A0A087XX19_POEFO Loading...

CCM2 scaffold protein

AlphaFold DB , UniProt , Accession A0A087XX19, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 458 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	34.5	Very low	36.8	Very low	241 Å²	241	168.4 Å²	168.4	100%	1.187	84%	0.835	S	S	*	*				0	123.5	0	-89.5	166.8	164.7	0	0	107
2	E	33	Very low	36.5	Very low	187 Å²	187	159.4 Å²	159.4	87%	0.874	82%	0.817	S	S	*	*			trans	-45.7	142.8	158.3	-68.7	154.7	115.1	0	0	110
3	E	36.8	Very low	36.8	Very low	192 Å²	192	159.9 Å²	159.9	90%	0.897	82%	0.82	S	S	*	*				-163.7	131.2	113.3	-110.9	-170.6	143	0	0	111.8
4	D	34.1	Very low	36.4	Very low	132 Å²	132	157.6 Å²	157.6	71%	0.706	82%	0.816	S	S	*	*			trans	-70.8	156.8	170.3	-136.8	-72.1	0	0	0	110
5	V	38	Very low	36.5	Very low	131 Å²	131	153.5 Å²	153.5	79%	0.794	81%	0.807	S	S	*	*				176.4	104.1	121.9	168	0	0	0	0	110.2
6	K	39.7	Very low	37.2	Very low	163 Å²	163	151.2 Å²	151.2	71%	0.709	80%	0.804	S	S	*	*			trans	36.8	110.8	134.9	-67	172	179.1	170	0	119.2
7	K	36.9	Very low	37.7	Very low	180 Å²	180	153.4 Å²	153.4	78%	0.783	81%	0.805	S	S	*	*				68.1	114	85.1	-77.5	-176.7	-179.3	171.5	0	115.1
8	V	34.4	Very low	37.7	Very low	152 Å²	152	156.1 Å²	156.1	92%	0.921	81%	0.809	S	S	*	*				-142.5	127.5	118.9	176.4	0	0	0	0	110
9	K	34.1	Very low	38.3	Very low	168 Å²	168	159.2 Å²	159.2	73%	0.73	81%	0.809	S	S	*	*			trans	-79.3	148.3	172.5	-87.3	175.2	170.2	-178.6	0	109.2
10	K	38.2	Very low	38.3	Very low	190 Å²	190	157.6 Å²	157.6	83%	0.826	81%	0.807	S	S	*	*				176	171.6	75.1	-123.9	174.1	-169.6	-171.4	0	109.2
11	P	44.8	Very low	38.4	Very low	116 Å²	116	158.5 Å²	158.5	75%	0.753	81%	0.806	S	S	*	*				-113.3	164	-120.6	14.4	13.1	0	0	0	112.2
12	G	33	Very low	38.7	Very low	61 Å²	61	154.9 Å²	154.9	63%	0.629	79%	0.79	S	S	*	*				82.2	118.7	71.6	0	0	0	0	0	109.6
13	I	41.3	Very low	38.9	Very low	166 Å²	166	156 Å²	156	85%	0.851	79%	0.792	S	S	*	*				-170.1	108.7	85.9	-79.6	147.1	0	0	0	105.9
14	V	30.9	Very low	38.8	Very low	127 Å²	127	150.4 Å²	150.4	77%	0.77	79%	0.786	S	S	*	*				68.5	100.2	84.8	-175.3	0	0	0	0	114.5
15	S	38.5	Very low	38.8	Very low	96 Å²	96	153.2 Å²	153.2	67%	0.671	80%	0.795	S	S	*	*			trans	-68.8	157.8	150.5	-164	0	0	0	0	109.5
16	P	46.5	Very low	38.9	Very low	117 Å²	117	156.4 Å²	156.4	76%	0.76	80%	0.798	S	S	*	*				-159.3	163.9	85.9	37	-14.1	0	0	0	118.2
17	F	45.5	Very low	38.7	Very low	188 Å²	188	152 Å²	152	83%	0.825	80%	0.798	S	S	*	*			trans	-35.2	145.7	160.4	-70.4	-101.3	0	0	0	117.2
18	K	38.8	Very low	39.3	Very low	202 Å²	202	154.4 Å²	154.4	88%	0.878	80%	0.803	S	S	*	*				-166.8	122	123.4	-115.7	171.8	-179.2	175.3	0	113.3
19	R	48.8	Very low	39.5	Very low	216 Å²	216	154.3 Å²	154.3	82%	0.815	80%	0.797	S	S	*	*			trans	-88.9	131.8	167.3	-178.7	-174.2	-66.3	157.8	-1.7	108.2	F21	R19-F21 HydrophobicContact CG-CD2 4.08Å; R19-F21 HydrophobicContact CG-CE2 4.28Å
20	V	39.1	Very low	40.1	Very low	126 Å²	126	156.5 Å²	156.5	76%	0.764	81%	0.807	S	S	*	*			trans	-139.6	117.2	162.9	-168.6	0	0	0	0	108.1
21	F	39.5	Very low	40.1	Very low	177 Å²	177	156.7 Å²	156.7	78%	0.776	81%	0.807	S	S	*	*			trans	-99.3	130.4	168.6	-89.7	-91	0	0	0	108.6	R19	R19-F21 HydrophobicContact CG-CD2 4.08Å; R19-F21 HydrophobicContact CG-CE2 4.28Å
22	L	40.1	Very low	39.9	Very low	165 Å²	165	155.4 Å²	155.4	86%	0.864	81%	0.806	S	S	*	*			trans	-146.8	103.3	153.3	-86.2	173.5	0	0	0	110.4
23	K	38.9	Very low	40.1	Very low	211 Å²	211	160.8 Å²	160.8	92%	0.917	82%	0.815	S	S	*	*			trans	22.5	116.4	134.7	-156.1	163.3	-178.3	172.9	0	118.3
24	G	33.7	Very low	40.2	Very low	74 Å²	74	161.1 Å²	161.1	76%	0.763	81%	0.813	S	S	*	*			trans	-152.2	142.3	164.3	0	0	0	0	0	110.3
25	E	34.7	Very low	40.8	Very low	191 Å²	191	163.7 Å²	163.7	89%	0.893	81%	0.814	S	S	*	*			trans	-73.1	143.4	-157.9	-71.6	161.6	78.5	0	0	117.6
26	K	40.4	Very low	41.3	Very low	199 Å²	199	164.3 Å²	164.3	87%	0.865	82%	0.819	S	S	*	*			trans	30.9	91	132.9	-145.8	179.6	-169.7	179.5	0	117.9
27	G	35.5	Very low	41.9	Very low	69 Å²	69	164.3 Å²	164.3	71%	0.711	82%	0.816	S	S	*	*			trans	-120	110.6	156.6	0	0	0	0	0	109.9	D29	G27-D29 PolarHBondContact O-N 3.34Å
28	R	47.7	Very low	43.4	Very low	231 Å²	231	164.3 Å²	164.3	87%	0.872	82%	0.819	S	S	*	*			trans	-73.9	104.9	166.3	-83.8	176.2	174.6	154.3	-4.4	107.2
29	D	40.2	Very low	45.8	Very low	150 Å²	150	159.2 Å²	159.2	80%	0.802	79%	0.794	S	S	*	*			trans	-126.9	94.8	154.2	-76.3	-50.8	0	0	0	107.4	G27 K31	G27-D29 PolarHBondContact O-N 3.34Å; D29-K31 PolarHBondContact O-N 3.4Å
30	K	46.5	Very low	47.9	Very low	215 Å²	215	153.8 Å²	153.8	94%	0.935	77%	0.774	S	S	*	*			trans	-67	80.1	155.7	-77.7	-176.4	173.6	-177.6	0	105.7	A32	K30-A32 VanDerWaalsContact C-N 3.3Å; K30-A32 PolarHBondContact O-N 2.85Å
31	K	38.1	Very low	50.4	Low	193 Å²	193	151.6 Å²	151.6	84%	0.839	77%	0.769	S	S	*	*			trans	-64.3	101.7	165.4	-152.2	175.3	-173.9	-177.2	0	104.7	D29 Q33	D29-K31 PolarHBondContact O-N 3.4Å; K31-Q33 PolarHBondContact O-N 2.93Å
32	A	39.4	Very low	53	Low	89 Å²	89	144.8 Å²	144.8	74%	0.736	74%	0.741	S	S	*	*			trans	-50.6	111.3	166.2	0	0	0	0	0	105.4	K30 E34	K30-A32 VanDerWaalsContact C-N 3.3Å; K30-A32 PolarHBondContact O-N 2.85Å; A32-E34 PolarHBondContact O-N 3.29Å
33	Q	38.8	Very low	55.6	Low	175 Å²	175	139.6 Å²	139.6	82%	0.818	71%	0.712	S	S	*	*			trans	-69.9	85.5	170.3	-171.5	173.5	-8.4	0	0	104.4	K31 K35	K31-Q33 PolarHBondContact O-N 2.93Å; Q33-K35 VanDerWaalsContact C-N 3.27Å; Q33-K35 PolarHBondContact O-N 3.28Å
34	E	42.7	Very low	58.1	Low	173 Å²	173	133.3 Å²	133.3	81%	0.808	69%	0.691	S	S	*	*			trans	-54	102.5	161.8	-168.9	172.9	-164.7	0	0	104.6	A32 S36	A32-E34 PolarHBondContact O-N 3.29Å; E34-S36 PolarHBondContact O-N 3.16Å
35	K	43	Very low	60.6	Low	180 Å²	180	132.7 Å²	132.7	78%	0.783	67%	0.668	S	S	*	*			trans	-66.2	88.3	169.9	-79.6	-179	174.2	-176.8	0	104.9	Q33 T37	Q33-K35 VanDerWaalsContact C-N 3.27Å; Q33-K35 PolarHBondContact O-N 3.28Å; K35-T37 PolarHBondContact O-N 3.26Å
36	S	49.6	Very low	62.8	Low	110 Å²	110	129.7 Å²	129.7	77%	0.769	67%	0.667	S	S	*	*			trans	-66.1	82	160	58.4	0	0	0	0	106	E34 E38	E34-S36 PolarHBondContact O-N 3.16Å; S36-E38 PolarHBondContact O-N 2.82Å; S36-E38 VanDerWaalsContact O-N 3.13Å
37	T	59.8	Low	64.7	Low	116 Å²	116	121.8 Å²	121.8	71%	0.712	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-57.8	116	164.8	-45.1	0	0	0	0	105.1	K35 R39	K35-T37 PolarHBondContact O-N 3.26Å; T37-R39 PolarHBondContact O-N 2.9Å
38	E	76.4	Confident	66.3	Low	189 Å²	189	121.6 Å²	121.6	88%	0.883	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-60	119.8	-178.4	-168.4	171.9	-177.5	0	0	108.6	S36	S36-E38 PolarHBondContact O-N 2.82Å; S36-E38 VanDerWaalsContact O-N 3.13Å
39	R	88.4	Confident	67.4	Low	94 Å²	94	118.7 Å²	118.7	36%	0.355	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-69.8	142.1	-177.1	-73.9	173.4	169.1	179.1	0.3	110	T37 D111 R126 D127	T37-R39 PolarHBondContact O-N 2.9Å; R39-D111 IonicContact CZ-OD2 2.74Å; R39-D111 VanDerWaalsContact CZ-OD2 3.29Å; R39-D111 IonicContact NH1-OD2 2.54Å; R39-D111 PolarHBondContact NH1-OD2 3.26Å; R39-D111 IonicContact NH2-OD2 3.81Å; R39-D111 PolarHBondContact NH2-OD2 3.38Å; R39-R126 HydrophobicContact CG-CG 4.36Å; R39-D127 IonicContact CZ-OD1 2.86Å; R39-D127 IonicContact CZ-OD2 3.57Å; R39-D127 IonicContact NE-OD1 2.89Å; R39-D127 PolarHBondContact NE-OD1 3.17Å; R39-D127 IonicContact NE-OD2 3.24Å; R39-D127 IonicContact NH2-OD1 2.93Å; R39-D127 PolarHBondContact NH2-OD1 3.36Å; R39-D127 IonicContact NH2-OD2 3.51Å; R39-D127 PolarHBondContact NH2-OD2 3.35Å
40	R	92.9	Very high	68.5	Low	102 Å²	102	116.6 Å²	116.6	39%	0.385	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-59.9	138.8	177.8	-172.6	-168.3	56.5	97.2	-12.1	110.9	E65 R126 E129	R40-E65 IonicContact CZ-OE1 3.93Å; R40-E65 IonicContact CZ-OE2 2.85Å; R40-E65 IonicContact NH1-OE1 2.82Å; R40-E65 IonicContact NH1-OE2 3.81Å; R40-E65 PolarHBondContact NH1-OE2 3.43Å; R40-E65 IonicContact NH2-OE1 2.81Å; R40-E65 PolarHBondContact NH2-OE1 3.22Å; R40-E65 IonicContact NH2-OE2 3.24Å; R40-E65 PolarHBondContact NH2-OE2 3.08Å; R40-R126 PolarHBondContact O-NH1 2.83Å; R40-R126 PolarHBondContact O-NH2 2.84Å; R40-E129 IonicContact CZ-OE1 3.79Å; R40-E129 IonicContact NE-OE1 3.42Å; R40-E129 PolarHBondContact NE-OE1 2.95Å; R40-E129 IonicContact NH2-OE1 3.16Å
41	A	92.3	Very high	69.4	Low	80 Å²	80	110 Å²	110	66%	0.661	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-60	141	169.9	0	0	0	0	0	111.2
42	L	94.4	Very high	71	Confident	35 Å²	35	102.6 Å²	102.6	18%	0.183	56%	0.557	C	S	.	*	P	Polyproline II helix	trans	-75	146.4	177.9	-67.3	-167.2	0	0	0	112	T44 E65 E67 V113 R126	L42-T44 HydrophobicContact CB-CG2 3.73Å; L42-T44 PolarHBondContact O-N 3.36Å; L42-E65 HydrophobicContact CB-CB 4.07Å; L42-E65 HydrophobicContact CD1-CB 4.38Å; L42-E65 HydrophobicContact CD2-CB 4.11Å; L42-E65 HydrophobicContact CG-CB 4.43Å; L42-E67 HydrophobicContact CD1-CB 4.35Å; L42-E67 HydrophobicContact CD1-CG 3.39Å; L42-E67 HydrophobicContact CD2-CG 4.49Å; L42-E67 HydrophobicContact CG-CG 4.15Å; L42-V113 HydrophobicContact CD2-CB 4.42Å; L42-V113 HydrophobicContact CD2-CG1 3.75Å; L42-V113 HydrophobicContact CD2-CG2 3.73Å; L42-R126 VanDerWaalsContact CD2-NH1 3.3Å
