	207	164.9 Å²	164.9	90%	0.9	79%	0.79	S	S	*	*			trans	-57	104.6	170.3	-77.3	179.6	174.4	178.7	0	108.6	V542 K546	V542-K544 PolarHBondContact O-N 2.84Å; K544-K546 PolarHBondContact O-N 2.85Å
545	K	28.1	Very low	39.7	Very low	202 Å²	202	162 Å²	162	88%	0.878	78%	0.779	S	S	*	*			trans	-51.1	122.4	154.8	-110	-180	174.2	-177.7	0	106.1	P543 K547	P543-K545 PolarHBondContact O-N 2.88Å; K545-K547 PolarHBondContact O-N 2.89Å
546	K	27.1	Very low	42.5	Very low	201 Å²	201	155.7 Å²	155.7	87%	0.874	75%	0.751	S	S	*	*			trans	-51.8	111.9	169.3	-77.9	-180	173.3	-177.7	0	107.1	K544 E548	K544-K546 PolarHBondContact O-N 2.85Å; K546-E548 VanDerWaalsContact C-N 3.34Å; K546-E548 PolarHBondContact O-N 2.84Å; K546-E548 VanDerWaalsContact O-N 3.09Å
547	K	30.5	Very low	44.8	Very low	202 Å²	202	154.8 Å²	154.8	88%	0.878	75%	0.746	S	S	*	*			trans	-67.1	100.7	165.4	-167.3	176.5	-177.6	-176.3	0	104	K545 L549	K545-K547 PolarHBondContact O-N 2.89Å; K547-L549 PolarHBondContact O-N 3.1Å
548	E	31.9	Very low	47.6	Very low	164 Å²	164	153 Å²	153	77%	0.766	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-55.3	124.3	168.8	-78	-178.9	153.3	0	0	106.7	K546	K546-E548 VanDerWaalsContact C-N 3.34Å; K546-E548 PolarHBondContact O-N 2.84Å; K546-E548 VanDerWaalsContact O-N 3.09Å
549	L	33.7	Very low	50.4	Low	155 Å²	155	147.4 Å²	147.4	81%	0.812	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-57	140.3	167	-75.9	147.3	0	0	0	107.4	K547 K551	K547-L549 PolarHBondContact O-N 3.1Å; L549-K551 PolarHBondContact O-N 3.1Å; L549-K551 VanDerWaalsContact O-N 3.08Å
550	P	41.3	Very low	53.3	Low	121 Å²	121	141.1 Å²	141.1	79%	0.786	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-54.4	121.8	175.2	-18.1	29.3	0	0	0	108.1	E552	P550-E552 PolarHBondContact O-N 3.03Å; P550-E552 VanDerWaalsContact O-N 3.15Å
551	K	56.9	Low	56.2	Low	134 Å²	134	134.6 Å²	134.6	58%	0.583	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-63.6	116.6	170.1	-68.2	177.9	-179.7	179	0	105.9	L549 L553	L549-K551 PolarHBondContact O-N 3.1Å; L549-K551 VanDerWaalsContact O-N 3.08Å; K551-L553 HydrophobicContact CB-CD2 4.33Å; K551-L553 PolarHBondContact O-N 3.48Å
552	E	67.8	Low	59.4	Low	158 Å²	158	125.1 Å²	125.1	74%	0.738	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-62.2	120.2	172.4	-159.6	165.1	-167.6	0	0	107.1	V501 P550	V501-E552 WeakPolarHBondContact CB-O 3.27Å; V501-E552 VanDerWaalsContact CG2-O 3.28Å; V501-E552 WeakPolarHBondContact CG2-O 3.5Å; V501-E552 PolarHBondContact N-O 2.9Å; P550-E552 PolarHBondContact O-N 3.03Å; P550-E552 VanDerWaalsContact O-N 3.15Å
553	L	77.8	Confident	62.2	Low	68 Å²	68	120.5 Å²	120.5	36%	0.356	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.7	127.1	-178	-60	-177.6	0	0	0	108.1	F333 W499 P500 K551	F333-L553 HydrophobicContact CD2-CD1 4.27Å; F333-L553 HydrophobicContact CD2-CD2 4.18Å; F333-L553 HydrophobicContact CE2-CD2 4.21Å; W499-L553 CarbonylContact O-C 3.27Å; W499-L553 VanDerWaalsContact O-CA 3.28Å; W499-L553 WeakPolarHBondContact O-CA 3.35Å; P500-L553 HydrophobicContact CB-CD2 4.03Å; K551-L553 HydrophobicContact CB-CD2 4.33Å; K551-L553 PolarHBondContact O-N 3.48Å
554	R	81.5	Confident	65.2	Low	177 Å²	177	115.3 Å²	115.3	67%	0.668	56%	0.555	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.3	128.2	166.6	176.6	-178.8	169.6	178.1	-0.7	108.1	S498 W499 V501	S498-R554 CarbonylContact C-O 3.52Å; S498-R554 VanDerWaalsContact CA-O 3.26Å; S498-R554 WeakPolarHBondContact CA-O 3.22Å; W499-R554 PolarHBondContact N-O 2.94Å; W499-R554 PolarHBondContact O-N 2.89Å; V501-R554 HydrophobicContact CG2-CB 4.05Å
555	Q	85.1	Confident	68.3	Low	129 Å²	129	111.7 Å²	111.7	60%	0.603	54%	0.536	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	137.4	176.9	-61.1	-178.7	2.4	0	0	110	I496 L497	I496-Q555 HydrophobicContact CG2-CB 3.98Å; I496-Q555 HydrophobicContact CG2-CG 4.21Å; L497-Q555 WeakPolarHBondContact O-CA 3.34Å
556	D	83.8	Confident	71.2	Confident	49 Å²	49	103.1 Å²	103.1	26%	0.262	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-79.5	157.6	168	-68.4	-26.7	0	0	0	109.6	L497 W499	L497-D556 HydrophobicContact CB-CB 4.27Å; L497-D556 PolarHBondContact O-N 2.73Å; W499-D556 PolarHBondContact NE1-OD2 3.02Å; W499-D556 VanDerWaalsContact NE1-OD2 3.12Å
557	P	81.9	Confident	74.4	Confident	95 Å²	95	98.6 Å²	98.6	62%	0.617	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-53	141.7	175	-26.2	34.7	0	0	0	112.1	I559	P557-I559 PolarHBondContact O-N 3.47Å
558	P	85.4	Confident	77.4	Confident	61 Å²	61	89.1 Å²	89.1	40%	0.396	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-62.4	135.4	-178	24.1	-32.3	0	0	0	111.4	E494 I496 L560	E494-P558 HydrophobicContact CG-CB 3.71Å; E494-P558 VanDerWaalsContact OE1-CB 3.29Å; E494-P558 WeakPolarHBondContact OE1-CB 3.09Å; I496-P558 HydrophobicContact CG1-CB 4.02Å; P558-L560 HydrophobicContact CB-CD2 4.23Å
559	I	85.8	Confident	80.5	Confident	95 Å²	95	86.4 Å²	86.4	49%	0.487	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	114	171.4	-57	171.1	0	0	0	107	K495 P557	K495-I559 HydrophobicContact CB-CB 4.3Å; K495-I559 PolarHBondContact N-O 2.62Å; K495-I559 PolarHBondContact O-N 2.9Å; P557-I559 PolarHBondContact O-N 3.47Å
560	L	88.4	Confident	83.5	Confident	54 Å²	54	79 Å²	79	28%	0.283	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	134.3	-177.9	-54.9	-178.7	0	0	0	111.1	L443 V492 E493 E494 P558	L443-L560 HydrophobicContact CD1-CB 4.32Å; L443-L560 HydrophobicContact CD1-CD1 3.86Å; V492-L560 HydrophobicContact CG1-CB 4.24Å; V492-L560 HydrophobicContact CG1-CD2 4.37Å; E493-L560 CarbonylContact O-C 3.28Å; E493-L560 WeakPolarHBondContact O-CA 3.44Å; E494-L560 HydrophobicContact CB-CD2 3.8Å; E494-L560 HydrophobicContact CG-CD2 3.93Å; P558-L560 HydrophobicContact CB-CD2 4.23Å
561	Q	88.6	Confident	86	Confident	101 Å²	101	77.9 Å²	77.9	47%	0.472	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	120.4	175.4	177.5	175.5	-24.6	0	0	110.2	E493 L563	E493-Q561 HydrophobicContact CB-CB 4.4Å; E493-Q561 PolarHBondContact N-O 3.42Å; E493-Q561 PolarHBondContact O-N 2.75Å; Q561-L563 HydrophobicContact CG-CD2 4.39Å; Q561-L563 PolarHBondContact O-N 3.01Å
562	V	90.3	Very high	87.8	Confident	12 Å²	12	73.2 Å²	73.2	7%	0.073	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	120.2	172.3	173.8	0	0	0	0	110.2	R442 L443 T490	R442-V562 HydrophobicContact CB-CG2 4.24Å; L443-V562 HydrophobicContact CD2-CG2 3.97Å; L443-V562 HydrophobicContact CG-CG2 4.11Å; T490-V562 HydrophobicContact CG2-CB 4.18Å; T490-V562 HydrophobicContact CG2-CG1 3.36Å; T490-V562 HydrophobicContact CG2-CG2 3.88Å