43	H	94.2	Very high	72.7	Confident	55 Å²	55	105.4 Å²	105.4	26%	0.255	55%	0.548	S	S	.	.			trans	-74.2	102.5	169	-165.2	43.9	0	0	0	109.6	F45 D62 Y63 E65	H43-F45 AromaticContact CE1-CE2 3.96Å; H43-F45 AromaticContact CE1-CZ 3.78Å; H43-F45 AromaticContact NE2-CE2 3.64Å; H43-F45 AromaticContact NE2-CZ 3.63Å; H43-D62 IonicContact CD2-OD1 3.03Å; H43-D62 IonicContact CE1-OD2 3.37Å; H43-D62 VanDerWaalsContact NE2-CG 3.27Å; H43-D62 IonicContact NE2-OD1 3.06Å; H43-D62 PolarHBondContact NE2-OD1 3.27Å; H43-D62 IonicContact NE2-OD2 3.31Å; H43-D62 PolarHBondContact NE2-OD2 3.04Å; H43-Y63 HydrophobicContact CB-CD2 4.38Å; H43-Y63 HydrophobicContact CB-CE2 3.78Å; H43-Y63 AromaticContact CD2-CD2 3.76Å; H43-Y63 AromaticContact CD2-CE2 3.59Å; H43-Y63 AromaticContact CD2-CZ 3.75Å; H43-Y63 PolarHBondContact CD2-O 3.13Å; H43-Y63 PolarHBondContact NE2-O 3.29Å; H43-E65 HydrophobicContact CB-CB 4.42Å; H43-E65 HydrophobicContact CB-CG 4.07Å; H43-E65 PolarHBondContact N-OE2 3.38Å; H43-E65 WeakPolarHBondContact O-CB 3.31Å; H43-E65 PolarHBondContact O-N 2.88Å
44	T	92.1	Very high	74.7	Confident	79 Å²	79	97.9 Å²	97.9	49%	0.485	51%	0.513	S	S	.	.			trans	-134.1	150.5	-171.4	56.5	0	0	0	0	111.3	L42	L42-T44 HydrophobicContact CB-CG2 3.73Å; L42-T44 PolarHBondContact O-N 3.36Å
45	F	86.4	Confident	76.1	Confident	62 Å²	62	96 Å²	96	27%	0.272	51%	0.505	S	S	.	.			trans	-120.9	156.7	179	-65.7	-94.7	0	0	0	110.7	H43 L47 I58 D62 Y63 I64	H43-F45 AromaticContact CE1-CE2 3.96Å; H43-F45 AromaticContact CE1-CZ 3.78Å; H43-F45 AromaticContact NE2-CE2 3.64Å; H43-F45 AromaticContact NE2-CZ 3.63Å; F45-L47 PolarHBondContact O-N 3.41Å; F45-I58 HydrophobicContact CD1-CD1 3.84Å; F45-I58 HydrophobicContact CD1-CG2 4.19Å; F45-I58 HydrophobicContact CD2-CG2 3.99Å; F45-I58 HydrophobicContact CE1-CD1 4.07Å; F45-I58 HydrophobicContact CE1-CG1 4.42Å; F45-I58 HydrophobicContact CE1-CG2 3.85Å; F45-I58 HydrophobicContact CE2-CG2 3.65Å; F45-I58 HydrophobicContact CG-CD1 4.41Å; F45-I58 HydrophobicContact CG-CG2 4.24Å; F45-I58 HydrophobicContact CZ-CG2 3.57Å; F45-D62 WeakPolarHBondContact CZ-OD2 3.4Å; F45-Y63 WeakPolarHBondContact CE2-O 3.14Å; F45-I64 HydrophobicContact CD2-CD1 4.09Å; F45-I64 HydrophobicContact CD2-CG1 3.78Å; F45-I64 HydrophobicContact CE2-CG1 4.11Å
46	S	81.1	Confident	77.6	Confident	127 Å²	127	90.7 Å²	90.7	89%	0.888	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-74.9	118.7	174.2	-65.7	0	0	0	0	109.7
47	L	78.8	Confident	78.5	Confident	33 Å²	33	90.5 Å²	90.5	17%	0.173	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-97.4	132.4	-177.5	-51.2	-177.8	0	0	0	110.3	F45 Q49 H52 I54 E209 L213	F45-L47 PolarHBondContact O-N 3.41Å; L47-Q49 PolarHBondContact O-N 2.87Å; L47-H52 HydrophobicContact CB-CB 4.12Å; L47-H52 HydrophobicContact CD1-CB 4.02Å; L47-I54 HydrophobicContact CD2-CD1 3.36Å; L47-I54 HydrophobicContact CD2-CG1 3.17Å; L47-E209 HydrophobicContact CD1-CG 3.94Å; L47-E209 WeakPolarHBondContact CD1-OE1 3.3Å; L47-L213 HydrophobicContact CD1-CD2 4.35Å
48	S	70.4	Confident	79.4	Confident	66 Å²	66	86.6 Å²	86.6	46%	0.462	45%	0.453	S	S	.	.	B	Isolated β-bridge	trans	-74.3	121.9	175.9	63.9	0	0	0	0	110.4	H52 R53	S48-H52 VanDerWaalsContact O-CA 3.24Å; S48-H52 WeakPolarHBondContact O-CA 3.43Å; S48-H52 PolarHBondContact O-N 3.46Å; S48-R53 PolarHBondContact O-N 2.81Å; S48-R53 WeakPolarHBondContact OG-CB 3.46Å
49	Q	69.6	Low	79.5	Confident	169 Å²	169	77.6 Å²	77.6	79%	0.79	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	150.6	174.1	-67.4	-175.9	-10.6	0	0	111.1	L47	L47-Q49 PolarHBondContact O-N 2.87Å
50	P	62.8	Low	78.9	Confident	107 Å²	107	74.7 Å²	74.7	70%	0.695	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	cis	-89.5	-16.1	3.5	34.1	-34.1	0	0	0	115	H52	P50-H52 VanDerWaalsContact C-N 3.3Å; P50-H52 PolarHBondContact O-N 2.85Å; P50-H52 PolarHBondContact O-ND1 3.24Å; P50-H52 VanDerWaalsContact O-ND1 3.08Å
51	D	65.6	Low	78.2	Confident	77 Å²	77	76.2 Å²	76.2	41%	0.412	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-1.9	-170.8	-67.6	-13.2	0	0	0	114	R53	D51-R53 HydrophobicContact CB-CG 3.72Å; D51-R53 PolarHBondContact O-N 3.22Å; D51-R53 IonicContact OD2-CZ 2.8Å; D51-R53 IonicContact OD2-NE 2.8Å; D51-R53 PolarHBondContact OD2-NE 3.46Å; D51-R53 IonicContact OD2-NH2 3.14Å; D51-R53 PolarHBondContact OD2-NH2 3.46Å
52	H	72.4	Confident	77.9	Confident	36 Å²	36	75.1 Å²	75.1	17%	0.167	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	40.1	-176	-59.8	82	0	0	0	112.6	L47 S48 P50 L212 Q216	L47-H52 HydrophobicContact CB-CB 4.12Å; L47-H52 HydrophobicContact CD1-CB 4.02Å; S48-H52 VanDerWaalsContact O-CA 3.24Å; S48-H52 WeakPolarHBondContact O-CA 3.43Å; S48-H52 PolarHBondContact O-N 3.46Å; P50-H52 VanDerWaalsContact C-N 3.3Å; P50-H52 PolarHBondContact O-N 2.85Å; P50-H52 PolarHBondContact O-ND1 3.24Å; P50-H52 VanDerWaalsContact O-ND1 3.08Å; H52-L212 HydrophobicContact CB-CD1 4.31Å; H52-Q216 PolarHBondContact O-NE2 2.96Å
53	R	74.8	Confident	77.7	Confident	149 Å²	149	77.5 Å²	77.5	56%	0.562	41%	0.408	S	S	*	.	B	Isolated β-bridge	trans	-66.3	140.7	-177.2	-57.3	-165	-179.6	-160.6	-3.7	111.4	S48 D51	S48-R53 PolarHBondContact O-N 2.81Å; S48-R53 WeakPolarHBondContact OG-CB 3.46Å; D51-R53 HydrophobicContact CB-CG 3.72Å; D51-R53 PolarHBondContact O-N 3.22Å; D51-R53 IonicContact OD2-CZ 2.8Å; D51-R53 IonicContact OD2-NE 2.8Å; D51-R53 PolarHBondContact OD2-NE 3.46Å; D51-R53 IonicContact OD2-NH2 3.14Å; D51-R53 PolarHBondContact OD2-NH2 3.46Å
54	I	80.3	Confident	77.7	Confident	16 Å²	16	74.9 Å²	74.9	8%	0.082	40%	0.397	C	S	.	.			trans	-122.4	146.4	173.4	-74.1	144.5	0	0	0	108.7	L47 P56 I58 L59 I64 L213	L47-I54 HydrophobicContact CD2-CD1 3.36Å; L47-I54 HydrophobicContact CD2-CG1 3.17Å; I54-P56 WeakPolarHBondContact O-CD 3.49Å; I54-I58 HydrophobicContact CG2-CB 3.89Å; I54-I58 HydrophobicContact CG2-CD1 4.14Å; I54-I58 HydrophobicContact CG2-CG2 4.25Å; I54-L59 HydrophobicContact CG2-CD1 4.33Å; I54-L59 HydrophobicContact CG2-CG 4.05Å; I54-I64 HydrophobicContact CD1-CD1 3.22Å; I54-I64 HydrophobicContact CG1-CD1 3.93Å; I54-I64 HydrophobicContact CG2-CD1 4.15Å; I54-L213 HydrophobicContact CD1-CD2 2.99Å; I54-L213 HydrophobicContact CD1-CG 4.47Å; I54-L213 HydrophobicContact CG1-CD2 4.4Å
55	E	72.1	Confident	78	Confident	135 Å²	135	71.6 Å²	71.6	63%	0.631	38%	0.376	S	S	*	.			trans	-61.8	122.3	169.8	-71.8	176.5	-176.8	0	0	109.5	D57 I58	E55-D57 PolarHBondContact O-N 3.28Å; E55-D57 VanDerWaalsContact O-N 3.07Å; E55-I58 HydrophobicContact CB-CD1 4.08Å; E55-I58 HydrophobicContact CB-CG1 4.28Å; E55-I58 WeakPolarHBondContact O-CB 3.23Å; E55-I58 PolarHBondContact O-N 3.09Å
56	P	74.7	Confident	78.5	Confident	68 Å²	68	70.4 Å²	70.4	44%	0.442	37%	0.37	S	S	.	.	H	α-helix	trans	-51.7	-35.5	-176.1	-30	36.4	0	0	0	114.1	I54 I58 L59 L60 I220	I54-P56 WeakPolarHBondContact O-CD 3.49Å; P56-I58 PolarHBondContact O-N 3.3Å; P56-I58 VanDerWaalsContact O-N 3.17Å; P56-L59 PolarHBondContact O-N 3.4Å; P56-L60 PolarHBondContact O-N 2.9Å; P56-I220 HydrophobicContact CB-CD1 3.89Å; P56-I220 HydrophobicContact CB-CG1 4.19Å
57	D	68.1	Low	79.2	Confident	105 Å²	105	69 Å²	69	56%	0.561	35%	0.35	S	S	*	.	H	α-helix	trans	-57.5	-29.9	178.9	-64	-18.3	0	0	0	113.2	E55 N61	E55-D57 PolarHBondContact O-N 3.28Å; E55-D57 VanDerWaalsContact O-N 3.07Å; D57-N61 WeakPolarHBondContact O-CB 3.48Å; D57-N61 PolarHBondContact O-N 3.08Å; D57-N61 PolarHBondContact O-ND2 2.91Å
58	I	79.1	Confident	80.1	Confident	34 Å²	34	67.8 Å²	67.8	17%	0.174	34%	0.344	C	S	.	.	H	α-helix	trans	-68.3	-42.8	175.2	-62.6	171.3	0	0	0	110.1	F45 I54 E55 P56 L60 D62	F45-I58 HydrophobicContact CD1-CD1 3.84Å; F45-I58 HydrophobicContact CD1-CG2 4.19Å; F45-I58 HydrophobicContact CD2-CG2 3.99Å; F45-I58 HydrophobicContact CE1-CD1 4.07Å; F45-I58 HydrophobicContact CE1-CG1 4.42Å; F45-I58 HydrophobicContact CE1-CG2 3.85Å; F45-I58 HydrophobicContact CE2-CG2 3.65Å; F45-I58 HydrophobicContact CG-CD1 4.41Å; F45-I58 HydrophobicContact CG-CG2 4.24Å; F45-I58 HydrophobicContact CZ-CG2 3.57Å; I54-I58 HydrophobicContact CG2-CB 3.89Å; I54-I58 HydrophobicContact CG2-CD1 4.14Å; I54-I58 HydrophobicContact CG2-CG2 4.25Å; E55-I58 HydrophobicContact CB-CD1 4.08Å; E55-I58 HydrophobicContact CB-CG1 4.28Å; E55-I58 WeakPolarHBondContact O-CB 3.23Å; E55-I58 PolarHBondContact O-N 3.09Å; P56-I58 PolarHBondContact O-N 3.3Å; P56-I58 VanDerWaalsContact O-N 3.17Å; I58-L60 VanDerWaalsContact C-N 3.32Å; I58-D62 HydrophobicContact CG2-CB 4.35Å; I58-D62 CarbonylContact O-C 3.48Å; I58-D62 WeakPolarHBondContact O-CA 3.45Å; I58-D62 WeakPolarHBondContact O-CB 3.5Å; I58-D62 PolarHBondContact O-N 3.18Å