563	L	88.1	Confident	89.2	Confident	28 Å²	28	65.8 Å²	65.8	15%	0.147	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-33.4	178.5	-60.9	-175.6	0	0	0	112.8	V317 Y338 I491 E493 Q561 L631	V317-L563 HydrophobicContact CG1-CD1 4.06Å; Y338-L563 HydrophobicContact CD1-CD1 3.89Å; Y338-L563 HydrophobicContact CE1-CD1 3.91Å; I491-L563 HydrophobicContact CB-CB 4.35Å; I491-L563 HydrophobicContact CG2-CB 4.2Å; I491-L563 HydrophobicContact CG2-CD1 4.03Å; I491-L563 HydrophobicContact CG2-CG 4.49Å; I491-L563 PolarHBondContact O-N 3.14Å; E493-L563 HydrophobicContact CB-CD1 4.09Å; E493-L563 HydrophobicContact CB-CD2 4.05Å; E493-L563 HydrophobicContact CB-CG 4Å; Q561-L563 HydrophobicContact CG-CD2 4.39Å; Q561-L563 PolarHBondContact O-N 3.01Å; L563-L631 HydrophobicContact CB-CD2 3.7Å
564	G	88.5	Confident	89.9	Confident	8 Å²	8	62.8 Å²	62.8	8%	0.082	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	146.1	-179.4	0	0	0	0	0	111	T490 I491	T490-G564 CarbonylContact C-O 3.25Å; T490-G564 VanDerWaalsContact CA-O 3.3Å; T490-G564 WeakPolarHBondContact CA-O 3.4Å; T490-G564 WeakPolarHBondContact CG2-O 3.17Å; I491-G564 PolarHBondContact N-O 2.91Å
565	R	91.8	Very high	90.4	Very high	132 Å²	132	56 Å²	56	50%	0.498	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	135.7	178.2	-178.4	-179.3	178	-158.9	3.3	109.1	T488 V489 T490	T488-R565 HydrophobicContact CG2-CG 3.63Å; V489-R565 WeakPolarHBondContact O-CA 3.28Å; T490-R565 HydrophobicContact CG2-CB 4.42Å
566	G	89.8	Confident	90.6	Very high	21 Å²	21	51.7 Å²	51.7	22%	0.216	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	155.1	-179.8	0	0	0	0	0	112.7	T488 V489 F586	T488-G566 WeakPolarHBondContact CA-O 3.3Å; V489-G566 PolarHBondContact N-O 2.91Å; V489-G566 PolarHBondContact O-N 2.85Å; G566-F586 VanDerWaalsContact N-CE1 3.34Å
567	L	92.9	Very high	91	Very high	107 Å²	107	54.2 Å²	54.2	56%	0.56	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	131.4	177.1	-175	70.8	0	0	0	109.5
568	V	95.2	Very high	91.5	Very high	2 Å²	2	53 Å²	53	1%	0.012	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	119.2	169.6	-178	0	0	0	0	107.7	G486 T487 V489 L570 V580	G486-V568 CarbonylContact C-O 3.41Å; G486-V568 VanDerWaalsContact CA-O 3.26Å; G486-V568 WeakPolarHBondContact CA-O 3.47Å; T487-V568 HydrophobicContact CG2-CB 3.82Å; T487-V568 HydrophobicContact CG2-CG1 4.45Å; T487-V568 HydrophobicContact CG2-CG2 4.46Å; T487-V568 PolarHBondContact N-O 3.16Å; T487-V568 PolarHBondContact O-N 3.33Å; V489-V568 HydrophobicContact CG2-CG2 3.71Å; V568-L570 HydrophobicContact CG1-CD2 3.95Å; V568-V580 HydrophobicContact CG1-CG1 4.14Å
569	I	95.6	Very high	92	Very high	107 Å²	107	53.2 Å²	53.2	55%	0.549	29%	0.288	S	S	.	.			trans	-77.5	125.9	-179.5	-56.7	172	0	0	0	108.5	E571	I569-E571 HydrophobicContact CG2-CB 4.15Å
570	L	96.2	Very high	92.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.268	C	S	.	.			trans	-112.1	-2.1	-176.8	-56.4	-179.2	0	0	0	113.9	F482 L483 T487 V568 P572 L573 V580 I637	F482-L570 HydrophobicContact CD1-CD1 4.42Å; F482-L570 HydrophobicContact CE1-CD1 3.7Å; F482-L570 HydrophobicContact CZ-CD1 4.05Å; L483-L570 HydrophobicContact CB-CB 4.42Å; L483-L570 HydrophobicContact CD2-CB 3.78Å; L483-L570 HydrophobicContact CD2-CD1 3.93Å; L483-L570 HydrophobicContact CD2-CG 4.49Å; L483-L570 CarbonylContact O-C 3.53Å; L483-L570 WeakPolarHBondContact O-CB 3.5Å; T487-L570 HydrophobicContact CG2-CD1 3.89Å; T487-L570 HydrophobicContact CG2-CD2 4.3Å; T487-L570 HydrophobicContact CG2-CG 4.28Å; V568-L570 HydrophobicContact CG1-CD2 3.95Å; L570-P572 VanDerWaalsContact O-N 3.15Å; L570-L573 HydrophobicContact CB-CD1 4.48Å; L570-L573 HydrophobicContact CD2-CD1 4.42Å; L570-L573 WeakPolarHBondContact O-CB 3.46Å; L570-L573 PolarHBondContact O-N 3.46Å; L570-V580 HydrophobicContact CD2-CG1 4.38Å; L570-I637 HydrophobicContact CD1-CD1 4.32Å; L570-I637 HydrophobicContact CD2-CB 4.41Å; L570-I637 HydrophobicContact CD2-CD1 3.52Å
571	E	94.8	Very high	92.9	Very high	98 Å²	98	50.6 Å²	50.6	46%	0.458	28%	0.283	S	S	.	.	H	α-helix	trans	-48	-37.4	173.9	-173.5	-175.4	176.5	0	0	113.9	L483 L484 I569 L573 L574 A575	L483-E571 PolarHBondContact O-N 2.84Å; L483-E571 VanDerWaalsContact O-N 3.17Å; L484-E571 HydrophobicContact CD2-CG 4.38Å; I569-E571 HydrophobicContact CG2-CB 4.15Å; E571-L573 PolarHBondContact O-N 2.86Å; E571-L573 VanDerWaalsContact O-N 3.14Å; E571-L574 WeakPolarHBondContact O-CB 3.37Å; E571-L574 PolarHBondContact O-N 2.98Å; E571-A575 PolarHBondContact O-N 3.23Å
572	P	95.7	Very high	93.2	Very high	36 Å²	36	48.2 Å²	48.2	23%	0.234	28%	0.275	C	S	.	.	H	α-helix	trans	-57.8	-29.4	177.2	-25.5	34.8	0	0	0	114.4	L570 L574 A575 G576 E577 V580	L570-P572 VanDerWaalsContact O-N 3.15Å; P572-L574 VanDerWaalsContact C-N 3.35Å; P572-A575 CarbonylContact O-C 3.31Å; P572-A575 VanDerWaalsContact O-C 3.27Å; P572-A575 WeakPolarHBondContact O-CA 3.42Å; P572-A575 PolarHBondContact O-N 3.44Å; P572-G576 PolarHBondContact O-N 3.12Å; P572-E577 HydrophobicContact CB-CB 4.19Å; P572-E577 HydrophobicContact CB-CG 4.1Å; P572-E577 WeakPolarHBondContact CB-OE2 3.36Å; P572-E577 VanDerWaalsContact O-CB 3.31Å; P572-E577 WeakPolarHBondContact O-CB 3.47Å; P572-E577 PolarHBondContact O-N 3.14Å; P572-V580 HydrophobicContact CB-CG2 4.03Å; P572-V580 HydrophobicContact CG-CG2 4.29Å
573	L	95.5	Very high	93.4	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-66.3	-37.4	175.3	-61	176.9	0	0	0	111.8	F307 L483 L570 E571 A575 G576 E577 V580 I637 L639	F307-L573 HydrophobicContact CD1-CD1 4.4Å; F307-L573 HydrophobicContact CE1-CD1 4.14Å; L483-L573 HydrophobicContact CD2-CD1 4.13Å; L570-L573 HydrophobicContact CB-CD1 4.48Å; L570-L573 HydrophobicContact CD2-CD1 4.42Å; L570-L573 WeakPolarHBondContact O-CB 3.46Å; L570-L573 PolarHBondContact O-N 3.46Å; E571-L573 PolarHBondContact O-N 2.86Å; E571-L573 VanDerWaalsContact O-N 3.14Å; L573-A575 VanDerWaalsContact C-N 3.32Å; L573-G576 PolarHBondContact O-N 3.36Å; L573-E577 WeakPolarHBondContact CA-O 3.46Å; L573-E577 VanDerWaalsContact CD2-O 3.27Å; L573-E577 WeakPolarHBondContact CD2-O 3.49Å; L573-V580 HydrophobicContact CD1-CG2 4.36Å; L573-V580 HydrophobicContact CD2-CB 4.48Å; L573-V580 HydrophobicContact CD2-CG2 3.82Å; L573-V580 HydrophobicContact CG-CG2 3.69Å; L573-I637 HydrophobicContact CD1-CG2 3.87Å; L573-L639 HydrophobicContact CD2-CB 4.32Å