59	L	79.6	Confident	81.4	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-74.7	-26.5	-179.8	-67.5	172.2	0	0	0	112.2	I54 P56 I64 A118 Q216 V217 I220	I54-L59 HydrophobicContact CG2-CD1 4.33Å; I54-L59 HydrophobicContact CG2-CG 4.05Å; P56-L59 PolarHBondContact O-N 3.4Å; L59-I64 HydrophobicContact CD2-CD1 3.84Å; L59-I64 HydrophobicContact CD2-CG1 4.04Å; L59-A118 VanDerWaalsContact O-CB 3.27Å; L59-A118 WeakPolarHBondContact O-CB 3.38Å; L59-A118 PolarHBondContact O-N 2.69Å; L59-Q216 HydrophobicContact CD1-CB 4.21Å; L59-V217 HydrophobicContact CD1-CG2 3.9Å; L59-V217 HydrophobicContact CD2-CG2 4.07Å; L59-V217 HydrophobicContact CG-CG2 4.44Å; L59-I220 HydrophobicContact CB-CD1 3.81Å; L59-I220 HydrophobicContact CD1-CD1 3.71Å; L59-I220 HydrophobicContact CG-CD1 4.38Å
60	L	75.9	Confident	82.7	Confident	33 Å²	33	60.1 Å²	60.1	17%	0.173	30%	0.299	C	S	.	.	H	α-helix	trans	-76	-47.5	176.3	-73.4	169.8	0	0	0	112.3	P56 I58 A118 Y119 I220 E224	P56-L60 PolarHBondContact O-N 2.9Å; I58-L60 VanDerWaalsContact C-N 3.32Å; L60-A118 HydrophobicContact CD2-CB 3.88Å; L60-Y119 VanDerWaalsContact O-CE2 3.28Å; L60-Y119 WeakPolarHBondContact O-CE2 3.26Å; L60-Y119 PolarHBondContact O-OH 2.83Å; L60-I220 HydrophobicContact CD1-CG2 4.34Å; L60-I220 HydrophobicContact CD2-CG2 3.51Å; L60-I220 HydrophobicContact CG-CG2 3.91Å; L60-E224 WeakPolarHBondContact CD2-OE2 3.27Å
61	N	76.6	Confident	84.3	Confident	134 Å²	134	55.3 Å²	55.3	72%	0.717	27%	0.267	S	S	*	.	H	α-helix	trans	-103.7	-10.8	-171.7	-58.2	-64.9	0	0	0	114	D57	D57-N61 WeakPolarHBondContact O-CB 3.48Å; D57-N61 PolarHBondContact O-N 3.08Å; D57-N61 PolarHBondContact O-ND2 2.91Å
62	D	86.8	Confident	85.8	Confident	57 Å²	57	52 Å²	52	31%	0.305	25%	0.252	S	S	.	.	S	Bend	trans	-139.2	-164	-178.3	-157.9	-8.5	0	0	0	110.7	H43 F45 I58	H43-D62 IonicContact CD2-OD1 3.03Å; H43-D62 IonicContact CE1-OD2 3.37Å; H43-D62 VanDerWaalsContact NE2-CG 3.27Å; H43-D62 IonicContact NE2-OD1 3.06Å; H43-D62 PolarHBondContact NE2-OD1 3.27Å; H43-D62 IonicContact NE2-OD2 3.31Å; H43-D62 PolarHBondContact NE2-OD2 3.04Å; F45-D62 WeakPolarHBondContact CZ-OD2 3.4Å; I58-D62 HydrophobicContact CG2-CB 4.35Å; I58-D62 CarbonylContact O-C 3.48Å; I58-D62 WeakPolarHBondContact O-CA 3.45Å; I58-D62 WeakPolarHBondContact O-CB 3.5Å; I58-D62 PolarHBondContact O-N 3.18Å
63	Y	90.9	Very high	86.9	Confident	84 Å²	84	53.7 Å²	53.7	33%	0.329	26%	0.259	S	S	.	.			trans	-144.2	163.5	-179.6	62.9	-86.8	0	0	0	112.6	H43 F45 E65 S115 L116	H43-Y63 HydrophobicContact CB-CD2 4.38Å; H43-Y63 HydrophobicContact CB-CE2 3.78Å; H43-Y63 AromaticContact CD2-CD2 3.76Å; H43-Y63 AromaticContact CD2-CE2 3.59Å; H43-Y63 AromaticContact CD2-CZ 3.75Å; H43-Y63 PolarHBondContact CD2-O 3.13Å; H43-Y63 PolarHBondContact NE2-O 3.29Å; F45-Y63 WeakPolarHBondContact CE2-O 3.14Å; Y63-E65 HydrophobicContact CD2-CG 3.93Å; Y63-E65 HydrophobicContact CE2-CG 3.83Å; Y63-S115 WeakPolarHBondContact CD2-OG 3.33Å; Y63-L116 CarbonylContact C-O 3.57Å; Y63-L116 WeakPolarHBondContact CA-O 3.26Å; Y63-L116 WeakPolarHBondContact CB-O 3.44Å
64	I	94.5	Very high	87.9	Confident	1 Å²	1	47 Å²	47	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	136.8	177.5	-55.6	-172.9	0	0	0	109.9	F45 I54 L59 S115 L116 L213	F45-I64 HydrophobicContact CD2-CD1 4.09Å; F45-I64 HydrophobicContact CD2-CG1 3.78Å; F45-I64 HydrophobicContact CE2-CG1 4.11Å; I54-I64 HydrophobicContact CD1-CD1 3.22Å; I54-I64 HydrophobicContact CG1-CD1 3.93Å; I54-I64 HydrophobicContact CG2-CD1 4.15Å; L59-I64 HydrophobicContact CD2-CD1 3.84Å; L59-I64 HydrophobicContact CD2-CG1 4.04Å; I64-S115 CarbonylContact O-C 3.52Å; I64-S115 WeakPolarHBondContact O-CA 3.17Å; I64-L116 PolarHBondContact N-O 3.09Å; I64-L116 WeakPolarHBondContact O-CD1 3.33Å; I64-L116 PolarHBondContact O-N 3.44Å; I64-L213 HydrophobicContact CG2-CD1 4.37Å
65	E	97.3	Very high	88.5	Confident	9 Å²	9	49.8 Å²	49.8	4%	0.042	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	139.4	178.9	-68	-178.7	151.2	0	0	112.7	R40 L42 H43 Y63 V113 V114	R40-E65 IonicContact CZ-OE1 3.93Å; R40-E65 IonicContact CZ-OE2 2.85Å; R40-E65 IonicContact NH1-OE1 2.82Å; R40-E65 IonicContact NH1-OE2 3.81Å; R40-E65 PolarHBondContact NH1-OE2 3.43Å; R40-E65 IonicContact NH2-OE1 2.81Å; R40-E65 PolarHBondContact NH2-OE1 3.22Å; R40-E65 IonicContact NH2-OE2 3.24Å; R40-E65 PolarHBondContact NH2-OE2 3.08Å; L42-E65 HydrophobicContact CB-CB 4.07Å; L42-E65 HydrophobicContact CD1-CB 4.38Å; L42-E65 HydrophobicContact CD2-CB 4.11Å; L42-E65 HydrophobicContact CG-CB 4.43Å; H43-E65 HydrophobicContact CB-CB 4.42Å; H43-E65 HydrophobicContact CB-CG 4.07Å; H43-E65 PolarHBondContact N-OE2 3.38Å; H43-E65 WeakPolarHBondContact O-CB 3.31Å; H43-E65 PolarHBondContact O-N 2.88Å; Y63-E65 HydrophobicContact CD2-CG 3.93Å; Y63-E65 HydrophobicContact CE2-CG 3.83Å; E65-V113 HydrophobicContact CB-CG1 3.71Å; E65-V113 HydrophobicContact CG-CG1 3.88Å; E65-V114 CarbonylContact C-O 3.57Å; E65-V114 VanDerWaalsContact CA-O 3.24Å; E65-V114 WeakPolarHBondContact CA-O 3.23Å
66	K	96.9	Very high	89.4	Confident	38 Å²	38	47.2 Å²	47.2	17%	0.165	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	138.6	173.1	-65.4	-63.4	176.4	-175.7	0	111.4	V113 V114 E209 L213	K66-V113 WeakPolarHBondContact O-CA 3.29Å; K66-V114 PolarHBondContact N-O 3.28Å; K66-V114 PolarHBondContact O-N 2.95Å; K66-E209 WeakPolarHBondContact CE-OE1 3.36Å; K66-E209 IonicContact NZ-OE1 3.32Å; K66-E209 PolarHBondContact NZ-OE1 3.3Å; K66-E209 IonicContact NZ-OE2 2.88Å; K66-L213 HydrophobicContact CG-CD1 4.16Å
67	E	96.5	Very high	90.3	Very high	97 Å²	97	44.3 Å²	44.3	45%	0.453	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	133	172.5	-62.3	-163.5	139.3	0	0	109.7	L42 R126	L42-E67 HydrophobicContact CD1-CB 4.35Å; L42-E67 HydrophobicContact CD1-CG 3.39Å; L42-E67 HydrophobicContact CD2-CG 4.49Å; L42-E67 HydrophobicContact CG-CG 4.15Å; E67-R126 IonicContact OE1-CZ 3.7Å; E67-R126 IonicContact OE1-NE 3.34Å; E67-R126 PolarHBondContact OE1-NE 3.2Å; E67-R126 IonicContact OE1-NH2 3.65Å; E67-R126 PolarHBondContact OE1-NH2 2.94Å
68	V	97.6	Very high	91.3	Very high	7 Å²	7	41.2 Å²	41.2	4%	0.042	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	171.6	174.3	-53.3	0	0	0	0	109.2	A112 V114 L123 L199 A200 V201 L210	V68-A112 HydrophobicContact CG2-CB 4.06Å; V68-A112 PolarHBondContact N-O 2.89Å; V68-A112 CarbonylContact O-C 3.52Å; V68-A112 PolarHBondContact O-N 2.86Å; V68-V114 HydrophobicContact CB-CG2 4.19Å; V68-V114 HydrophobicContact CG1-CB 4.37Å; V68-V114 HydrophobicContact CG1-CG2 3.52Å; V68-V114 HydrophobicContact CG2-CG2 3.55Å; V68-L123 HydrophobicContact CG2-CD1 3.9Å; V68-L199 HydrophobicContact CG2-CD1 4.46Å; V68-L199 HydrophobicContact CG2-CD2 4.19Å; V68-A200 CarbonylContact C-O 3.53Å; V68-V201 HydrophobicContact CB-CG1 4.37Å; V68-V201 HydrophobicContact CG1-CG1 3.93Å; V68-L210 HydrophobicContact CG1-CD2 4.26Å
69	K	97.4	Very high	91.7	Very high	41 Å²	41	40.2 Å²	40.2	18%	0.178	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.8	162.2	-68.2	-179.3	178.9	-72.5	0	109.8	L71 L106 T107 Q110 D111 L199 A200	K69-L71 HydrophobicContact CB-CD1 4.33Å; K69-L71 VanDerWaalsContact O-CD1 3.31Å; K69-L71 WeakPolarHBondContact O-CD1 3.45Å; K69-L106 HydrophobicContact CB-CD2 4.26Å; K69-L106 HydrophobicContact CD-CB 3.91Å; K69-L106 HydrophobicContact CD-CD1 4.16Å; K69-L106 HydrophobicContact CD-CD2 4.02Å; K69-L106 HydrophobicContact CD-CG 4.25Å; K69-T107 PolarHBondContact NZ-O 3.5Å; K69-Q110 CarbonylContact C-O 3.45Å; K69-Q110 WeakPolarHBondContact CA-O 3.49Å; K69-Q110 HydrophobicContact CB-CB 4.22Å; K69-D111 IonicContact NZ-OD1 3.37Å; K69-D111 PolarHBondContact NZ-OD1 3.22Å; K69-L199 CarbonylContact O-C 3.54Å; K69-L199 VanDerWaalsContact O-CA 3.31Å; K69-L199 WeakPolarHBondContact O-CA 3.24Å; K69-A200 HydrophobicContact CB-CB 4.3Å; K69-A200 PolarHBondContact N-O 3.13Å; K69-A200 PolarHBondContact O-N 3.23Å
70	Y	97.6	Very high	92.1	Very high	34 Å²	34	49.1 Å²	49.1	13%	0.133	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	116.2	175.9	175.4	-126.2	0	0	0	110.4	G72 Q73 Q110 L123 W125 I132 L133 L197 L199	Y70-G72 WeakPolarHBondContact CE2-O 3.22Å; Y70-G72 VanDerWaalsContact CZ-CA 3.4Å; Y70-Q73 PolarHBondContact OH-N 3.24Å; Y70-Q110 PolarHBondContact N-O 3.15Å; Y70-Q110 WeakPolarHBondContact O-CB 3.32Å; Y70-Q110 WeakPolarHBondContact O-CG 3.34Å; Y70-L123 HydrophobicContact CD1-CD2 4.3Å; Y70-L123 HydrophobicContact CD2-CD2 3.41Å; Y70-L123 VanDerWaalsContact CD2-CD2 3.41Å; Y70-L123 HydrophobicContact CE2-CD2 3.94Å; Y70-L123 HydrophobicContact CG-CD2 3.61Å; Y70-W125 AromaticContact CD1-CH2 3.59Å; Y70-W125 HydrophobicContact CD1-CH2 3.59Å; Y70-W125 HydrophobicContact CD1-CZ2 4.02Å; Y70-W125 HydrophobicContact CD1-CZ3 4.19Å; Y70-W125 HydrophobicContact CE1-CH2 4.34Å; Y70-W125 HydrophobicContact CE1-CZ2 4.43Å; Y70-I132 HydrophobicContact CD1-CD1 4.03Å; Y70-I132 HydrophobicContact CD1-CG2 3.93Å; Y70-I132 HydrophobicContact CE1-CG2 3.51Å; Y70-I132 HydrophobicContact CG-CD1 4.36Å; Y70-L133 HydrophobicContact CE2-CD2 4.39Å; Y70-L197 HydrophobicContact CD2-CD1 3.66Å; Y70-L197 HydrophobicContact CE2-CD1 3.28Å; Y70-L199 HydrophobicContact CD2-CD2 3.96Å
71	L	96.5	Very high	92.8	Very high	6 Å²	6	48 Å²	48	3%	0.031	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-24.8	-179.7	-78.8	64.2	0	0	0	112.1	K69 L102 A103 L106 L153 V198 A200	K69-L71 HydrophobicContact CB-CD1 4.33Å; K69-L71 VanDerWaalsContact O-CD1 3.31Å; K69-L71 WeakPolarHBondContact O-CD1 3.45Å; L71-L102 WeakPolarHBondContact O-CA 3.21Å; L71-A103 PolarHBondContact O-N 3.48Å; L71-L106 HydrophobicContact CD1-CD2 3.58Å; L71-L106 HydrophobicContact CD2-CD2 4.31Å; L71-L106 HydrophobicContact CG-CD2 3.91Å; L71-L153 HydrophobicContact CD2-CD2 3.99Å; L71-V198 HydrophobicContact CB-CB 4.24Å; L71-V198 HydrophobicContact CB-CG1 4.1Å; L71-V198 WeakPolarHBondContact CB-O 3.47Å; L71-V198 HydrophobicContact CD2-CG1 4.03Å; L71-V198 PolarHBondContact N-O 3.17Å; L71-A200 HydrophobicContact CD1-CB 3.61Å
72	G	95.9	Very high	93.3	Very high	8 Å²	8	45.3 Å²	45.3	8%	0.082	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	139.9	179.4	-178.9	0	0	0	0	0	112.8	Y70 L102 V198	Y70-G72 WeakPolarHBondContact CE2-O 3.22Å; Y70-G72 VanDerWaalsContact CZ-CA 3.4Å; G72-L102 VanDerWaalsContact CA-CD2 3.49Å; G72-V198 PolarHBondContact O-N 3.34Å
73	Q	95.6	Very high	93.4	Very high	71 Å²	71	44 Å²	44	33%	0.332	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	124.6	177.1	-173.8	-178.9	36.4	0	0	109	Y70 C195 L196	Y70-Q73 PolarHBondContact OH-N 3.24Å; Q73-C195 HydrophobicContact CG-CB 4.26Å; Q73-L196 CarbonylContact C-O 3.57Å; Q73-L196 WeakPolarHBondContact CA-O 3.5Å
74	L	95.3	Very high	93.3	Very high	7 Å²	7	44.9 Å²	44.9	4%	0.037	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	129	171.4	-53.5	-177.4	0	0	0	108.8	V77 L92 A96 L102 C195 L196	L74-V77 HydrophobicContact CB-CG2 3.83Å; L74-L92 HydrophobicContact CD1-CB 4.31Å; L74-A96 HydrophobicContact CD1-CB 4.06Å; L74-A96 HydrophobicContact CD2-CB 3.26Å; L74-A96 HydrophobicContact CG-CB 4.31Å; L74-L102 HydrophobicContact CD1-CD1 4.35Å; L74-L102 HydrophobicContact CD2-CD1 3.97Å; L74-L102 HydrophobicContact CD2-CD2 3.75Å; L74-L102 HydrophobicContact CD2-CG 3.75Å; L74-L102 HydrophobicContact CG-CD1 4.34Å; L74-L102 HydrophobicContact CG-CD2 4.32Å; L74-C195 CarbonylContact O-C 3.09Å; L74-C195 WeakPolarHBondContact O-CA 3.48Å; L74-C195 WeakPolarHBondContact O-CB 3.42Å; L74-L196 HydrophobicContact CB-CB 4.18Å; L74-L196 HydrophobicContact CD1-CD1 4.38Å; L74-L196 PolarHBondContact N-O 2.96Å; L74-L196 PolarHBondContact O-N 2.78Å
75	T	93.4	Very high	93.2	Very high	76 Å²	76	46.1 Å²	46.1	47%	0.466	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	166.1	176.1	62.6	0	0	0	0	110.1	V77	T75-V77 PolarHBondContact O-N 3.38Å
76	S	90.5	Very high	93.1	Very high	81 Å²	81	51.4 Å²	51.4	57%	0.566	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	58.7	32.3	-179.5	-46.4	0	0	0	0	113
77	V	93.6	Very high	93.1	Very high	7 Å²	7	53.8 Å²	53.8	4%	0.042	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	139.9	175.6	179.2	0	0	0	0	108.3	L74 T75 G79 L81 L92 V193 C194 L196	L74-V77 HydrophobicContact CB-CG2 3.83Å; T75-V77 PolarHBondContact O-N 3.38Å; V77-G79 PolarHBondContact O-N 2.81Å; V77-L81 HydrophobicContact CG1-CB 4.34Å; V77-L81 HydrophobicContact CG1-CD2 3.83Å; V77-L92 HydrophobicContact CG1-CD1 3.7Å; V77-V193 CarbonylContact O-C 3.47Å; V77-V193 VanDerWaalsContact O-CA 3.28Å; V77-V193 WeakPolarHBondContact O-CA 3.49Å; V77-C194 WeakPolarHBondContact CB-O 3.42Å; V77-C194 PolarHBondContact N-O 2.83Å; V77-C194 PolarHBondContact O-N 2.83Å; V77-L196 HydrophobicContact CG1-CD1 4.14Å; V77-L196 HydrophobicContact CG1-CG 4.22Å; V77-L196 HydrophobicContact CG2-CD1 4.31Å; V77-L196 HydrophobicContact CG2-CG 4.14Å
78	P	90.5	Very high	93	Very high	40 Å²	40	52.9 Å²	52.9	26%	0.26	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	127	178.3	-23.6	33	0	0	0	112.1	Y80 L81	P78-Y80 HydrophobicContact CB-CD1 4.06Å; P78-Y80 HydrophobicContact CB-CD2 4.3Å; P78-Y80 HydrophobicContact CB-CE1 3.57Å; P78-Y80 HydrophobicContact CB-CE2 3.83Å; P78-Y80 HydrophobicContact CB-CG 4.4Å; P78-Y80 VanDerWaalsContact CB-CZ 3.44Å; P78-Y80 PolarHBondContact O-N 2.75Å; P78-L81 WeakPolarHBondContact O-CB 3.46Å; P78-L81 PolarHBondContact O-N 3.02Å
79	G	86.9	Confident	92.9	Very high	12 Å²	12	52.6 Å²	52.6	12%	0.124	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-26.1	-175.7	0	0	0	0	0	113.7	V77 L81 K157 E192	V77-G79 PolarHBondContact O-N 2.81Å; G79-L81 PolarHBondContact O-N 3.44Å; G79-K157 PolarHBondContact O-NZ 2.94Å; G79-E192 WeakPolarHBondContact CA-O 3.36Å; G79-E192 PolarHBondContact N-O 2.9Å
80	Y	87.5	Confident	92.8	Very high	189 Å²	189	51.3 Å²	51.3	74%	0.741	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	0.1	173.5	60.3	-103	0	0	0	114.2	P78 N82	P78-Y80 HydrophobicContact CB-CD1 4.06Å; P78-Y80 HydrophobicContact CB-CD2 4.3Å; P78-Y80 HydrophobicContact CB-CE1 3.57Å; P78-Y80 HydrophobicContact CB-CE2 3.83Å; P78-Y80 HydrophobicContact CB-CG 4.4Å; P78-Y80 VanDerWaalsContact CB-CZ 3.44Å; P78-Y80 PolarHBondContact O-N 2.75Å; Y80-N82 PolarHBondContact O-N 2.82Å
81	L	91.1	Very high	92.7	Very high	10 Å²	10	55 Å²	55	5%	0.052	30%	0.295	C	S	.	.			trans	-51.2	127.9	174.9	177	77.2	0	0	0	109.9	V77 P78 G79 P83 E88 V89 L92 K157 L196	V77-L81 HydrophobicContact CG1-CB 4.34Å; V77-L81 HydrophobicContact CG1-CD2 3.83Å; P78-L81 WeakPolarHBondContact O-CB 3.46Å; P78-L81 PolarHBondContact O-N 3.02Å; G79-L81 PolarHBondContact O-N 3.44Å; L81-P83 VanDerWaalsContact O-CD 3.24Å; L81-P83 WeakPolarHBondContact O-CD 3.31Å; L81-E88 HydrophobicContact CD1-CB 3.81Å; L81-V89 HydrophobicContact CD2-CG2 4.4Å; L81-L92 HydrophobicContact CD1-CD1 3.73Å; L81-L92 HydrophobicContact CD2-CD1 3.97Å; L81-L92 HydrophobicContact CG-CD1 4.47Å; L81-K157 PolarHBondContact O-NZ 2.85Å; L81-L196 HydrophobicContact CD2-CD1 3.68Å; L81-L196 HydrophobicContact CD2-CD2 3.82Å; L81-L196 HydrophobicContact CD2-CG 4.18Å
82	N	87.6	Confident	92.7	Very high	77 Å²	77	57.1 Å²	57.1	41%	0.412	31%	0.306	S	S	.	.			trans	-82.1	109.1	174.8	-179	0.7	0	0	0	109.8	Y80 S84 S85	Y80-N82 PolarHBondContact O-N 2.82Å; N82-S84 PolarHBondContact O-N 3.01Å; N82-S84 VanDerWaalsContact O-N 3.17Å; N82-S84 WeakPolarHBondContact OD1-CB 3.46Å; N82-S84 PolarHBondContact OD1-N 3.18Å; N82-S85 WeakPolarHBondContact O-CB 3.37Å; N82-S85 PolarHBondContact O-N 2.83Å
83	P	87.9	Confident	92.7	Very high	30 Å²	30	56.7 Å²	56.7	20%	0.195	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-24.1	-178.3	28.2	-35.4	0	0	0	112.6	L81 S85 A142 S144 K157	L81-P83 VanDerWaalsContact O-CD 3.24Å; L81-P83 WeakPolarHBondContact O-CD 3.31Å; P83-S85 VanDerWaalsContact C-N 3.3Å; P83-S85 PolarHBondContact O-N 2.83Å; P83-A142 HydrophobicContact CB-CB 3.66Å; P83-A142 HydrophobicContact CG-CB 3.52Å; P83-S144 PolarHBondContact O-OG 3.41Å; P83-S144 VanDerWaalsContact O-OG 3.12Å; P83-K157 HydrophobicContact CB-CD 4.48Å
84	S	88.1	Confident	92.6	Very high	102 Å²	102	56.2 Å²	56.2	71%	0.713	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-12.8	175.7	-53.1	0	0	0	0	113.5	N82 R86	N82-S84 PolarHBondContact O-N 3.01Å; N82-S84 VanDerWaalsContact O-N 3.17Å; N82-S84 WeakPolarHBondContact OD1-CB 3.46Å; N82-S84 PolarHBondContact OD1-N 3.18Å; S84-R86 PolarHBondContact O-N 2.8Å; S84-R86 VanDerWaalsContact O-N 3.14Å
85	S	94.4	Very high	92.6	Very high	26 Å²	26	60.4 Å²	60.4	18%	0.182	32%	0.324	C	S	.	.			trans	-82.6	90.8	-179.5	-172.6	0	0	0	0	110.4	N82 P83 T87 E88 V89	N82-S85 WeakPolarHBondContact O-CB 3.37Å; N82-S85 PolarHBondContact O-N 2.83Å; P83-S85 VanDerWaalsContact C-N 3.3Å; P83-S85 PolarHBondContact O-N 2.83Å; S85-T87 PolarHBondContact O-N 2.82Å; S85-T87 VanDerWaalsContact O-N 3.13Å; S85-E88 VanDerWaalsContact CB-OE1 3.29Å; S85-E88 WeakPolarHBondContact CB-OE1 3.14Å; S85-E88 PolarHBondContact O-N 3.07Å; S85-E88 VanDerWaalsContact OG-CD 3.23Å; S85-E88 WeakPolarHBondContact OG-CG 3.46Å; S85-E88 PolarHBondContact OG-OE1 2.94Å; S85-V89 WeakPolarHBondContact O-CG2 3.34Å; S85-V89 PolarHBondContact O-N 2.8Å; S85-V89 VanDerWaalsContact O-N 3.08Å
86	R	95	Very high	92.7	Very high	121 Å²	121	57 Å²	57	46%	0.457	30%	0.304	S	S	.	.	H	α-helix	trans	-47.9	-43.4	176.7	176.6	175.7	-174.9	-79.7	-2.5	112.3	S84 L90 I146 R147	S84-R86 PolarHBondContact O-N 2.8Å; S84-R86 VanDerWaalsContact O-N 3.14Å; R86-L90 HydrophobicContact CG-CD1 3.71Å; R86-L90 HydrophobicContact CG-CG 4.31Å; R86-L90 WeakPolarHBondContact O-CB 3.28Å; R86-L90 VanDerWaalsContact O-CG 3.3Å; R86-L90 WeakPolarHBondContact O-CG 3.35Å; R86-L90 PolarHBondContact O-N 2.77Å; R86-I146 HydrophobicContact CG-CG2 3.91Å; R86-R147 PolarHBondContact NE-O 2.8Å; R86-R147 PolarHBondContact NH2-O 3.26Å