574	L	93.8	Very high	93.6	Very high	4 Å²	4	50.8 Å²	50.8	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-69.4	-33.6	172.3	-73.5	170.5	0	0	0	111.5	G255 L260 K480 L483 L484 E571 P572 G576	G255-L574 VanDerWaalsContact CA-O 3.31Å; G255-L574 WeakPolarHBondContact CA-O 3.49Å; G255-L574 PolarHBondContact N-O 3.09Å; L260-L574 HydrophobicContact CD1-CD2 4.1Å; L260-L574 HydrophobicContact CD2-CD2 4.12Å; L260-L574 HydrophobicContact CG-CD2 4.4Å; K480-L574 HydrophobicContact CB-CD2 4.42Å; K480-L574 HydrophobicContact CG-CD1 4.09Å; K480-L574 HydrophobicContact CG-CD2 4.03Å; L483-L574 HydrophobicContact CB-CD1 3.61Å; L483-L574 HydrophobicContact CB-CD2 4.37Å; L483-L574 HydrophobicContact CB-CG 3.75Å; L483-L574 HydrophobicContact CD1-CD2 3.79Å; L483-L574 HydrophobicContact CD1-CG 3.84Å; L483-L574 HydrophobicContact CG-CG 4.46Å; L484-L574 HydrophobicContact CD2-CD1 3.65Å; L484-L574 HydrophobicContact CG-CD1 3.63Å; E571-L574 WeakPolarHBondContact O-CB 3.37Å; E571-L574 PolarHBondContact O-N 2.98Å; P572-L574 VanDerWaalsContact C-N 3.35Å; L574-G576 PolarHBondContact O-N 2.89Å; L574-G576 VanDerWaalsContact O-N 3.15Å
575	A	91.1	Very high	93.8	Very high	34 Å²	34	55.1 Å²	55.1	28%	0.281	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	18.7	170.9	0	0	0	0	0	113	F229 Q254 E571 P572 L573 E577	F229-A575 HydrophobicContact CZ-CB 4.39Å; Q254-A575 PolarHBondContact NE2-O 3.1Å; E571-A575 PolarHBondContact O-N 3.23Å; P572-A575 CarbonylContact O-C 3.31Å; P572-A575 VanDerWaalsContact O-C 3.27Å; P572-A575 WeakPolarHBondContact O-CA 3.42Å; P572-A575 PolarHBondContact O-N 3.44Å; L573-A575 VanDerWaalsContact C-N 3.32Å; A575-E577 VanDerWaalsContact C-N 3.28Å; A575-E577 PolarHBondContact O-N 3.17Å
576	G	88.8	Confident	93.7	Very high	39 Å²	39	50.9 Å²	50.9	40%	0.402	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	6.7	170.2	0	0	0	0	0	115	P572 L573 L574	P572-G576 PolarHBondContact O-N 3.12Å; L573-G576 PolarHBondContact O-N 3.36Å; L574-G576 PolarHBondContact O-N 2.89Å; L574-G576 VanDerWaalsContact O-N 3.15Å
577	E	93	Very high	93.5	Very high	103 Å²	103	51.3 Å²	51.3	48%	0.481	30%	0.303	S	S	.	.			trans	-70.6	132	166.7	-61.2	-166.6	172.1	0	0	109.5	P572 L573 A575 L579	P572-E577 HydrophobicContact CB-CB 4.19Å; P572-E577 HydrophobicContact CB-CG 4.1Å; P572-E577 WeakPolarHBondContact CB-OE2 3.36Å; P572-E577 VanDerWaalsContact O-CB 3.31Å; P572-E577 WeakPolarHBondContact O-CB 3.47Å; P572-E577 PolarHBondContact O-N 3.14Å; L573-E577 WeakPolarHBondContact CA-O 3.46Å; L573-E577 VanDerWaalsContact CD2-O 3.27Å; L573-E577 WeakPolarHBondContact CD2-O 3.49Å; A575-E577 VanDerWaalsContact C-N 3.28Å; A575-E577 PolarHBondContact O-N 3.17Å; E577-L579 PolarHBondContact O-N 3.16Å
578	P	92.6	Very high	93.1	Very high	70 Å²	70	52.5 Å²	52.5	46%	0.455	31%	0.307	S	S	.	.	S	Bend	trans	-76.8	-13.2	-178.6	31	-35.9	0	0	0	112.7	Q638 L639	P578-Q638 WeakPolarHBondContact O-CA 3.49Å; P578-Q638 WeakPolarHBondContact O-CG 3.4Å; P578-L639 PolarHBondContact O-N 3.43Å
579	L	96	Very high	92.4	Very high	64 Å²	64	54.7 Å²	54.7	34%	0.335	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	125.7	-168.1	-173.6	61.6	0	0	0	112.7	E577 Q636 I637 Q638	E577-L579 PolarHBondContact O-N 3.16Å; L579-Q636 HydrophobicContact CD1-CG 3.34Å; L579-Q636 HydrophobicContact CD2-CG 4.36Å; L579-Q636 HydrophobicContact CG-CG 4.16Å; L579-I637 WeakPolarHBondContact CD1-O 3.19Å; L579-Q638 HydrophobicContact CD1-CB 3.6Å; L579-Q638 HydrophobicContact CD1-CG 4.01Å
580	V	96.5	Very high	91.5	Very high	11 Å²	11	51.5 Å²	51.5	7%	0.067	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	119.1	165	172.1	0	0	0	0	108.5	V568 L570 P572 L573 Q636 I637	V568-V580 HydrophobicContact CG1-CG1 4.14Å; L570-V580 HydrophobicContact CD2-CG1 4.38Å; P572-V580 HydrophobicContact CB-CG2 4.03Å; P572-V580 HydrophobicContact CG-CG2 4.29Å; L573-V580 HydrophobicContact CD1-CG2 4.36Å; L573-V580 HydrophobicContact CD2-CB 4.48Å; L573-V580 HydrophobicContact CD2-CG2 3.82Å; L573-V580 HydrophobicContact CG-CG2 3.69Å; V580-Q636 CarbonylContact O-C 3.58Å; V580-Q636 VanDerWaalsContact O-CA 3.28Å; V580-Q636 WeakPolarHBondContact O-CA 3.32Å; V580-I637 PolarHBondContact N-O 3.35Å; V580-I637 PolarHBondContact O-N 3.36Å
581	S	96.3	Very high	90.6	Very high	83 Å²	83	55 Å²	55	58%	0.58	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	120	174.7	-175.2	0	0	0	0	109.3
582	T	94.9	Very high	89.6	Confident	52 Å²	52	51.5 Å²	51.5	32%	0.319	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	138.1	-175.4	-62.8	0	0	0	0	110.6	V635	T582-V635 PolarHBondContact N-O 3.47Å; T582-V635 PolarHBondContact O-N 3.42Å; T582-V635 VanDerWaalsContact O-O 3.1Å
583	V	94.9	Very high	88.6	Confident	84 Å²	84	54.5 Å²	54.5	51%	0.509	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	104.5	168	-177.6	0	0	0	0	108	N585 T632 V633 E634	V583-N585 PolarHBondContact O-N 3.42Å; V583-T632 HydrophobicContact CG1-CG2 4.24Å; V583-V633 CarbonylContact C-O 3.59Å; V583-V633 WeakPolarHBondContact CA-O 3.3Å; V583-E634 HydrophobicContact CG2-CG 4.14Å
584	C	92.4	Very high	87.8	Confident	10 Å²	10	54.6 Å²	54.6	7%	0.068	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	118.4	178.3	-63.4	0	0	0	0	108.9	F586 T632 V633	C584-F586 HydrophobicContact CB-CE1 3.92Å; C584-F586 HydrophobicContact CB-CE2 4.01Å; C584-F586 HydrophobicContact CB-CZ 3.46Å; C584-F586 VanDerWaalsContact CB-CZ 3.46Å; C584-T632 CarbonylContact O-C 3.55Å; C584-T632 WeakPolarHBondContact O-CA 3.41Å; C584-V633 HydrophobicContact CB-CG1 3.81Å; C584-V633 PolarHBondContact N-O 3.04Å; C584-V633 PolarHBondContact O-N 2.75Å
585	N	91.8	Very high	87	Confident	99 Å²	99	55 Å²	55	53%	0.529	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	118.1	178.7	-175.9	-21.4	0	0	0	110.3	V583 G587 P630 T632	V583-N585 PolarHBondContact O-N 3.42Å; N585-G587 PolarHBondContact OD1-N 3.12Å; N585-P630 WeakPolarHBondContact OD1-CB 3.45Å; N585-T632 HydrophobicContact CB-CG2 4.07Å
586	F	90.1	Very high	86.5	Confident	42 Å²	42	59.6 Å²	59.6	18%	0.184	34%	0.338	C	S	.	.			trans	-101.9	12.3	-176.6	-52	-62.4	0	0	0	113.2	I491 G566 C584 L631 V633	I491-F586 HydrophobicContact CD1-CD2 3.64Å; I491-F586 HydrophobicContact CD1-CE2 3.42Å; I491-F586 VanDerWaalsContact CD1-CE2 3.42Å; I491-F586 HydrophobicContact CG1-CD2 4.37Å; I491-F586 HydrophobicContact CG1-CE2 3.81Å; G566-F586 VanDerWaalsContact N-CE1 3.34Å; C584-F586 HydrophobicContact CB-CE1 3.92Å; C584-F586 HydrophobicContact CB-CE2 4.01Å; C584-F586 HydrophobicContact CB-CZ 3.46Å; C584-F586 VanDerWaalsContact CB-CZ 3.46Å; F586-L631 HydrophobicContact CB-CB 4.36Å; F586-L631 HydrophobicContact CB-CD2 4.1Å; F586-L631 HydrophobicContact CB-CG 4.36Å; F586-L631 HydrophobicContact CD2-CD2 4.12Å; F586-L631 HydrophobicContact CD2-CG 4.04Å; F586-L631 PolarHBondContact N-O 2.88Å; F586-V633 HydrophobicContact CE2-CG1 3.7Å; F586-V633 HydrophobicContact CZ-CG1 4.01Å
587	G	85.8	Confident	86	Confident	30 Å²	30	61.3 Å²	61.3	31%	0.309	34%	0.338	S	S	.	.			trans	84.5	-167.8	-179.1	0	0	0	0	0	113.5	N585 P630 L631	N585-G587 PolarHBondContact OD1-N 3.12Å; G587-P630 CarbonylContact O-C 3.53Å; G587-P630 WeakPolarHBondContact O-CA 3.45Å; G587-L631 PolarHBondContact O-N 3.33Å