87	T	95.2	Very high	92.8	Very high	88 Å²	88	55.4 Å²	55.4	54%	0.54	29%	0.285	S	S	.	.	H	α-helix	trans	-66.3	-46.4	-176.3	-55.1	0	0	0	0	112	S85 Q91	S85-T87 PolarHBondContact O-N 2.82Å; S85-T87 VanDerWaalsContact O-N 3.13Å; T87-Q91 WeakPolarHBondContact O-CB 3.41Å; T87-Q91 WeakPolarHBondContact O-CG 3.41Å; T87-Q91 PolarHBondContact O-N 2.87Å
88	E	94.7	Very high	92.8	Very high	77 Å²	77	62.5 Å²	62.5	36%	0.36	32%	0.316	S	S	.	.	H	α-helix	trans	-64.9	-45.6	179.2	-72.7	165.1	-126.6	0	0	111.4	L81 S85 Q91 L92	L81-E88 HydrophobicContact CD1-CB 3.81Å; S85-E88 VanDerWaalsContact CB-OE1 3.29Å; S85-E88 WeakPolarHBondContact CB-OE1 3.14Å; S85-E88 PolarHBondContact O-N 3.07Å; S85-E88 VanDerWaalsContact OG-CD 3.23Å; S85-E88 WeakPolarHBondContact OG-CG 3.46Å; S85-E88 PolarHBondContact OG-OE1 2.94Å; E88-Q91 PolarHBondContact O-N 2.87Å; E88-L92 PolarHBondContact O-N 2.82Å; E88-L92 VanDerWaalsContact O-N 3.17Å
89	V	96.1	Very high	93	Very high	2 Å²	2	63.4 Å²	63.4	1%	0.012	32%	0.323	C	S	.	.	H	α-helix	trans	-63.7	-45.7	-179.4	178.2	0	0	0	0	111	L81 S85 Q91 L92 I93 I146 V155	L81-V89 HydrophobicContact CD2-CG2 4.4Å; S85-V89 WeakPolarHBondContact O-CG2 3.34Å; S85-V89 PolarHBondContact O-N 2.8Å; S85-V89 VanDerWaalsContact O-N 3.08Å; V89-Q91 PolarHBondContact O-N 3.39Å; V89-L92 PolarHBondContact O-N 2.79Å; V89-I93 HydrophobicContact CG1-CD1 3.85Å; V89-I93 WeakPolarHBondContact O-CG1 3.37Å; V89-I93 PolarHBondContact O-N 2.85Å; V89-I146 HydrophobicContact CB-CD1 3.6Å; V89-I146 HydrophobicContact CG1-CD1 3.37Å; V89-I146 HydrophobicContact CG2-CD1 4.2Å; V89-V155 HydrophobicContact CG1-CB 4.43Å; V89-V155 HydrophobicContact CG1-CG1 4.14Å; V89-V155 HydrophobicContact CG1-CG2 4Å
90	L	96	Very high	93.2	Very high	13 Å²	13	71.1 Å²	71.1	7%	0.068	36%	0.355	C	S	.	.	H	α-helix	trans	-66	-37.7	177.9	-73.1	177.5	0	0	0	112.6	R86 L92 I93 D94 I146 D148 L153	R86-L90 HydrophobicContact CG-CD1 3.71Å; R86-L90 HydrophobicContact CG-CG 4.31Å; R86-L90 WeakPolarHBondContact O-CB 3.28Å; R86-L90 VanDerWaalsContact O-CG 3.3Å; R86-L90 WeakPolarHBondContact O-CG 3.35Å; R86-L90 PolarHBondContact O-N 2.77Å; L90-L92 VanDerWaalsContact C-N 3.29Å; L90-L92 PolarHBondContact O-N 2.86Å; L90-I93 PolarHBondContact O-N 2.85Å; L90-D94 WeakPolarHBondContact O-CB 3.38Å; L90-D94 VanDerWaalsContact O-CG 3.27Å; L90-D94 PolarHBondContact O-N 2.96Å; L90-I146 HydrophobicContact CD1-CG2 4.07Å; L90-I146 HydrophobicContact CD2-CG2 3.89Å; L90-I146 HydrophobicContact CG-CG2 3.98Å; L90-D148 HydrophobicContact CD2-CB 4.17Å; L90-L153 HydrophobicContact CD2-CD1 4.09Å
91	Q	95.6	Very high	93.3	Very high	112 Å²	112	67.9 Å²	67.9	52%	0.523	35%	0.347	S	S	.	.	H	α-helix	trans	-59	-41.2	175.1	-78.5	175.2	5.4	0	0	112.1	T87 E88 V89 N95	T87-Q91 WeakPolarHBondContact O-CB 3.41Å; T87-Q91 WeakPolarHBondContact O-CG 3.41Å; T87-Q91 PolarHBondContact O-N 2.87Å; E88-Q91 PolarHBondContact O-N 2.87Å; V89-Q91 PolarHBondContact O-N 3.39Å; Q91-N95 WeakPolarHBondContact O-CB 3.28Å; Q91-N95 PolarHBondContact O-N 3.39Å; Q91-N95 PolarHBondContact O-ND2 2.76Å; Q91-N95 VanDerWaalsContact O-ND2 3.14Å
92	L	95.9	Very high	93.3	Very high	50 Å²	50	67.8 Å²	67.8	26%	0.262	35%	0.347	S	S	.	.	H	α-helix	trans	-65.3	-46.3	175.5	-70.6	172.4	0	0	0	111.8	L74 V77 L81 E88 V89 L90 D94 N95 A96 L196	L74-L92 HydrophobicContact CD1-CB 4.31Å; V77-L92 HydrophobicContact CG1-CD1 3.7Å; L81-L92 HydrophobicContact CD1-CD1 3.73Å; L81-L92 HydrophobicContact CD2-CD1 3.97Å; L81-L92 HydrophobicContact CG-CD1 4.47Å; E88-L92 PolarHBondContact O-N 2.82Å; E88-L92 VanDerWaalsContact O-N 3.17Å; V89-L92 PolarHBondContact O-N 2.79Å; L90-L92 VanDerWaalsContact C-N 3.29Å; L90-L92 PolarHBondContact O-N 2.86Å; L92-D94 PolarHBondContact O-N 3.27Å; L92-N95 PolarHBondContact O-N 2.85Å; L92-A96 WeakPolarHBondContact O-CB 3.33Å; L92-A96 PolarHBondContact O-N 2.64Å; L92-L196 HydrophobicContact CD1-CD1 4.06Å
93	I	95.4	Very high	93.3	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-61.3	-44.2	178.2	-68.8	172.1	0	0	0	111	V89 L90 A96 R97 L102 L153 V155 V198	V89-I93 HydrophobicContact CG1-CD1 3.85Å; V89-I93 WeakPolarHBondContact O-CG1 3.37Å; V89-I93 PolarHBondContact O-N 2.85Å; L90-I93 PolarHBondContact O-N 2.85Å; I93-A96 PolarHBondContact O-N 3.37Å; I93-R97 HydrophobicContact CG2-CG 4.49Å; I93-R97 WeakPolarHBondContact O-CG 3.4Å; I93-R97 PolarHBondContact O-N 3.2Å; I93-L102 HydrophobicContact CB-CD1 4.35Å; I93-L102 HydrophobicContact CG1-CD1 4.4Å; I93-L102 HydrophobicContact CG2-CD1 3.94Å; I93-L153 HydrophobicContact CD1-CD1 4.17Å; I93-V155 HydrophobicContact CD1-CG2 3.97Å; I93-V198 HydrophobicContact CD1-CG1 4.06Å; I93-V198 HydrophobicContact CD1-CG2 4.28Å; I93-V198 HydrophobicContact CG1-CG1 4.48Å; I93-V198 HydrophobicContact CG1-CG2 4.16Å
94	D	94.9	Very high	92.7	Very high	61 Å²	61	67.1 Å²	67.1	33%	0.326	36%	0.361	S	S	.	.	H	α-helix	trans	-64.9	-42.1	179.4	-75	-20.7	0	0	0	112.1	L90 L92 A96 R97 K98	L90-D94 WeakPolarHBondContact O-CB 3.38Å; L90-D94 VanDerWaalsContact O-CG 3.27Å; L90-D94 PolarHBondContact O-N 2.96Å; L92-D94 PolarHBondContact O-N 3.27Å; D94-A96 VanDerWaalsContact C-N 3.31Å; D94-A96 PolarHBondContact O-N 2.86Å; D94-R97 PolarHBondContact O-N 3.29Å; D94-K98 WeakPolarHBondContact O-CB 3.48Å; D94-K98 VanDerWaalsContact O-CG 3.24Å; D94-K98 WeakPolarHBondContact O-CG 3.24Å; D94-K98 PolarHBondContact O-N 2.8Å
95	N	94.9	Very high	92.4	Very high	95 Å²	95	69.6 Å²	69.6	51%	0.508	36%	0.361	S	S	.	.	H	α-helix	trans	-64.8	-38.1	175.7	-71.8	-22.5	0	0	0	111.5	Q91 L92 K98 S99	Q91-N95 WeakPolarHBondContact O-CB 3.28Å; Q91-N95 PolarHBondContact O-N 3.39Å; Q91-N95 PolarHBondContact O-ND2 2.76Å; Q91-N95 VanDerWaalsContact O-ND2 3.14Å; L92-N95 PolarHBondContact O-N 2.85Å; N95-K98 PolarHBondContact O-N 2.88Å; N95-S99 WeakPolarHBondContact O-CB 3.24Å; N95-S99 PolarHBondContact O-N 3.25Å; N95-S99 PolarHBondContact O-OG 3.41Å
96	A	94.6	Very high	92	Very high	5 Å²	5	71.2 Å²	71.2	4%	0.041	37%	0.367	C	S	.	.	H	α-helix	trans	-69.8	-38.3	176.3	0	0	0	0	0	112.8	L74 L92 I93 D94 S99 H100 Q101 L102	L74-A96 HydrophobicContact CD1-CB 4.06Å; L74-A96 HydrophobicContact CD2-CB 3.26Å; L74-A96 HydrophobicContact CG-CB 4.31Å; L92-A96 WeakPolarHBondContact O-CB 3.33Å; L92-A96 PolarHBondContact O-N 2.64Å; I93-A96 PolarHBondContact O-N 3.37Å; D94-A96 VanDerWaalsContact C-N 3.31Å; D94-A96 PolarHBondContact O-N 2.86Å; A96-S99 WeakPolarHBondContact CA-OG 3.43Å; A96-S99 CarbonylContact O-C 3.53Å; A96-S99 PolarHBondContact O-N 2.84Å; A96-S99 PolarHBondContact O-OG 2.98Å; A96-H100 PolarHBondContact O-N 3.27Å; A96-H100 VanDerWaalsContact O-N 3.13Å; A96-Q101 HydrophobicContact CB-CB 4.17Å; A96-Q101 PolarHBondContact O-N 2.9Å; A96-L102 HydrophobicContact CB-CD1 3.8Å; A96-L102 HydrophobicContact CB-CG 3.78Å; A96-L102 PolarHBondContact O-N 2.82Å
97	R	93.1	Very high	91.8	Very high	46 Å²	46	67.8 Å²	67.8	17%	0.174	36%	0.36	C	S	.	.	H	α-helix	trans	-62	-44.6	171.2	-76.6	176.9	172.9	164.4	0.2	111.5	I93 D94 S99 H100 L102 D148	I93-R97 HydrophobicContact CG2-CG 4.49Å; I93-R97 WeakPolarHBondContact O-CG 3.4Å; I93-R97 PolarHBondContact O-N 3.2Å; D94-R97 PolarHBondContact O-N 3.29Å; R97-S99 VanDerWaalsContact C-N 3.27Å; R97-S99 PolarHBondContact O-N 3.02Å; R97-H100 PolarHBondContact O-N 2.9Å; R97-H100 VanDerWaalsContact O-N 3.15Å; R97-L102 HydrophobicContact CG-CB 4.06Å; R97-D148 IonicContact NH1-OD2 3.8Å; R97-D148 PolarHBondContact NH1-OD2 3.01Å
98	K	94.1	Very high	91.6	Very high	156 Å²	156	67.1 Å²	67.1	68%	0.678	36%	0.359	S	S	*	.	H	α-helix	trans	-64	-30.5	177.2	-73.2	168.8	-171.8	167.2	0	113.3	D94 N95	D94-K98 WeakPolarHBondContact O-CB 3.48Å; D94-K98 VanDerWaalsContact O-CG 3.24Å; D94-K98 WeakPolarHBondContact O-CG 3.24Å; D94-K98 PolarHBondContact O-N 2.8Å; N95-K98 PolarHBondContact O-N 2.88Å
99	S	93.6	Very high	91.4	Very high	60 Å²	60	70.6 Å²	70.6	42%	0.42	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	10.2	176.8	56.2	0	0	0	0	113.7	N95 A96 R97 Q101	N95-S99 WeakPolarHBondContact O-CB 3.24Å; N95-S99 PolarHBondContact O-N 3.25Å; N95-S99 PolarHBondContact O-OG 3.41Å; A96-S99 WeakPolarHBondContact CA-OG 3.43Å; A96-S99 CarbonylContact O-C 3.53Å; A96-S99 PolarHBondContact O-N 2.84Å; A96-S99 PolarHBondContact O-OG 2.98Å; R97-S99 VanDerWaalsContact C-N 3.27Å; R97-S99 PolarHBondContact O-N 3.02Å; S99-Q101 PolarHBondContact O-N 2.84Å; S99-Q101 PolarHBondContact OG-NE2 2.74Å
100	H	90.8	Very high	91.4	Very high	173 Å²	173	71.7 Å²	71.7	80%	0.801	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	24	179.2	-55.5	-69.6	0	0	0	115	A96 R97	A96-H100 PolarHBondContact O-N 3.27Å; A96-H100 VanDerWaalsContact O-N 3.13Å; R97-H100 PolarHBondContact O-N 2.9Å; R97-H100 VanDerWaalsContact O-N 3.15Å