588	M	83.5	Confident	85.3	Confident	132 Å²	132	56.8 Å²	56.8	65%	0.65	32%	0.317	S	S	*	.			trans	-94.8	115.5	-174.3	-65.2	-177.1	-179.1	0	0	111.2	P628	M588-P628 HydrophobicContact CG-CG 4.47Å; M588-P628 HydrophobicContact SD-CG 3.77Å
589	V	80.7	Confident	84.6	Confident	48 Å²	48	56.6 Å²	56.6	29%	0.291	31%	0.312	S	S	.	.			trans	-101.6	-20.9	175.5	-171.5	0	0	0	0	111.7	L318 L631	L318-V589 HydrophobicContact CB-CG1 4.19Å; V589-L631 HydrophobicContact CG2-CB 3.85Å; V589-L631 HydrophobicContact CG2-CD2 3.88Å; V589-L631 HydrophobicContact CG2-CG 4.46Å
590	R	78.1	Confident	83.6	Confident	41 Å²	41	55.8 Å²	55.8	16%	0.155	32%	0.315	C	S	.	.			trans	-81.9	143.9	178.4	-63.7	176.5	67.9	174.8	7	111.5	D595 P628	R590-D595 IonicContact CZ-OD1 2.92Å; R590-D595 IonicContact CZ-OD2 2.88Å; R590-D595 IonicContact NE-OD1 2.69Å; R590-D595 PolarHBondContact NE-OD1 2.8Å; R590-D595 IonicContact NE-OD2 2.79Å; R590-D595 PolarHBondContact NE-OD2 3.34Å; R590-D595 IonicContact NH2-OD1 3.75Å; R590-D595 PolarHBondContact NH2-OD1 3.11Å; R590-D595 IonicContact NH2-OD2 3.34Å; R590-D595 PolarHBondContact NH2-OD2 3.27Å; R590-P628 HydrophobicContact CB-CB 3.93Å
591	T	76.1	Confident	82.7	Confident	74 Å²	74	58.1 Å²	58.1	45%	0.454	32%	0.322	S	S	.	.			trans	-124.3	155.4	176.2	65.4	0	0	0	0	110.9	T593 S594 D595 Y626	T591-T593 PolarHBondContact O-N 3.48Å; T591-T593 VanDerWaalsContact O-N 3.12Å; T591-S594 PolarHBondContact N-OG 3.1Å; T591-S594 PolarHBondContact O-N 3.2Å; T591-S594 PolarHBondContact O-OG 2.96Å; T591-S594 PolarHBondContact OG1-N 2.78Å; T591-S594 PolarHBondContact OG1-OG 3.22Å; T591-D595 PolarHBondContact O-N 3.13Å; T591-Y626 PolarHBondContact O-OH 3.01Å
592	L	74.9	Confident	81.6	Confident	23 Å²	23	56.4 Å²	56.4	12%	0.12	31%	0.307	C	S	.	.	H	α-helix	trans	-54.4	-37.2	178.1	179.3	66.2	0	0	0	111.5	R596 I621 E623 Y626	L592-R596 WeakPolarHBondContact O-CB 3.47Å; L592-R596 VanDerWaalsContact O-CG 3.28Å; L592-R596 WeakPolarHBondContact O-CG 3.35Å; L592-R596 PolarHBondContact O-N 3.42Å; L592-R596 VanDerWaalsContact O-N 3.14Å; L592-I621 HydrophobicContact CD1-CG2 4.3Å; L592-E623 HydrophobicContact CD2-CB 4.33Å; L592-E623 HydrophobicContact CD2-CG 3.8Å; L592-Y626 VanDerWaalsContact CA-CZ 3.41Å; L592-Y626 HydrophobicContact CB-CD1 3.82Å; L592-Y626 HydrophobicContact CB-CE1 3.73Å; L592-Y626 HydrophobicContact CB-CE2 4.43Å; L592-Y626 HydrophobicContact CB-CG 4.22Å; L592-Y626 HydrophobicContact CD1-CD1 4.1Å; L592-Y626 HydrophobicContact CD1-CD2 3.51Å; L592-Y626 HydrophobicContact CD1-CE1 4.5Å; L592-Y626 HydrophobicContact CD1-CE2 3.97Å; L592-Y626 HydrophobicContact CD1-CG 3.59Å; L592-Y626 HydrophobicContact CG-CD1 4.49Å; L592-Y626 HydrophobicContact CG-CG 4.44Å; L592-Y626 VanDerWaalsContact N-CZ 3.32Å; L592-Y626 PolarHBondContact N-OH 3.39Å
593	T	74.7	Confident	80.6	Confident	99 Å²	99	55.8 Å²	55.8	61%	0.607	30%	0.304	S	S	*	.	H	α-helix	trans	-64.7	-47.6	176.8	-50.9	0	0	0	0	111.6	T591 D595 R596 L597	T591-T593 PolarHBondContact O-N 3.48Å; T591-T593 VanDerWaalsContact O-N 3.12Å; T593-D595 PolarHBondContact O-N 3.32Å; T593-R596 PolarHBondContact O-N 3.48Å; T593-L597 WeakPolarHBondContact O-CG 3.48Å; T593-L597 PolarHBondContact O-N 3.25Å; T593-L597 VanDerWaalsContact O-N 3.17Å
594	S	76.9	Confident	79.3	Confident	5 Å²	5	58.2 Å²	58.2	4%	0.035	31%	0.308	C	S	.	.	H	α-helix	trans	-64.1	-41.8	179.4	58.2	0	0	0	0	112.2	L318 T591 R596 L597 T598	L318-S594 WeakPolarHBondContact CD1-OG 3.4Å; T591-S594 PolarHBondContact N-OG 3.1Å; T591-S594 PolarHBondContact O-N 3.2Å; T591-S594 PolarHBondContact O-OG 2.96Å; T591-S594 PolarHBondContact OG1-N 2.78Å; T591-S594 PolarHBondContact OG1-OG 3.22Å; S594-R596 VanDerWaalsContact C-N 3.34Å; S594-R596 PolarHBondContact O-N 3.16Å; S594-L597 WeakPolarHBondContact O-CB 3.29Å; S594-L597 PolarHBondContact O-N 2.93Å; S594-L597 VanDerWaalsContact O-N 3.1Å; S594-T598 PolarHBondContact O-N 3.49Å; S594-T598 PolarHBondContact O-OG1 3.44Å; S594-T598 VanDerWaalsContact O-OG1 3.07Å
595	D	78.6	Confident	77.9	Confident	12 Å²	12	63.3 Å²	63.3	6%	0.064	33%	0.329	C	S	.	.	H	α-helix	trans	-67.5	-35.8	-178.7	-72.3	-12	0	0	0	112.5	R590 T591 T593 L597 T598 L599 Y626	R590-D595 IonicContact CZ-OD1 2.92Å; R590-D595 IonicContact CZ-OD2 2.88Å; R590-D595 IonicContact NE-OD1 2.69Å; R590-D595 PolarHBondContact NE-OD1 2.8Å; R590-D595 IonicContact NE-OD2 2.79Å; R590-D595 PolarHBondContact NE-OD2 3.34Å; R590-D595 IonicContact NH2-OD1 3.75Å; R590-D595 PolarHBondContact NH2-OD1 3.11Å; R590-D595 IonicContact NH2-OD2 3.34Å; R590-D595 PolarHBondContact NH2-OD2 3.27Å; T591-D595 PolarHBondContact O-N 3.13Å; T593-D595 PolarHBondContact O-N 3.32Å; D595-L597 VanDerWaalsContact C-N 3.32Å; D595-L597 PolarHBondContact O-N 2.93Å; D595-T598 PolarHBondContact O-N 2.68Å; D595-L599 WeakPolarHBondContact O-CB 3.25Å; D595-L599 WeakPolarHBondContact O-CD1 3.35Å; D595-L599 VanDerWaalsContact O-CG 3.29Å; D595-L599 WeakPolarHBondContact O-CG 3.29Å; D595-L599 PolarHBondContact O-N 2.82Å; D595-Y626 HydrophobicContact CB-CE2 4.12Å; D595-Y626 VanDerWaalsContact CG-OH 3.3Å; D595-Y626 WeakPolarHBondContact OD2-CE2 3.41Å; D595-Y626 VanDerWaalsContact OD2-CZ 3.27Å; D595-Y626 PolarHBondContact OD2-OH 3.45Å
596	R	79.9	Confident	76.3	Confident	130 Å²	130	63.9 Å²	63.9	49%	0.491	33%	0.331	S	S	.	.	H	α-helix	trans	-62.3	-39.3	171.4	-76.4	177.2	174.9	-177.2	1.9	112	L592 T593 S594 A600 I621	L592-R596 WeakPolarHBondContact O-CB 3.47Å; L592-R596 VanDerWaalsContact O-CG 3.28Å; L592-R596 WeakPolarHBondContact O-CG 3.35Å; L592-R596 PolarHBondContact O-N 3.42Å; L592-R596 VanDerWaalsContact O-N 3.14Å; T593-R596 PolarHBondContact O-N 3.48Å; S594-R596 VanDerWaalsContact C-N 3.34Å; S594-R596 PolarHBondContact O-N 3.16Å; R596-A600 VanDerWaalsContact O-CB 3.31Å; R596-A600 WeakPolarHBondContact O-CB 3.26Å; R596-A600 PolarHBondContact O-N 3.48Å; R596-I621 PolarHBondContact NH2-O 2.91Å
597	L	77.7	Confident	74.5	Confident	75 Å²	75	69.1 Å²	69.1	39%	0.393	35%	0.354	S	S	.	.	H	α-helix	trans	-66.5	-43.9	177.5	-69.4	172.1	0	0	0	111.6	V322 L323 T593 S594 D595 A600 R601	V322-L597 HydrophobicContact CB-CB 4.02Å; V322-L597 HydrophobicContact CG2-CB 3.78Å; V322-L597 HydrophobicContact CG2-CD1 4.19Å; L323-L597 HydrophobicContact CD2-CD1 4.18Å; T593-L597 WeakPolarHBondContact O-CG 3.48Å; T593-L597 PolarHBondContact O-N 3.25Å; T593-L597 VanDerWaalsContact O-N 3.17Å; S594-L597 WeakPolarHBondContact O-CB 3.29Å; S594-L597 PolarHBondContact O-N 2.93Å; S594-L597 VanDerWaalsContact O-N 3.1Å; D595-L597 VanDerWaalsContact C-N 3.32Å; D595-L597 PolarHBondContact O-N 2.93Å; L597-A600 PolarHBondContact O-N 3.45Å; L597-R601 PolarHBondContact O-N 3.11Å
598	T	78.6	Confident	72.8	Confident	8 Å²	8	76.3 Å²	76.3	5%	0.049	38%	0.377	C	S	.	.	H	α-helix	trans	-60.7	-49.8	176.4	-50	0	0	0	0	111.6	D319 W459 S594 D595 A600 R601 D602	D319-T598 HydrophobicContact CB-CG2 4.27Å; W459-T598 HydrophobicContact CH2-CG2 3.4Å; W459-T598 VanDerWaalsContact CH2-CG2 3.4Å; W459-T598 HydrophobicContact CZ2-CG2 4.02Å; W459-T598 HydrophobicContact CZ3-CG2 3.93Å; S594-T598 PolarHBondContact O-N 3.49Å; S594-T598 PolarHBondContact O-OG1 3.44Å; S594-T598 VanDerWaalsContact O-OG1 3.07Å; D595-T598 PolarHBondContact O-N 2.68Å; T598-A600 VanDerWaalsContact C-N 3.3Å; T598-A600 PolarHBondContact O-N 3.03Å; T598-R601 WeakPolarHBondContact O-CB 3.48Å; T598-R601 PolarHBondContact O-N 3.31Å; T598-R601 VanDerWaalsContact O-N 3.16Å; T598-D602 PolarHBondContact O-N 3.49Å
599	L	77.3	Confident	71.2	Confident	67 Å²	67	76.1 Å²	76.1	35%	0.351	38%	0.383	S	S	.	.	H	α-helix	trans	-59.3	-39	176.7	-73.9	166.3	0	0	0	112.7	D595 S603 I621	D595-L599 WeakPolarHBondContact O-CB 3.25Å; D595-L599 WeakPolarHBondContact O-CD1 3.35Å; D595-L599 VanDerWaalsContact O-CG 3.29Å; D595-L599 WeakPolarHBondContact O-CG 3.29Å; D595-L599 PolarHBondContact O-N 2.82Å; L599-S603 WeakPolarHBondContact O-CB 3.39Å; L599-S603 PolarHBondContact O-N 3.15Å; L599-S603 PolarHBondContact O-OG 2.8Å; L599-I621 HydrophobicContact CD1-CD1 3.57Å
600	A	75.8	Confident	69.5	Low	47 Å²	47	76 Å²	76	39%	0.388	39%	0.387	S	S	.	.	H	α-helix	trans	-67.1	-40.6	177.7	0	0	0	0	0	112.1	R596 L597 T598 K604	R596-A600 VanDerWaalsContact O-CB 3.31Å; R596-A600 WeakPolarHBondContact O-CB 3.26Å; R596-A600 PolarHBondContact O-N 3.48Å; L597-A600 PolarHBondContact O-N 3.45Å; T598-A600 VanDerWaalsContact C-N 3.3Å; T598-A600 PolarHBondContact O-N 3.03Å; A600-K604 WeakPolarHBondContact O-CG 3.28Å; A600-K604 PolarHBondContact O-N 2.9Å; A600-K604 VanDerWaalsContact O-N 3.13Å
601	R	77.7	Confident	68	Low	59 Å²	59	83.4 Å²	83.4	22%	0.223	42%	0.42	C	S	.	.	H	α-helix	trans	-63.2	-46	175.3	-171.5	-165.1	70.9	179.8	-12	111.3	D319 S321 L597 T598 S603 K604 K605	D319-R601 IonicContact OD1-NH1 3.92Å; D319-R601 IonicContact OD2-CZ 3.94Å; D319-R601 IonicContact OD2-NE 3.48Å; D319-R601 IonicContact OD2-NH1 3.21Å; D319-R601 PolarHBondContact OD2-NH1 3.37Å; D319-R601 IonicContact OD2-NH2 3.47Å; D319-R601 PolarHBondContact OD2-NH2 3.35Å; S321-R601 PolarHBondContact OG-NH1 3.1Å; L597-R601 PolarHBondContact O-N 3.11Å; T598-R601 WeakPolarHBondContact O-CB 3.48Å; T598-R601 PolarHBondContact O-N 3.31Å; T598-R601 VanDerWaalsContact O-N 3.16Å; R601-S603 VanDerWaalsContact C-N 3.34Å; R601-S603 PolarHBondContact O-N 3.04Å; R601-K604 WeakPolarHBondContact O-CB 3.25Å; R601-K604 PolarHBondContact O-N 2.92Å; R601-K604 VanDerWaalsContact O-N 3.08Å; R601-K605 PolarHBondContact O-N 3.41Å
602	D	74	Confident	66.4	Low	48 Å²	48	89.3 Å²	89.3	26%	0.257	44%	0.44	S	S	.	.	H	α-helix	trans	-68.3	-37.2	-177.5	-65.6	-15.2	0	0	0	111.2	T598 K604 K605 I606	T598-D602 PolarHBondContact O-N 3.49Å; D602-K604 VanDerWaalsContact C-N 3.29Å; D602-K604 PolarHBondContact O-N 2.88Å; D602-K605 PolarHBondContact O-N 3.1Å; D602-I606 VanDerWaalsContact O-CG1 3.25Å; D602-I606 WeakPolarHBondContact O-CG1 3.21Å; D602-I606 PolarHBondContact O-N 2.83Å
603	S	72.3	Confident	64.7	Low	38 Å²	38	96.8 Å²	96.8	27%	0.266	47%	0.474	S	S	.	.	H	α-helix	trans	-59.7	-36.1	170	-63.2	0	0	0	0	113.1	L599 R601 K607	L599-S603 WeakPolarHBondContact O-CB 3.39Å; L599-S603 PolarHBondContact O-N 3.15Å; L599-S603 PolarHBondContact O-OG 2.8Å; R601-S603 VanDerWaalsContact C-N 3.34Å; R601-S603 PolarHBondContact O-N 3.04Å; S603-K607 WeakPolarHBondContact O-CG 3.25Å; S603-K607 PolarHBondContact O-N 3.23Å; S603-K607 VanDerWaalsContact O-N 3.12Å
604	K	68.4	Low	62.9	Low	136 Å²	136	101.7 Å²	101.7	59%	0.591	49%	0.487	S	S	*	.	H	α-helix	trans	-71.6	-39.8	174.6	-73.3	174.7	-178.6	177.4	0	112.1	A600 R601 D602 K607 K608	A600-K604 WeakPolarHBondContact O-CG 3.28Å; A600-K604 PolarHBondContact O-N 2.9Å; A600-K604 VanDerWaalsContact O-N 3.13Å; R601-K604 WeakPolarHBondContact O-CB 3.25Å; R601-K604 PolarHBondContact O-N 2.92Å; R601-K604 VanDerWaalsContact O-N 3.08Å; D602-K604 VanDerWaalsContact C-N 3.29Å; D602-K604 PolarHBondContact O-N 2.88Å; K604-K607 PolarHBondContact O-N 2.68Å; K604-K608 PolarHBondContact O-N 2.84Å; K604-K608 VanDerWaalsContact O-N 3.13Å
605	K	63.1	Low	61	Low	116 Å²	116	106.7 Å²	106.7	50%	0.504	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-45.7	174.1	-76.3	-178.8	179.2	173.7	0	111.1	R601 D602 K607 K608 V609	R601-K605 PolarHBondContact O-N 3.41Å; D602-K605 PolarHBondContact O-N 3.1Å; K605-K607 VanDerWaalsContact C-N 3.35Å; K605-K607 PolarHBondContact O-N 3.18Å; K605-K608 WeakPolarHBondContact O-CB 3.35Å; K605-K608 PolarHBondContact O-N 3.28Å; K605-K608 VanDerWaalsContact O-N 3.1Å; K605-V609 WeakPolarHBondContact O-CG2 3.38Å; K605-V609 PolarHBondContact O-N 3.11Å; K605-V609 VanDerWaalsContact O-N 3.11Å
606	I	58	Low	59.1	Low	112 Å²	112	115.8 Å²	115.8	57%	0.574	56%	0.558	S	S	*	*	H	α-helix	trans	-61.8	-41.2	177.4	-65.5	163.3	0	0	0	110.9	D602 K608 V609 A610	D602-I606 VanDerWaalsContact O-CG1 3.25Å; D602-I606 WeakPolarHBondContact O-CG1 3.21Å; D602-I606 PolarHBondContact O-N 2.83Å; I606-K608 VanDerWaalsContact C-N 3.32Å; I606-K608 PolarHBondContact O-N 2.83Å; I606-V609 PolarHBondContact O-N 3.08Å; I606-A610 HydrophobicContact CG2-CB 4.49Å; I606-A610 WeakPolarHBondContact O-CB 3.36Å; I606-A610 PolarHBondContact O-N 3.46Å
607	K	51.6	Low	57.1	Low	152 Å²	152	114.1 Å²	114.1	66%	0.661	57%	0.572	S	S	*	*	H	α-helix	trans	-64.9	-29.3	174.6	-76.2	175.9	-178.3	176	0	114	S603 K604 K605	S603-K607 WeakPolarHBondContact O-CG 3.25Å; S603-K607 PolarHBondContact O-N 3.23Å; S603-K607 VanDerWaalsContact O-N 3.12Å; K604-K607 PolarHBondContact O-N 2.68Å; K605-K607 VanDerWaalsContact C-N 3.35Å; K605-K607 PolarHBondContact O-N 3.18Å
608	K	51.1	Low	55.5	Low	180 Å²	180	115 Å²	115	78%	0.783	58%	0.581	S	S	*	*	H	α-helix	trans	-72.8	-34.7	174.1	-98	-179.7	176.6	173.2	0	112.2	K604 K605 I606	K604-K608 PolarHBondContact O-N 2.84Å; K604-K608 VanDerWaalsContact O-N 3.13Å; K605-K608 WeakPolarHBondContact O-CB 3.35Å; K605-K608 PolarHBondContact O-N 3.28Å; K605-K608 VanDerWaalsContact O-N 3.1Å; I606-K608 VanDerWaalsContact C-N 3.32Å; I606-K608 PolarHBondContact O-N 2.83Å
609	V	48.9	Very low	53.9	Low	129 Å²	129	121.3 Å²	121.3	78%	0.782	61%	0.614	S	S	*	*	H	α-helix	trans	-86.1	-39.3	-179.2	-180	0	0	0	0	111.8	K605 I606 K611	K605-V609 WeakPolarHBondContact O-CG2 3.38Å; K605-V609 PolarHBondContact O-N 3.11Å; K605-V609 VanDerWaalsContact O-N 3.11Å; I606-V609 PolarHBondContact O-N 3.08Å; V609-K611 VanDerWaalsContact C-N 3.29Å; V609-K611 PolarHBondContact O-N 3.43Å