101	Q	90.2	Very high	91.4	Very high	122 Å²	122	72.3 Å²	72.3	57%	0.57	38%	0.384	S	S	*	.	S	Bend	trans	-82.1	-25.7	173.2	-66.1	-179.9	51.7	0	0	112.5	A96 S99	A96-Q101 HydrophobicContact CB-CB 4.17Å; A96-Q101 PolarHBondContact O-N 2.9Å; S99-Q101 PolarHBondContact O-N 2.84Å; S99-Q101 PolarHBondContact OG-NE2 2.74Å
102	L	91.6	Very high	91.5	Very high	8 Å²	8	67 Å²	67	4%	0.042	36%	0.359	C	S	.	.	S	Bend	trans	-115.6	151.5	173.4	-63.1	179.2	0	0	0	110.6	L71 G72 L74 I93 A96 R97 G104 V198	L71-L102 WeakPolarHBondContact O-CA 3.21Å; G72-L102 VanDerWaalsContact CA-CD2 3.49Å; L74-L102 HydrophobicContact CD1-CD1 4.35Å; L74-L102 HydrophobicContact CD2-CD1 3.97Å; L74-L102 HydrophobicContact CD2-CD2 3.75Å; L74-L102 HydrophobicContact CD2-CG 3.75Å; L74-L102 HydrophobicContact CG-CD1 4.34Å; L74-L102 HydrophobicContact CG-CD2 4.32Å; I93-L102 HydrophobicContact CB-CD1 4.35Å; I93-L102 HydrophobicContact CG1-CD1 4.4Å; I93-L102 HydrophobicContact CG2-CD1 3.94Å; A96-L102 HydrophobicContact CB-CD1 3.8Å; A96-L102 HydrophobicContact CB-CG 3.78Å; A96-L102 PolarHBondContact O-N 2.82Å; R97-L102 HydrophobicContact CG-CB 4.06Å; L102-G104 PolarHBondContact O-N 2.95Å; L102-V198 HydrophobicContact CD1-CB 4.49Å; L102-V198 HydrophobicContact CD1-CG2 4.13Å; L102-V198 HydrophobicContact CD2-CG2 4.42Å
103	A	86.8	Confident	91.6	Very high	26 Å²	26	64.9 Å²	64.9	22%	0.215	35%	0.348	C	S	.	.			trans	-58.9	119.1	171.2	0	0	0	0	0	110.4	L71 Q110	L71-A103 PolarHBondContact O-N 3.48Å; A103-Q110 HydrophobicContact CB-CG 3.86Å
104	G	76.7	Confident	91.7	Very high	67 Å²	67	64.9 Å²	64.9	69%	0.691	35%	0.348	S	S	*	.	S	Bend	trans	-80	-29.8	-179.5	0	0	0	0	0	113.8	L102	L102-G104 PolarHBondContact O-N 2.95Å
105	Q	81.5	Confident	91.8	Very high	153 Å²	153	62.2 Å²	62.2	72%	0.715	33%	0.334	S	S	*	.	S	Bend	trans	-124.3	134.4	177.4	-173.6	173.6	-19.1	0	0	109.6	T107 Q110	Q105-T107 HydrophobicContact CG-CG2 4.44Å; Q105-T107 PolarHBondContact O-N 3.38Å; Q105-Q110 PolarHBondContact O-OE1 2.84Å
106	L	86.1	Confident	91.8	Very high	60 Å²	60	57.7 Å²	57.7	31%	0.314	31%	0.31	S	S	.	.			trans	-79.7	111.4	177	-62.4	179.2	0	0	0	109.7	K69 L71 L151 A200	K69-L106 HydrophobicContact CB-CD2 4.26Å; K69-L106 HydrophobicContact CD-CB 3.91Å; K69-L106 HydrophobicContact CD-CD1 4.16Å; K69-L106 HydrophobicContact CD-CD2 4.02Å; K69-L106 HydrophobicContact CD-CG 4.25Å; L71-L106 HydrophobicContact CD1-CD2 3.58Å; L71-L106 HydrophobicContact CD2-CD2 4.31Å; L71-L106 HydrophobicContact CG-CD2 3.91Å; L106-L151 HydrophobicContact CD1-CD2 3.6Å; L106-L151 HydrophobicContact CD1-CG 3.91Å; L106-L151 HydrophobicContact CG-CD2 4.2Å; L106-A200 HydrophobicContact CD1-CB 4.08Å; L106-A200 HydrophobicContact CD2-CB 4.25Å
107	T	90.8	Very high	91.5	Very high	50 Å²	50	58 Å²	58	31%	0.307	31%	0.312	S	S	.	.			trans	-118.3	-178.5	173.9	73.3	0	0	0	0	109.9	K69 Q105 E109 Q110	K69-T107 PolarHBondContact NZ-O 3.5Å; Q105-T107 HydrophobicContact CG-CG2 4.44Å; Q105-T107 PolarHBondContact O-N 3.38Å; T107-E109 PolarHBondContact O-N 2.84Å; T107-E109 WeakPolarHBondContact OG1-CB 3.23Å; T107-E109 PolarHBondContact OG1-N 2.95Å; T107-Q110 PolarHBondContact O-N 2.77Å; T107-Q110 PolarHBondContact O-OE1 3.06Å; T107-Q110 PolarHBondContact OG1-OE1 3.03Å
108	S	90.1	Very high	91	Very high	74 Å²	74	56.2 Å²	56.2	52%	0.517	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-69.3	-19.7	174	52.1	0	0	0	0	113	Q110 D111	S108-Q110 PolarHBondContact O-N 3.2Å; S108-D111 VanDerWaalsContact O-CB 3.31Å; S108-D111 WeakPolarHBondContact O-CB 3.43Å; S108-D111 VanDerWaalsContact O-CG 3.24Å; S108-D111 PolarHBondContact O-N 2.98Å; S108-D111 VanDerWaalsContact O-N 3.09Å
109	E	91.1	Very high	90.5	Very high	149 Å²	149	56 Å²	56	70%	0.696	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-65.9	-19.5	177	-60.8	179.6	175	0	0	112.7	T107 W125	T107-E109 PolarHBondContact O-N 2.84Å; T107-E109 WeakPolarHBondContact OG1-CB 3.23Å; T107-E109 PolarHBondContact OG1-N 2.95Å; E109-W125 VanDerWaalsContact O-CZ3 3.23Å; E109-W125 WeakPolarHBondContact O-CZ3 3.17Å
110	Q	95	Very high	90.2	Very high	25 Å²	25	54.1 Å²	54.1	12%	0.117	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-92	-2.3	177.3	-70.2	74.5	49.4	0	0	112.7	K69 Y70 A103 Q105 T107 S108 A112	K69-Q110 CarbonylContact C-O 3.45Å; K69-Q110 WeakPolarHBondContact CA-O 3.49Å; K69-Q110 HydrophobicContact CB-CB 4.22Å; Y70-Q110 PolarHBondContact N-O 3.15Å; Y70-Q110 WeakPolarHBondContact O-CB 3.32Å; Y70-Q110 WeakPolarHBondContact O-CG 3.34Å; A103-Q110 HydrophobicContact CB-CG 3.86Å; Q105-Q110 PolarHBondContact O-OE1 2.84Å; T107-Q110 PolarHBondContact O-N 2.77Å; T107-Q110 PolarHBondContact O-OE1 3.06Å; T107-Q110 PolarHBondContact OG1-OE1 3.03Å; S108-Q110 PolarHBondContact O-N 3.2Å; Q110-A112 PolarHBondContact O-N 2.88Å
111	D	96.9	Very high	90.5	Very high	26 Å²	26	46 Å²	46	14%	0.139	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	124.7	-177.3	-67	-13.3	0	0	0	110.2	R39 K69 S108 R126	R39-D111 IonicContact CZ-OD2 2.74Å; R39-D111 VanDerWaalsContact CZ-OD2 3.29Å; R39-D111 IonicContact NH1-OD2 2.54Å; R39-D111 PolarHBondContact NH1-OD2 3.26Å; R39-D111 IonicContact NH2-OD2 3.81Å; R39-D111 PolarHBondContact NH2-OD2 3.38Å; K69-D111 IonicContact NZ-OD1 3.37Å; K69-D111 PolarHBondContact NZ-OD1 3.22Å; S108-D111 VanDerWaalsContact O-CB 3.31Å; S108-D111 WeakPolarHBondContact O-CB 3.43Å; S108-D111 VanDerWaalsContact O-CG 3.24Å; S108-D111 PolarHBondContact O-N 2.98Å; S108-D111 VanDerWaalsContact O-N 3.09Å; D111-R126 HydrophobicContact CB-CB 3.63Å; D111-R126 HydrophobicContact CB-CG 4.24Å; D111-R126 VanDerWaalsContact O-CB 3.23Å; D111-R126 WeakPolarHBondContact O-CB 3.47Å; D111-R126 PolarHBondContact O-N 3.28Å
112	A	97.6	Very high	90.8	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.008	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	166.2	-177.6	0	0	0	0	0	111	V68 Q110 L123 V124 I132	V68-A112 HydrophobicContact CG2-CB 4.06Å; V68-A112 PolarHBondContact N-O 2.89Å; V68-A112 CarbonylContact O-C 3.52Å; V68-A112 PolarHBondContact O-N 2.86Å; Q110-A112 PolarHBondContact O-N 2.88Å; A112-L123 HydrophobicContact CB-CD1 4.15Å; A112-L123 HydrophobicContact CB-CG 4.38Å; A112-V124 CarbonylContact C-O 3.54Å; A112-V124 WeakPolarHBondContact CA-O 3.39Å; A112-V124 WeakPolarHBondContact CB-O 3.21Å; A112-I132 HydrophobicContact CB-CD1 3.98Å
113	V	97.9	Very high	91.1	Very high	5 Å²	5	42 Å²	42	3%	0.03	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	127.8	174	-177.5	0	0	0	0	108.1	L42 E65 K66 L123 V124	L42-V113 HydrophobicContact CD2-CB 4.42Å; L42-V113 HydrophobicContact CD2-CG1 3.75Å; L42-V113 HydrophobicContact CD2-CG2 3.73Å; E65-V113 HydrophobicContact CB-CG1 3.71Å; E65-V113 HydrophobicContact CG-CG1 3.88Å; K66-V113 WeakPolarHBondContact O-CA 3.29Å; V113-L123 WeakPolarHBondContact O-CA 3.15Å; V113-V124 PolarHBondContact N-O 3.05Å; V113-V124 PolarHBondContact O-N 3.49Å
114	V	98.1	Very high	91.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	121.3	165.5	-177.5	0	0	0	0	107.6	E65 K66 V68 L116 I121 L123 L199 L210	E65-V114 CarbonylContact C-O 3.57Å; E65-V114 VanDerWaalsContact CA-O 3.24Å; E65-V114 WeakPolarHBondContact CA-O 3.23Å; K66-V114 PolarHBondContact N-O 3.28Å; K66-V114 PolarHBondContact O-N 2.95Å; V68-V114 HydrophobicContact CB-CG2 4.19Å; V68-V114 HydrophobicContact CG1-CB 4.37Å; V68-V114 HydrophobicContact CG1-CG2 3.52Å; V68-V114 HydrophobicContact CG2-CG2 3.55Å; V114-L116 HydrophobicContact CB-CD1 4.16Å; V114-L116 HydrophobicContact CG1-CD1 3.53Å; V114-L116 HydrophobicContact CG1-CG 3.87Å; V114-I121 HydrophobicContact CG1-CG2 3.55Å; V114-L123 HydrophobicContact CB-CD1 4.46Å; V114-L123 HydrophobicContact CG2-CD1 3.51Å; V114-L199 HydrophobicContact CG2-CD1 3.83Å; V114-L210 HydrophobicContact CG1-CD1 4.45Å
115	S	96.9	Very high	92.5	Very high	5 Å²	5	42.3 Å²	42.3	4%	0.035	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	120	169.7	166.3	0	0	0	0	108.4	Y63 I64 I121 K122	Y63-S115 WeakPolarHBondContact CD2-OG 3.33Å; I64-S115 CarbonylContact O-C 3.52Å; I64-S115 WeakPolarHBondContact O-CA 3.17Å; S115-I121 WeakPolarHBondContact O-CA 3.42Å; S115-K122 PolarHBondContact N-O 2.9Å; S115-K122 PolarHBondContact O-N 2.82Å
116	L	95	Very high	93.1	Very high	1 Å²	1	36 Å²	36	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	132.7	-175.9	-62	93.3	0	0	0	110.2	Y63 I64 V114 L210 L213 L214	Y63-L116 CarbonylContact C-O 3.57Å; Y63-L116 WeakPolarHBondContact CA-O 3.26Å; Y63-L116 WeakPolarHBondContact CB-O 3.44Å; I64-L116 PolarHBondContact N-O 3.09Å; I64-L116 WeakPolarHBondContact O-CD1 3.33Å; I64-L116 PolarHBondContact O-N 3.44Å; V114-L116 HydrophobicContact CB-CD1 4.16Å; V114-L116 HydrophobicContact CG1-CD1 3.53Å; V114-L116 HydrophobicContact CG1-CG 3.87Å; L116-L210 HydrophobicContact CD1-CD1 3.9Å; L116-L210 HydrophobicContact CD2-CD1 3.79Å; L116-L210 HydrophobicContact CG-CD1 4.43Å; L116-L213 HydrophobicContact CD2-CB 4.02Å; L116-L214 HydrophobicContact CD2-CD1 4.3Å; L116-L214 HydrophobicContact CD2-CD2 3.55Å; L116-L214 HydrophobicContact CD2-CG 3.58Å