610	A	45.2	Very low	52.6	Low	46 Å²	46	122.5 Å²	122.5	38%	0.38	63%	0.626	S	S	.	*			trans	-83.4	63.4	177.5	0	0	0	0	0	111.8	I606 K612	I606-A610 HydrophobicContact CG2-CB 4.49Å; I606-A610 WeakPolarHBondContact O-CB 3.36Å; I606-A610 PolarHBondContact O-N 3.46Å; A610-K612 PolarHBondContact O-N 3.02Å
611	K	47.3	Very low	51.6	Low	196 Å²	196	123.5 Å²	123.5	85%	0.852	62%	0.624	S	S	*	*	S	Bend	trans	-78.1	4.1	163	-112.5	-178	-178.8	178.4	0	113.2	V609	V609-K611 VanDerWaalsContact C-N 3.29Å; V609-K611 PolarHBondContact O-N 3.43Å
612	K	41.5	Very low	50.5	Low	198 Å²	198	128.3 Å²	128.3	86%	0.861	64%	0.643	S	S	*	*	S	Bend	trans	-147	88.8	170.8	-92.7	-174.8	171.8	-178.4	0	109.7	A610	A610-K612 PolarHBondContact O-N 3.02Å
613	E	40.5	Very low	49.7	Very low	179 Å²	179	133.3 Å²	133.3	84%	0.836	67%	0.665	S	S	*	*	S	Bend	trans	146.2	146	151.6	-81.5	-174.7	178.5	0	0	111.6
614	K	35.6	Very low	48.6	Very low	202 Å²	202	135.9 Å²	135.9	88%	0.878	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-63.8	138.8	-167.1	-76.2	179	175.6	178.2	0	111.8	K616	K614-K616 PolarHBondContact O-N 2.77Å
615	P	38.3	Very low	48.1	Very low	110 Å²	110	134.9 Å²	134.9	71%	0.714	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-69.9	130.6	179.4	28.7	-32.2	0	0	0	110.9
616	K	37.6	Very low	48.3	Very low	204 Å²	204	131.4 Å²	131.4	89%	0.887	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-68.2	135.5	160.9	-87.6	-179	175	177.8	0	108.6	K614 V618	K614-K616 PolarHBondContact O-N 2.77Å; K616-V618 PolarHBondContact O-N 3.25Å
617	A	38.7	Very low	48.9	Very low	95 Å²	95	133.7 Å²	133.7	79%	0.785	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-65.2	127.8	179.3	0	0	0	0	0	110.5
618	V	43.9	Very low	50.1	Low	94 Å²	94	127.5 Å²	127.5	57%	0.57	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-81.9	119.7	169.5	179.3	0	0	0	0	106.7	K616	K616-V618 PolarHBondContact O-N 3.25Å
619	N	44.4	Very low	51.5	Low	140 Å²	140	123.1 Å²	123.1	75%	0.749	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-68.8	135.4	176	-79.1	-21.1	0	0	0	109.8	I621	N619-I621 PolarHBondContact O-N 3.39Å
620	P	50.4	Low	53.5	Low	92 Å²	92	119 Å²	119	60%	0.597	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-68.1	129.1	174.3	26.7	-30.9	0	0	0	110.2	Y622	P620-Y622 HydrophobicContact CG-CE2 4.27Å; P620-Y622 PolarHBondContact O-N 3.26Å
621	I	54.3	Low	55.7	Low	68 Å²	68	116.8 Å²	116.8	35%	0.349	59%	0.591	S	S	.	*			trans	-73.3	112.4	171.4	-59.6	174.5	0	0	0	107.7	L592 R596 L599 N619 Y626	L592-I621 HydrophobicContact CD1-CG2 4.3Å; R596-I621 PolarHBondContact NH2-O 2.91Å; L599-I621 HydrophobicContact CD1-CD1 3.57Å; N619-I621 PolarHBondContact O-N 3.39Å; I621-Y626 HydrophobicContact CG2-CD2 4.1Å
622	Y	54.8	Low	58	Low	159 Å²	159	108.2 Å²	108.2	62%	0.624	56%	0.555	S	S	*	*			trans	-74.9	144	173	-76	-87.9	0	0	0	110.1	P620 S624 D625	P620-Y622 HydrophobicContact CG-CE2 4.27Å; P620-Y622 PolarHBondContact O-N 3.26Å; Y622-S624 PolarHBondContact O-N 3.41Å; Y622-S624 VanDerWaalsContact O-N 3.15Å; Y622-D625 PolarHBondContact O-N 3.24Å; Y622-D625 VanDerWaalsContact O-N 3.11Å
623	E	57.9	Low	60.6	Low	153 Å²	153	98.8 Å²	98.8	72%	0.715	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-62.2	-21.5	-176	-158.2	158.6	-131.6	0	0	112.7	L592	L592-E623 HydrophobicContact CD2-CB 4.33Å; L592-E623 HydrophobicContact CD2-CG 3.8Å
624	S	48.3	Very low	63.2	Low	93 Å²	93	93.4 Å²	93.4	65%	0.65	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-75.3	-20.6	176.4	60.8	0	0	0	0	115	Y622	Y622-S624 PolarHBondContact O-N 3.41Å; Y622-S624 VanDerWaalsContact O-N 3.15Å
625	D	59.4	Low	66.1	Low	114 Å²	114	84 Å²	84	61%	0.61	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-114.9	11.2	-172.4	-56.3	-12.2	0	0	0	111.7	Y622 H627	Y622-D625 PolarHBondContact O-N 3.24Å; Y622-D625 VanDerWaalsContact O-N 3.11Å; D625-H627 PolarHBondContact O-N 2.94Å
626	Y	67.1	Low	68.9	Low	43 Å²	43	81.8 Å²	81.8	17%	0.169	43%	0.429	C	S	.	.			trans	-85.1	103.4	-176.1	-176.6	-109.2	0	0	0	111.5	T591 L592 D595 I621 P628	T591-Y626 PolarHBondContact O-OH 3.01Å; L592-Y626 VanDerWaalsContact CA-CZ 3.41Å; L592-Y626 HydrophobicContact CB-CD1 3.82Å; L592-Y626 HydrophobicContact CB-CE1 3.73Å; L592-Y626 HydrophobicContact CB-CE2 4.43Å; L592-Y626 HydrophobicContact CB-CG 4.22Å; L592-Y626 HydrophobicContact CD1-CD1 4.1Å; L592-Y626 HydrophobicContact CD1-CD2 3.51Å; L592-Y626 HydrophobicContact CD1-CE1 4.5Å; L592-Y626 HydrophobicContact CD1-CE2 3.97Å; L592-Y626 HydrophobicContact CD1-CG 3.59Å; L592-Y626 HydrophobicContact CG-CD1 4.49Å; L592-Y626 HydrophobicContact CG-CG 4.44Å; L592-Y626 VanDerWaalsContact N-CZ 3.32Å; L592-Y626 PolarHBondContact N-OH 3.39Å; D595-Y626 HydrophobicContact CB-CE2 4.12Å; D595-Y626 VanDerWaalsContact CG-OH 3.3Å; D595-Y626 WeakPolarHBondContact OD2-CE2 3.41Å; D595-Y626 VanDerWaalsContact OD2-CZ 3.27Å; D595-Y626 PolarHBondContact OD2-OH 3.45Å; I621-Y626 HydrophobicContact CG2-CD2 4.1Å; Y626-P628 HydrophobicContact CD1-CG 4.42Å; Y626-P628 HydrophobicContact CE1-CB 4.1Å; Y626-P628 HydrophobicContact CE1-CG 3.71Å
627	H	69.8	Low	71.8	Confident	161 Å²	161	72.2 Å²	72.2	75%	0.745	39%	0.387	S	S	*	.			trans	-119.8	95.8	172.2	-65	-63	0	0	0	109.3	D625	D625-H627 PolarHBondContact O-N 2.94Å
628	P	76.8	Confident	74.5	Confident	21 Å²	21	71.3 Å²	71.3	14%	0.136	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-68.4	141.3	177.8	24.3	-27.9	0	0	0	110.7	M588 R590 Y626	M588-P628 HydrophobicContact CG-CG 4.47Å; M588-P628 HydrophobicContact SD-CG 3.77Å; R590-P628 HydrophobicContact CB-CB 3.93Å; Y626-P628 HydrophobicContact CD1-CG 4.42Å; Y626-P628 HydrophobicContact CE1-CB 4.1Å; Y626-P628 HydrophobicContact CE1-CG 3.71Å
629	E	81.6	Confident	77	Confident	89 Å²	89	67 Å²	67	42%	0.416	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-65.4	132.5	170.3	-68.2	-174	172.5	0	0	109.9
630	P	89.7	Confident	79.4	Confident	41 Å²	41	62 Å²	62	27%	0.266	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-65.3	154.1	173.8	27.6	-32.8	0	0	0	110.9	G316 N585 G587 T632	G316-P630 WeakPolarHBondContact CA-O 3.31Å; N585-P630 WeakPolarHBondContact OD1-CB 3.45Å; G587-P630 CarbonylContact O-C 3.53Å; G587-P630 WeakPolarHBondContact O-CA 3.45Å; P630-T632 HydrophobicContact CB-CG2 4.25Å; P630-T632 HydrophobicContact CG-CG2 3.97Å; P630-T632 PolarHBondContact O-N 3.33Å
631	L	92.1	Very high	81.4	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	30%	0.301	C	S	.	.			trans	-69.3	112.3	171.4	180	68.5	0	0	0	108.5	I314 R315 V317 I491 L563 F586 G587 V589	I314-L631 HydrophobicContact CG2-CD1 4.25Å; R315-L631 VanDerWaalsContact O-CA 3.31Å; R315-L631 WeakPolarHBondContact O-CA 3.19Å; V317-L631 HydrophobicContact CB-CD1 4.4Å; V317-L631 HydrophobicContact CG2-CD1 3.7Å; I491-L631 HydrophobicContact CD1-CD1 3.77Å; I491-L631 HydrophobicContact CD1-CD2 4.05Å; I491-L631 HydrophobicContact CD1-CG 3.77Å; L563-L631 HydrophobicContact CB-CD2 3.7Å; F586-L631 HydrophobicContact CB-CB 4.36Å; F586-L631 HydrophobicContact CB-CD2 4.1Å; F586-L631 HydrophobicContact CB-CG 4.36Å; F586-L631 HydrophobicContact CD2-CD2 4.12Å; F586-L631 HydrophobicContact CD2-CG 4.04Å; F586-L631 PolarHBondContact N-O 2.88Å; G587-L631 PolarHBondContact O-N 3.33Å; V589-L631 HydrophobicContact CG2-CB 3.85Å; V589-L631 HydrophobicContact CG2-CD2 3.88Å; V589-L631 HydrophobicContact CG2-CG 4.46Å
632	T	94.8	Very high	83.2	Confident	15 Å²	15	58.3 Å²	58.3	9%	0.092	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	149.8	-178.2	63.8	0	0	0	0	112.4	I314 R315 V583 C584 N585 P630	I314-T632 CarbonylContact C-O 3.58Å; I314-T632 VanDerWaalsContact CA-O 3.31Å; I314-T632 WeakPolarHBondContact CA-O 3.28Å; R315-T632 PolarHBondContact N-O 3.27Å; R315-T632 PolarHBondContact O-N 3.31Å; V583-T632 HydrophobicContact CG1-CG2 4.24Å; C584-T632 CarbonylContact O-C 3.55Å; C584-T632 WeakPolarHBondContact O-CA 3.41Å; N585-T632 HydrophobicContact CB-CG2 4.07Å; P630-T632 HydrophobicContact CB-CG2 4.25Å; P630-T632 HydrophobicContact CG-CG2 3.97Å; P630-T632 PolarHBondContact O-N 3.33Å
633	V	95.9	Very high	85	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	134.7	167.3	61.8	0	0	0	0	110.6	I311 I314 V340 V489 I491 V583 C584 F586 V635	I311-V633 HydrophobicContact CG2-CG2 3.79Å; I314-V633 HydrophobicContact CG1-CG2 4.32Å; V340-V633 HydrophobicContact CG1-CG2 4.41Å; V340-V633 HydrophobicContact CG2-CG2 4Å; V489-V633 HydrophobicContact CG1-CG1 3.99Å; I491-V633 HydrophobicContact CD1-CB 4.15Å; I491-V633 HydrophobicContact CD1-CG1 4.31Å; I491-V633 HydrophobicContact CG1-CB 4.42Å; I491-V633 HydrophobicContact CG1-CG1 4.37Å; V583-V633 CarbonylContact C-O 3.59Å; V583-V633 WeakPolarHBondContact CA-O 3.3Å; C584-V633 HydrophobicContact CB-CG1 3.81Å; C584-V633 PolarHBondContact N-O 3.04Å; C584-V633 PolarHBondContact O-N 2.75Å; F586-V633 HydrophobicContact CE2-CG1 3.7Å; F586-V633 HydrophobicContact CZ-CG1 4.01Å; V633-V635 HydrophobicContact CG1-CG2 4.17Å; V633-V635 HydrophobicContact CG2-CG2 4.23Å
634	E	96.3	Very high	86.7	Confident	66 Å²	66	54 Å²	54	31%	0.308	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	123.4	172.5	-67.3	159.2	-173.3	0	0	109.4	G312 N313 V583	G312-E634 PolarHBondContact N-O 3.05Å; N313-E634 PolarHBondContact N-OE2 3.33Å; N313-E634 PolarHBondContact ND2-OE2 2.85Å; N313-E634 PolarHBondContact O-N 2.64Å; V583-E634 HydrophobicContact CG2-CG 4.14Å
635	V	96.6	Very high	88.8	Confident	4 Å²	4	50 Å²	50	2%	0.024	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	133.5	177.7	-178.7	0	0	0	0	109.5	I311 V489 T582 V633 I637	I311-V635 HydrophobicContact CD1-CB 4.33Å; I311-V635 HydrophobicContact CD1-CG1 3.92Å; I311-V635 HydrophobicContact CD1-CG2 3.82Å; V489-V635 HydrophobicContact CG1-CG2 4.03Å; V489-V635 HydrophobicContact CG2-CG1 4.38Å; V489-V635 HydrophobicContact CG2-CG2 4.13Å; T582-V635 PolarHBondContact N-O 3.47Å; T582-V635 PolarHBondContact O-N 3.42Å; T582-V635 VanDerWaalsContact O-O 3.1Å; V633-V635 HydrophobicContact CG1-CG2 4.17Å; V633-V635 HydrophobicContact CG2-CG2 4.23Å; V635-I637 HydrophobicContact CG1-CD1 4.36Å; V635-I637 HydrophobicContact CG1-CG1 4.31Å
636	Q	97.2	Very high	90.2	Very high	65 Å²	65	50.9 Å²	50.9	30%	0.304	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	128	177	165.6	-174.8	-18.5	0	0	109.9	T310 L579 V580	T310-Q636 PolarHBondContact N-O 2.87Å; T310-Q636 PolarHBondContact O-N 2.9Å; T310-Q636 WeakPolarHBondContact OG1-CB 3.48Å; T310-Q636 WeakPolarHBondContact OG1-CG 3.26Å; T310-Q636 PolarHBondContact OG1-O 2.98Å; L579-Q636 HydrophobicContact CD1-CG 3.34Å; L579-Q636 HydrophobicContact CD2-CG 4.36Å; L579-Q636 HydrophobicContact CG-CG 4.16Å; V580-Q636 CarbonylContact O-C 3.58Å; V580-Q636 VanDerWaalsContact O-CA 3.28Å; V580-Q636 WeakPolarHBondContact O-CA 3.32Å
637	I	97.1	Very high	91.4	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.01	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	117	-179.8	-61.1	168.8	0	0	0	107.4	F307 V308 V309 T487 L570 L573 L579 V580 V635	F307-I637 HydrophobicContact CD1-CG2 4.36Å; V308-I637 WeakPolarHBondContact O-CA 3.18Å; V309-I637 HydrophobicContact CG1-CG1 4.22Å; V309-I637 HydrophobicContact CG2-CG1 4.18Å; V309-I637 HydrophobicContact CG2-CG2 4.42Å; T487-I637 HydrophobicContact CG2-CD1 3.75Å; L570-I637 HydrophobicContact CD1-CD1 4.32Å; L570-I637 HydrophobicContact CD2-CB 4.41Å; L570-I637 HydrophobicContact CD2-CD1 3.52Å; L573-I637 HydrophobicContact CD1-CG2 3.87Å; L579-I637 WeakPolarHBondContact CD1-O 3.19Å; V580-I637 PolarHBondContact N-O 3.35Å; V580-I637 PolarHBondContact O-N 3.36Å; V635-I637 HydrophobicContact CG1-CD1 4.36Å; V635-I637 HydrophobicContact CG1-CG1 4.31Å
638	Q	97	Very high	92.3	Very high	77 Å²	77	45 Å²	45	36%	0.36	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	132.3	-176.4	-172.3	174.2	-35.2	0	0	110.2	F307 V308 P578 L579	F307-Q638 CarbonylContact C-O 3.58Å; F307-Q638 WeakPolarHBondContact CA-O 3.28Å; V308-Q638 HydrophobicContact CB-CB 4.46Å; V308-Q638 PolarHBondContact N-O 3.14Å; V308-Q638 PolarHBondContact O-N 3.38Å; P578-Q638 WeakPolarHBondContact O-CA 3.49Å; P578-Q638 WeakPolarHBondContact O-CG 3.4Å; L579-Q638 HydrophobicContact CD1-CB 3.6Å; L579-Q638 HydrophobicContact CD1-CG 4.01Å
639	L	96.1	Very high	92.8	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.016	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	124	166.3	177	65.4	0	0	0	108.6	L260 F307 L573 P578 Q641	L260-L639 HydrophobicContact CD2-CD1 4.47Å; L260-L639 HydrophobicContact CD2-CD2 3.96Å; F307-L639 HydrophobicContact CD1-CB 4.35Å; F307-L639 HydrophobicContact CD1-CD1 4.07Å; F307-L639 HydrophobicContact CE1-CB 4.19Å; F307-L639 HydrophobicContact CE1-CD1 3.56Å; F307-L639 HydrophobicContact CE1-CG 4.42Å; F307-L639 HydrophobicContact CE2-CD1 4.24Å; F307-L639 HydrophobicContact CZ-CD1 3.65Å; L573-L639 HydrophobicContact CD2-CB 4.32Å; P578-L639 PolarHBondContact O-N 3.43Å; L639-Q641 HydrophobicContact CD2-CG 4.38Å; L639-Q641 HydrophobicContact CG-CG 4.27Å; L639-Q641 PolarHBondContact O-N 3.22Å
640	N	93.9	Very high	93	Very high	35 Å²	35	50.8 Å²	50.8	19%	0.187	24%	0.235	C	C	.	.			trans	-75.3	123.2	177.9	-71.4	-15.6	0	0	0	109.8	P262 Q306	P262-N640 VanDerWaalsContact CA-O 3.27Å; P262-N640 WeakPolarHBondContact CA-O 3.42Å; P262-N640 WeakPolarHBondContact CB-O 3.47Å; Q306-N640 HydrophobicContact CB-CB 3.98Å; Q306-N640 WeakPolarHBondContact O-CB 3.22Å; Q306-N640 PolarHBondContact O-N 3.08Å