117	S	87.1	Confident	93.4	Very high	11 Å²	11	37.3 Å²	37.3	8%	0.077	19%	0.185	C	C	.	.			trans	-144.6	171.2	173.2	60.8	0	0	0	0	109.2	Y119 N120 V217	S117-Y119 PolarHBondContact O-N 2.76Å; S117-Y119 PolarHBondContact OG-N 2.76Å; S117-N120 PolarHBondContact N-O 2.92Å; S117-N120 PolarHBondContact OG-N 2.86Å; S117-N120 PolarHBondContact OG-O 3.35Å; S117-V217 WeakPolarHBondContact O-CG1 3.31Å
118	A	84.2	Confident	93.2	Very high	8 Å²	8	38.1 Å²	38.1	7%	0.066	20%	0.203	C	C	.	.	S	Bend	trans	-60.1	-21.8	171.2	0	0	0	0	0	112.9	L59 L60 I137 V221	L59-A118 VanDerWaalsContact O-CB 3.27Å; L59-A118 WeakPolarHBondContact O-CB 3.38Å; L59-A118 PolarHBondContact O-N 2.69Å; L60-A118 HydrophobicContact CD2-CB 3.88Å; A118-I137 WeakPolarHBondContact O-CG1 3.31Å; A118-V221 HydrophobicContact CB-CG2 4.33Å; A118-V221 WeakPolarHBondContact O-CG2 3.33Å
119	Y	82.1	Confident	93.3	Very high	151 Å²	151	39 Å²	39	59%	0.592	20%	0.199	S	C	*	.	S	Bend	trans	-89.4	-43.3	-174.7	-53	-70	0	0	0	113.5	L60 S117 I137	L60-Y119 VanDerWaalsContact O-CE2 3.28Å; L60-Y119 WeakPolarHBondContact O-CE2 3.26Å; L60-Y119 PolarHBondContact O-OH 2.83Å; S117-Y119 PolarHBondContact O-N 2.76Å; S117-Y119 PolarHBondContact OG-N 2.76Å; Y119-I137 PolarHBondContact O-N 2.9Å
120	N	88.3	Confident	93.4	Very high	21 Å²	21	37.2 Å²	37.2	11%	0.112	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	162.3	-174.5	53.8	90.8	0	0	0	112.2	S117 R134 V135	S117-N120 PolarHBondContact N-O 2.92Å; S117-N120 PolarHBondContact OG-N 2.86Å; S117-N120 PolarHBondContact OG-O 3.35Å; N120-R134 HydrophobicContact CB-CG 3.8Å; N120-R134 VanDerWaalsContact CG-NH1 3.3Å; N120-R134 PolarHBondContact ND2-NH1 2.94Å; N120-R134 WeakPolarHBondContact OD1-CG 3.38Å; N120-R134 PolarHBondContact OD1-NH1 3.01Å; N120-V135 CarbonylContact C-O 3.52Å; N120-V135 VanDerWaalsContact CA-O 3.23Å; N120-V135 WeakPolarHBondContact CA-O 3.45Å; N120-V135 WeakPolarHBondContact CB-O 3.45Å
121	I	96.2	Very high	93.4	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	127.5	157.7	-58	-178.5	0	0	0	108.4	V114 S115 R134 V135 I137 I140 I156 L214	V114-I121 HydrophobicContact CG1-CG2 3.55Å; S115-I121 WeakPolarHBondContact O-CA 3.42Å; I121-R134 CarbonylContact O-C 3.59Å; I121-R134 WeakPolarHBondContact O-CA 3.21Å; I121-V135 PolarHBondContact N-O 2.87Å; I121-V135 PolarHBondContact O-N 3.1Å; I121-I137 HydrophobicContact CG1-CD1 3.96Å; I121-I140 HydrophobicContact CB-CD1 4.49Å; I121-I140 HydrophobicContact CD1-CD1 3.3Å; I121-I140 HydrophobicContact CG1-CD1 3.7Å; I121-I156 HydrophobicContact CD1-CD1 3.81Å; I121-L214 HydrophobicContact CD1-CD1 3.93Å; I121-L214 HydrophobicContact CD1-CD2 3.34Å; I121-L214 HydrophobicContact CD1-CG 4.3Å; I121-L214 HydrophobicContact CG1-CD2 3.77Å
122	K	96.8	Very high	93.3	Very high	46 Å²	46	41.5 Å²	41.5	20%	0.2	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	127.2	172.8	-178.3	-175.8	67.5	-175.9	0	109.5	S115 V124 I131	S115-K122 PolarHBondContact N-O 2.9Å; S115-K122 PolarHBondContact O-N 2.82Å; K122-V124 HydrophobicContact CD-CG2 4.13Å; K122-V124 HydrophobicContact CG-CG2 3.92Å; K122-I131 HydrophobicContact CD-CD1 4.26Å; K122-I131 HydrophobicContact CD-CG1 4.45Å; K122-I131 HydrophobicContact CG-CG2 4.3Å
123	L	97.8	Very high	93.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	130.9	176.7	-165.5	72.5	0	0	0	109.4	V68 Y70 A112 V113 V114 I132 L133 L197 L199	V68-L123 HydrophobicContact CG2-CD1 3.9Å; Y70-L123 HydrophobicContact CD1-CD2 4.3Å; Y70-L123 HydrophobicContact CD2-CD2 3.41Å; Y70-L123 VanDerWaalsContact CD2-CD2 3.41Å; Y70-L123 HydrophobicContact CE2-CD2 3.94Å; Y70-L123 HydrophobicContact CG-CD2 3.61Å; A112-L123 HydrophobicContact CB-CD1 4.15Å; A112-L123 HydrophobicContact CB-CG 4.38Å; V113-L123 WeakPolarHBondContact O-CA 3.15Å; V114-L123 HydrophobicContact CB-CD1 4.46Å; V114-L123 HydrophobicContact CG2-CD1 3.51Å; L123-I132 HydrophobicContact CB-CB 4.28Å; L123-I132 HydrophobicContact CB-CD1 4.5Å; L123-I132 HydrophobicContact CD2-CB 4.23Å; L123-I132 HydrophobicContact CD2-CD1 3.87Å; L123-I132 HydrophobicContact CD2-CG2 4.09Å; L123-I132 HydrophobicContact CG-CB 4.32Å; L123-I132 HydrophobicContact CG-CD1 3.74Å; L123-I132 PolarHBondContact O-N 3.28Å; L123-L133 HydrophobicContact CB-CD1 3.78Å; L123-L133 HydrophobicContact CB-CG 3.96Å; L123-L133 HydrophobicContact CD2-CD1 4.43Å; L123-L133 HydrophobicContact CD2-CD2 4.36Å; L123-L133 HydrophobicContact CD2-CG 4.24Å; L123-L133 PolarHBondContact N-O 2.73Å; L123-L133 PolarHBondContact O-N 3.3Å; L123-L197 HydrophobicContact CD2-CD1 4.2Å; L123-L199 HydrophobicContact CD1-CD2 4.08Å; L123-L199 HydrophobicContact CD2-CD2 4.1Å
124	V	96.9	Very high	93.1	Very high	18 Å²	18	48.9 Å²	48.9	11%	0.109	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	138.2	-172.8	-172.7	0	0	0	0	109.4	A112 V113 K122 E129 D130 I131	A112-V124 CarbonylContact C-O 3.54Å; A112-V124 WeakPolarHBondContact CA-O 3.39Å; A112-V124 WeakPolarHBondContact CB-O 3.21Å; V113-V124 PolarHBondContact N-O 3.05Å; V113-V124 PolarHBondContact O-N 3.49Å; K122-V124 HydrophobicContact CD-CG2 4.13Å; K122-V124 HydrophobicContact CG-CG2 3.92Å; V124-E129 HydrophobicContact CG1-CB 4.16Å; V124-E129 WeakPolarHBondContact CG1-O 3.35Å; V124-D130 WeakPolarHBondContact CA-O 3.17Å; V124-D130 WeakPolarHBondContact CG1-O 3.38Å; V124-I131 HydrophobicContact CG2-CG1 4.36Å
125	W	96.6	Very high	92.8	Very high	82 Å²	82	49.5 Å²	49.5	31%	0.311	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	138	172.6	-71.2	118.5	0	0	0	110.9	Y70 E109 D127 E129 D130 I132	Y70-W125 AromaticContact CD1-CH2 3.59Å; Y70-W125 HydrophobicContact CD1-CH2 3.59Å; Y70-W125 HydrophobicContact CD1-CZ2 4.02Å; Y70-W125 HydrophobicContact CD1-CZ3 4.19Å; Y70-W125 HydrophobicContact CE1-CH2 4.34Å; Y70-W125 HydrophobicContact CE1-CZ2 4.43Å; E109-W125 VanDerWaalsContact O-CZ3 3.23Å; E109-W125 WeakPolarHBondContact O-CZ3 3.17Å; W125-D127 VanDerWaalsContact C-N 3.31Å; W125-D127 WeakPolarHBondContact CB-O 3.36Å; W125-D127 PolarHBondContact O-N 3.23Å; W125-E129 VanDerWaalsContact O-CA 3.3Å; W125-E129 WeakPolarHBondContact O-CA 3.42Å; W125-E129 PolarHBondContact O-N 3.14Å; W125-D130 PolarHBondContact N-O 3.48Å; W125-I132 HydrophobicContact CD2-CD1 3.54Å; W125-I132 HydrophobicContact CD2-CG1 3.71Å; W125-I132 VanDerWaalsContact CE2-CG1 3.46Å; W125-I132 HydrophobicContact CE3-CD1 3.77Å; W125-I132 HydrophobicContact CE3-CG1 4.43Å; W125-I132 HydrophobicContact CG-CD1 3.93Å; W125-I132 HydrophobicContact CG-CG1 3.81Å; W125-I132 HydrophobicContact CH2-CD1 4.29Å; W125-I132 HydrophobicContact CZ2-CD1 4.08Å; W125-I132 HydrophobicContact CZ2-CG1 4.02Å; W125-I132 HydrophobicContact CZ3-CD1 4.11Å
126	R	94.8	Very high	92.4	Very high	22 Å²	22	51 Å²	51	8%	0.083	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-36.3	-178.3	-169.1	66.2	170	131.3	-1.1	111.9	R39 R40 L42 E67 D111	R39-R126 HydrophobicContact CG-CG 4.36Å; R40-R126 PolarHBondContact O-NH1 2.83Å; R40-R126 PolarHBondContact O-NH2 2.84Å; L42-R126 VanDerWaalsContact CD2-NH1 3.3Å; E67-R126 IonicContact OE1-CZ 3.7Å; E67-R126 IonicContact OE1-NE 3.34Å; E67-R126 PolarHBondContact OE1-NE 3.2Å; E67-R126 IonicContact OE1-NH2 3.65Å; E67-R126 PolarHBondContact OE1-NH2 2.94Å; D111-R126 HydrophobicContact CB-CB 3.63Å; D111-R126 HydrophobicContact CB-CG 4.24Å; D111-R126 VanDerWaalsContact O-CB 3.23Å; D111-R126 WeakPolarHBondContact O-CB 3.47Å; D111-R126 PolarHBondContact O-N 3.28Å
127	D	90.7	Very high	92.1	Very high	87 Å²	87	51.1 Å²	51.1	47%	0.465	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	130	174.6	-59	-38.9	0	0	0	108.7	R39 W125 E129	R39-D127 IonicContact CZ-OD1 2.86Å; R39-D127 IonicContact CZ-OD2 3.57Å; R39-D127 IonicContact NE-OD1 2.89Å; R39-D127 PolarHBondContact NE-OD1 3.17Å; R39-D127 IonicContact NE-OD2 3.24Å; R39-D127 IonicContact NH2-OD1 2.93Å; R39-D127 PolarHBondContact NH2-OD1 3.36Å; R39-D127 IonicContact NH2-OD2 3.51Å; R39-D127 PolarHBondContact NH2-OD2 3.35Å; W125-D127 VanDerWaalsContact C-N 3.31Å; W125-D127 WeakPolarHBondContact CB-O 3.36Å; W125-D127 PolarHBondContact O-N 3.23Å; D127-E129 PolarHBondContact O-N 3.01Å
128	G	87.4	Confident	91.8	Very high	67 Å²	67	56.3 Å²	56.3	69%	0.691	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	-22.7	-176.9	0	0	0	0	0	115.1	D130	G128-D130 PolarHBondContact O-N 2.81Å
129	E	91.1	Very high	92	Very high	93 Å²	93	57.6 Å²	57.6	44%	0.435	29%	0.288	S	S	.	.			trans	58.7	25.3	-179.3	-58.8	-166.9	137.6	0	0	114.3	R40 V124 W125 D127	R40-E129 IonicContact CZ-OE1 3.79Å; R40-E129 IonicContact NE-OE1 3.42Å; R40-E129 PolarHBondContact NE-OE1 2.95Å; R40-E129 IonicContact NH2-OE1 3.16Å; V124-E129 HydrophobicContact CG1-CB 4.16Å; V124-E129 WeakPolarHBondContact CG1-O 3.35Å; W125-E129 VanDerWaalsContact O-CA 3.3Å; W125-E129 WeakPolarHBondContact O-CA 3.42Å; W125-E129 PolarHBondContact O-N 3.14Å; D127-E129 PolarHBondContact O-N 3.01Å