641	Q	93.1	Very high	92.4	Very high	73 Å²	73	52.5 Å²	52.5	34%	0.341	24%	0.24	S	C	.	.			trans	-130.8	130.3	176.4	-66.5	-175.6	-6.2	0	0	110	P262 L639	P262-Q641 CarbonylContact O-C 3.57Å; P262-Q641 WeakPolarHBondContact O-CA 3.47Å; L639-Q641 HydrophobicContact CD2-CG 4.38Å; L639-Q641 HydrophobicContact CG-CG 4.27Å; L639-Q641 PolarHBondContact O-N 3.22Å
642	C	92.4	Very high	91.2	Very high	9 Å²	9	57.5 Å²	57.5	6%	0.061	26%	0.262	C	S	.	.			trans	-73.3	136.6	179	-57	0	0	0	0	110.7	P262 F291 E647 A648	P262-C642 PolarHBondContact O-N 3.26Å; F291-C642 WeakPolarHBondContact CZ-O 3.31Å; C642-E647 HydrophobicContact CB-CB 4.48Å; C642-E647 HydrophobicContact CB-CG 4.41Å; C642-A648 HydrophobicContact CB-CB 4.06Å
643	R	91.8	Very high	89.4	Confident	199 Å²	199	60.7 Å²	60.7	75%	0.751	29%	0.289	S	S	*	.	S	Bend	trans	-99.1	-10.2	179	-60.3	-178.6	178.5	-177.6	0.2	113.2	F291 E647	F291-R643 VanDerWaalsContact CE1-C 3.45Å; R643-E647 PolarHBondContact N-OE2 3.24Å
644	S	93.6	Very high	86.9	Confident	24 Å²	24	69.8 Å²	69.8	17%	0.168	34%	0.344	C	S	.	.	S	Bend	trans	-151.2	164.8	177.3	71.9	0	0	0	0	111.9	E646 E647 A648	S644-E646 VanDerWaalsContact C-N 3.28Å; S644-E646 PolarHBondContact O-N 2.99Å; S644-E646 PolarHBondContact OG-N 3.19Å; S644-E647 PolarHBondContact O-N 3.23Å; S644-E647 PolarHBondContact OG-N 3.15Å; S644-A648 PolarHBondContact O-N 3.34Å
645	A	91.9	Very high	86.4	Confident	9 Å²	9	70 Å²	70	7%	0.074	35%	0.346	C	S	.	.	H	α-helix	trans	-63	-35.9	172.2	0	0	0	0	0	112	L290 L294 E647 A648 L649	L290-A645 PolarHBondContact O-N 2.64Å; L294-A645 HydrophobicContact CB-CB 4.03Å; L294-A645 HydrophobicContact CD1-CB 4.48Å; A645-E647 VanDerWaalsContact C-N 3.33Å; A645-E647 PolarHBondContact O-N 3.19Å; A645-A648 PolarHBondContact O-N 3.36Å; A645-L649 WeakPolarHBondContact O-CB 3.13Å; A645-L649 VanDerWaalsContact O-CG 3.22Å; A645-L649 WeakPolarHBondContact O-CG 3Å; A645-L649 PolarHBondContact O-N 3.06Å
646	E	90.4	Very high	85.9	Confident	131 Å²	131	73.4 Å²	73.4	61%	0.612	36%	0.363	S	S	*	.	H	α-helix	trans	-62.9	-40.4	178.7	-64.7	-177.7	-171.1	0	0	112.1	S644 R650	S644-E646 VanDerWaalsContact C-N 3.28Å; S644-E646 PolarHBondContact O-N 2.99Å; S644-E646 PolarHBondContact OG-N 3.19Å; E646-R650 VanDerWaalsContact O-CG 3.28Å; E646-R650 WeakPolarHBondContact O-CG 3.45Å; E646-R650 PolarHBondContact O-N 3.08Å; E646-R650 IonicContact OE2-NH2 3.96Å
647	E	91.9	Very high	85.2	Confident	81 Å²	81	73.9 Å²	73.9	38%	0.379	37%	0.366	S	S	.	.	H	α-helix	trans	-64.9	-47.9	177.3	-174.7	175.2	-169.5	0	0	110.9	C642 R643 S644 A645 L649 R650 M651	C642-E647 HydrophobicContact CB-CB 4.48Å; C642-E647 HydrophobicContact CB-CG 4.41Å; R643-E647 PolarHBondContact N-OE2 3.24Å; S644-E647 PolarHBondContact O-N 3.23Å; S644-E647 PolarHBondContact OG-N 3.15Å; A645-E647 VanDerWaalsContact C-N 3.33Å; A645-E647 PolarHBondContact O-N 3.19Å; E647-L649 VanDerWaalsContact C-N 3.34Å; E647-L649 PolarHBondContact O-N 3.24Å; E647-R650 PolarHBondContact O-N 2.96Å; E647-M651 WeakPolarHBondContact O-CG 3.28Å; E647-M651 PolarHBondContact O-N 3.09Å
648	A	89.1	Confident	84.5	Confident	1 Å²	1	78.1 Å²	78.1	1%	0.008	39%	0.387	C	S	.	.	H	α-helix	trans	-60.2	-41.8	177.2	0	0	0	0	0	112.5	L294 C642 S644 A645 M651	L294-A648 HydrophobicContact CD1-CB 3.72Å; L294-A648 HydrophobicContact CD2-CB 4.38Å; C642-A648 HydrophobicContact CB-CB 4.06Å; S644-A648 PolarHBondContact O-N 3.34Å; A645-A648 PolarHBondContact O-N 3.36Å; A648-M651 WeakPolarHBondContact O-CB 3.28Å; A648-M651 PolarHBondContact O-N 2.95Å
649	L	86.5	Confident	83.8	Confident	59 Å²	59	78.2 Å²	78.2	31%	0.309	39%	0.389	S	S	.	.	H	α-helix	trans	-72.9	-28.4	179.3	-67.9	173	0	0	0	113.2	L294 N297 A645 E647 M651 F652 A653	L294-L649 HydrophobicContact CD1-CG 4.5Å; N297-L649 HydrophobicContact CB-CD2 3.62Å; A645-L649 WeakPolarHBondContact O-CB 3.13Å; A645-L649 VanDerWaalsContact O-CG 3.22Å; A645-L649 WeakPolarHBondContact O-CG 3Å; A645-L649 PolarHBondContact O-N 3.06Å; E647-L649 VanDerWaalsContact C-N 3.34Å; E647-L649 PolarHBondContact O-N 3.24Å; L649-M651 VanDerWaalsContact C-N 3.29Å; L649-F652 PolarHBondContact O-N 3.34Å; L649-A653 PolarHBondContact O-N 3.06Å
650	R	86	Confident	82.9	Confident	172 Å²	172	83.2 Å²	83.2	65%	0.649	41%	0.414	S	S	*	.	H	α-helix	trans	-66.4	-34.3	172.4	-78.5	177.3	-164.9	-177.2	8.8	111.9	E646 E647 F652 A653	E646-R650 VanDerWaalsContact O-CG 3.28Å; E646-R650 WeakPolarHBondContact O-CG 3.45Å; E646-R650 PolarHBondContact O-N 3.08Å; E646-R650 IonicContact OE2-NH2 3.96Å; E647-R650 PolarHBondContact O-N 2.96Å; R650-F652 PolarHBondContact O-N 3.4Å; R650-A653 PolarHBondContact O-N 3.23Å; R650-A653 VanDerWaalsContact O-N 3.14Å
651	M	76.3	Confident	82.1	Confident	76 Å²	76	86.6 Å²	86.6	37%	0.374	43%	0.43	S	S	.	.	H	α-helix	trans	-65.2	-24.7	176.5	-66.7	177.1	52.1	0	0	112.9	P262 Q306 E647 A648 L649	P262-M651 HydrophobicContact CB-CE 4.03Å; P262-M651 HydrophobicContact CB-SD 4.35Å; P262-M651 HydrophobicContact CG-CE 3.94Å; Q306-M651 VanDerWaalsContact CD-CE 3.45Å; Q306-M651 VanDerWaalsContact NE2-CE 3.3Å; E647-M651 WeakPolarHBondContact O-CG 3.28Å; E647-M651 PolarHBondContact O-N 3.09Å; A648-M651 WeakPolarHBondContact O-CB 3.28Å; A648-M651 PolarHBondContact O-N 2.95Å; L649-M651 VanDerWaalsContact C-N 3.29Å
652	F	66.9	Low	81.3	Confident	107 Å²	107	87.7 Å²	87.7	47%	0.469	44%	0.437	S	S	.	.	H	α-helix	trans	-79.6	-25.7	173.3	175.1	-100.1	0	0	0	113.6	L300 L649 R650 V654	L300-F652 HydrophobicContact CB-CD2 4.03Å; L300-F652 HydrophobicContact CB-CE1 4.47Å; L300-F652 HydrophobicContact CB-CE2 3.68Å; L300-F652 HydrophobicContact CB-CZ 3.92Å; L300-F652 HydrophobicContact CD1-CE1 4.3Å; L300-F652 HydrophobicContact CD1-CZ 4.22Å; L300-F652 HydrophobicContact CD2-CE2 4.46Å; L300-F652 HydrophobicContact CD2-CZ 4.18Å; L300-F652 HydrophobicContact CG-CZ 4.33Å; L300-F652 WeakPolarHBondContact O-CD2 3.38Å; L300-F652 WeakPolarHBondContact O-CE2 3.41Å; L649-F652 PolarHBondContact O-N 3.34Å; R650-F652 PolarHBondContact O-N 3.4Å; F652-V654 VanDerWaalsContact C-N 3.3Å; F652-V654 PolarHBondContact O-N 3.38Å
653	A	57.7	Low	80.4	Confident	81 Å²	81	94.3 Å²	94.3	67%	0.669	47%	0.468	S	S	*	.			trans	-88	9.7	-169.5	0	0	0	0	0	114.6	L649 R650	L649-A653 PolarHBondContact O-N 3.06Å; R650-A653 PolarHBondContact O-N 3.23Å; R650-A653 VanDerWaalsContact O-N 3.14Å
654	V	42.6	Very low	79.3	Confident	191 Å²	191	84.7 Å²	84.7	100%	1.158	44%	0.443	S	S	*	.			trans	-103.4	0	-177.3	178.2	0	0	0	0	110.6	F652	F652-V654 VanDerWaalsContact C-N 3.3Å; F652-V654 PolarHBondContact O-N 3.38Å

Retrieved 654 of 654 residues in 1156.1 ms (Link to these results)

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