130	D	93.8	Very high	92.5	Very high	111 Å²	111	50.5 Å²	50.5	59%	0.594	26%	0.26	S	S	*	.			trans	-72.4	134.6	174.2	-71.7	-42.6	0	0	0	111	V124 W125 G128 I132	V124-D130 WeakPolarHBondContact CA-O 3.17Å; V124-D130 WeakPolarHBondContact CG1-O 3.38Å; W125-D130 PolarHBondContact N-O 3.48Å; G128-D130 PolarHBondContact O-N 2.81Å; D130-I132 PolarHBondContact O-N 2.86Å
131	I	94.9	Very high	92.6	Very high	100 Å²	100	52.9 Å²	52.9	51%	0.513	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	126.7	179.3	-59.5	173.9	0	0	0	109.4	K122 V124	K122-I131 HydrophobicContact CD-CD1 4.26Å; K122-I131 HydrophobicContact CD-CG1 4.45Å; K122-I131 HydrophobicContact CG-CG2 4.3Å; V124-I131 HydrophobicContact CG2-CG1 4.36Å
132	I	95.6	Very high	92.4	Very high	41 Å²	41	53.7 Å²	53.7	21%	0.21	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-54.2	173.9	-62.2	157.3	0	0	0	109.7	Y70 A112 L123 W125 D130	Y70-I132 HydrophobicContact CD1-CD1 4.03Å; Y70-I132 HydrophobicContact CD1-CG2 3.93Å; Y70-I132 HydrophobicContact CE1-CG2 3.51Å; Y70-I132 HydrophobicContact CG-CD1 4.36Å; A112-I132 HydrophobicContact CB-CD1 3.98Å; L123-I132 HydrophobicContact CB-CB 4.28Å; L123-I132 HydrophobicContact CB-CD1 4.5Å; L123-I132 HydrophobicContact CD2-CB 4.23Å; L123-I132 HydrophobicContact CD2-CD1 3.87Å; L123-I132 HydrophobicContact CD2-CG2 4.09Å; L123-I132 HydrophobicContact CG-CB 4.32Å; L123-I132 HydrophobicContact CG-CD1 3.74Å; L123-I132 PolarHBondContact O-N 3.28Å; W125-I132 HydrophobicContact CD2-CD1 3.54Å; W125-I132 HydrophobicContact CD2-CG1 3.71Å; W125-I132 VanDerWaalsContact CE2-CG1 3.46Å; W125-I132 HydrophobicContact CE3-CD1 3.77Å; W125-I132 HydrophobicContact CE3-CG1 4.43Å; W125-I132 HydrophobicContact CG-CD1 3.93Å; W125-I132 HydrophobicContact CG-CG1 3.81Å; W125-I132 HydrophobicContact CH2-CD1 4.29Å; W125-I132 HydrophobicContact CZ2-CD1 4.08Å; W125-I132 HydrophobicContact CZ2-CG1 4.02Å; W125-I132 HydrophobicContact CZ3-CD1 4.11Å; D130-I132 PolarHBondContact O-N 2.86Å
133	L	95.6	Very high	92.4	Very high	24 Å²	24	53 Å²	53	13%	0.126	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	162.1	-177.8	54.7	84.4	0	0	0	111.1	Y70 L123 V135 L197	Y70-L133 HydrophobicContact CE2-CD2 4.39Å; L123-L133 HydrophobicContact CB-CD1 3.78Å; L123-L133 HydrophobicContact CB-CG 3.96Å; L123-L133 HydrophobicContact CD2-CD1 4.43Å; L123-L133 HydrophobicContact CD2-CD2 4.36Å; L123-L133 HydrophobicContact CD2-CG 4.24Å; L123-L133 PolarHBondContact N-O 2.73Å; L123-L133 PolarHBondContact O-N 3.3Å; L133-V135 HydrophobicContact CD1-CG2 3.76Å; L133-L197 HydrophobicContact CD1-CD2 3.9Å; L133-L197 HydrophobicContact CD2-CD1 3.92Å; L133-L197 HydrophobicContact CD2-CD2 4.45Å
134	R	94.6	Very high	92.3	Very high	136 Å²	136	54 Å²	54	51%	0.513	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	128.6	170.9	-174.9	-178.1	-68.7	-115.6	14	108.2	N120 I121	N120-R134 HydrophobicContact CB-CG 3.8Å; N120-R134 VanDerWaalsContact CG-NH1 3.3Å; N120-R134 PolarHBondContact ND2-NH1 2.94Å; N120-R134 WeakPolarHBondContact OD1-CG 3.38Å; N120-R134 PolarHBondContact OD1-NH1 3.01Å; I121-R134 CarbonylContact O-C 3.59Å; I121-R134 WeakPolarHBondContact O-CA 3.21Å
135	V	92.4	Very high	92.4	Very high	13 Å²	13	56.1 Å²	56.1	8%	0.079	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	115.3	-179.9	-172.1	0	0	0	0	108.4	N120 I121 L133 D139 I140 T158	N120-V135 CarbonylContact C-O 3.52Å; N120-V135 VanDerWaalsContact CA-O 3.23Å; N120-V135 WeakPolarHBondContact CA-O 3.45Å; N120-V135 WeakPolarHBondContact CB-O 3.45Å; I121-V135 PolarHBondContact N-O 2.87Å; I121-V135 PolarHBondContact O-N 3.1Å; L133-V135 HydrophobicContact CD1-CG2 3.76Å; V135-D139 HydrophobicContact CG1-CB 4.08Å; V135-I140 HydrophobicContact CG1-CD1 4.21Å; V135-I140 HydrophobicContact CG1-CG1 3.64Å; V135-T158 HydrophobicContact CG1-CG2 3.73Å; V135-T158 HydrophobicContact CG2-CG2 4.42Å
136	P	88.9	Confident	92.4	Very high	38 Å²	38	52.7 Å²	52.7	25%	0.247	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	145.4	171	-22.8	33.3	0	0	0	111.7	H138 D139	P136-H138 WeakPolarHBondContact CB-CE1 3.21Å; P136-H138 WeakPolarHBondContact CB-NE2 3.45Å; P136-H138 PolarHBondContact O-N 3.41Å; P136-D139 VanDerWaalsContact CD-OD2 3.32Å; P136-D139 WeakPolarHBondContact CD-OD2 3.38Å; P136-D139 WeakPolarHBondContact CG-OD2 3.15Å; P136-D139 PolarHBondContact O-N 3.01Å; P136-D139 VanDerWaalsContact O-N 3.09Å
137	I	87.5	Confident	92.4	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.01	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-61	-35.6	-178.3	-63.2	-53.3	0	0	0	111.9	A118 Y119 I121 D139 I140 V217 F218 V221	A118-I137 WeakPolarHBondContact O-CG1 3.31Å; Y119-I137 PolarHBondContact O-N 2.9Å; I121-I137 HydrophobicContact CG1-CD1 3.96Å; I137-D139 PolarHBondContact O-N 3.37Å; I137-I140 HydrophobicContact CD1-CD1 4.09Å; I137-I140 PolarHBondContact O-N 2.95Å; I137-I140 VanDerWaalsContact O-N 3.13Å; I137-V217 HydrophobicContact CB-CG1 4.4Å; I137-V217 HydrophobicContact CD1-CG1 3.53Å; I137-V217 HydrophobicContact CG1-CG1 3.58Å; I137-V217 HydrophobicContact CG2-CG1 3.89Å; I137-F218 HydrophobicContact CG2-CD1 3.57Å; I137-F218 HydrophobicContact CG2-CE1 3.78Å; I137-V221 HydrophobicContact CB-CG2 4.35Å; I137-V221 HydrophobicContact CG2-CB 4.21Å; I137-V221 HydrophobicContact CG2-CG1 4.37Å; I137-V221 HydrophobicContact CG2-CG2 3.96Å
138	H	82	Confident	92.5	Very high	121 Å²	121	56 Å²	56	56%	0.56	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-67.1	-21.5	178.3	56.9	-103.2	0	0	0	113.8	P136 I140	P136-H138 WeakPolarHBondContact CB-CE1 3.21Å; P136-H138 WeakPolarHBondContact CB-NE2 3.45Å; P136-H138 PolarHBondContact O-N 3.41Å; H138-I140 VanDerWaalsContact C-N 3.28Å
139	D	88.1	Confident	92.7	Very high	34 Å²	34	59.1 Å²	59.1	18%	0.182	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-83.4	-5	175.6	-72	-27.9	0	0	0	112.8	V135 P136 I137 T158 A159	V135-D139 HydrophobicContact CG1-CB 4.08Å; P136-D139 VanDerWaalsContact CD-OD2 3.32Å; P136-D139 WeakPolarHBondContact CD-OD2 3.38Å; P136-D139 WeakPolarHBondContact CG-OD2 3.15Å; P136-D139 PolarHBondContact O-N 3.01Å; P136-D139 VanDerWaalsContact O-N 3.09Å; I137-D139 PolarHBondContact O-N 3.37Å; D139-T158 CarbonylContact O-C 3.54Å; D139-T158 WeakPolarHBondContact O-CA 3.43Å; D139-A159 HydrophobicContact CB-CB 4.23Å; D139-A159 PolarHBondContact O-N 3.2Å
140	I	92.2	Very high	92.5	Very high	3 Å²	3	59.3 Å²	59.3	2%	0.015	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	113.1	-178.4	-53.5	173.2	0	0	0	109.4	I121 V135 I137 H138 V143 I156 T158 F218	I121-I140 HydrophobicContact CB-CD1 4.49Å; I121-I140 HydrophobicContact CD1-CD1 3.3Å; I121-I140 HydrophobicContact CG1-CD1 3.7Å; V135-I140 HydrophobicContact CG1-CD1 4.21Å; V135-I140 HydrophobicContact CG1-CG1 3.64Å; I137-I140 HydrophobicContact CD1-CD1 4.09Å; I137-I140 PolarHBondContact O-N 2.95Å; I137-I140 VanDerWaalsContact O-N 3.13Å; H138-I140 VanDerWaalsContact C-N 3.28Å; I140-V143 HydrophobicContact CG2-CG2 4.22Å; I140-I156 HydrophobicContact CD1-CG2 4.33Å; I140-I156 HydrophobicContact CG1-CG2 4.3Å; I140-I156 HydrophobicContact CG2-CG2 3.48Å; I140-I156 VanDerWaalsContact CG2-CG2 3.48Å; I140-T158 HydrophobicContact CG1-CG2 4.32Å; I140-F218 HydrophobicContact CB-CE1 3.89Å; I140-F218 HydrophobicContact CB-CZ 3.94Å; I140-F218 HydrophobicContact CD1-CE1 4.42Å; I140-F218 HydrophobicContact CG2-CE1 4.06Å; I140-F218 HydrophobicContact CG2-CZ 3.55Å
141	A	90.8	Very high	92.5	Very high	71 Å²	71	56 Å²	56	59%	0.587	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	-35.7	179.2	0	0	0	0	0	112.5	K157	A141-K157 HydrophobicContact CB-CD 4.16Å; A141-K157 HydrophobicContact CB-CG 4.2Å; A141-K157 PolarHBondContact N-O 3.48Å
142	A	92.6	Very high	92.6	Very high	19 Å²	19	52.5 Å²	52.5	16%	0.157	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	157.5	-179.9	0	0	0	0	0	112.5	P83 K157	P83-A142 HydrophobicContact CB-CB 3.66Å; P83-A142 HydrophobicContact CG-CB 3.52Å; A142-K157 HydrophobicContact CB-CB 4.31Å; A142-K157 PolarHBondContact N-O 2.8Å; A142-K157 PolarHBondContact O-N 3.02Å
143	V	96.6	Very high	92.7	Very high	31 Å²	31	50.5 Å²	50.5	19%	0.188	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	137.3	168.7	-177.6	0	0	0	0	107.5	I140 V154 V155 I156 L214 F218	I140-V143 HydrophobicContact CG2-CG2 4.22Å; V143-V154 HydrophobicContact CG1-CG1 3.77Å; V143-V155 CarbonylContact C-O 3.58Å; V143-V155 WeakPolarHBondContact CA-O 3.27Å; V143-I156 HydrophobicContact CG1-CG1 4.27Å; V143-I156 HydrophobicContact CG2-CG1 4.28Å; V143-I156 HydrophobicContact CG2-CG2 4.31Å; V143-L214 HydrophobicContact CB-CD1 4.4Å; V143-L214 HydrophobicContact CG1-CD1 3.95Å; V143-L214 HydrophobicContact CG2-CB 4.11Å; V143-L214 HydrophobicContact CG2-CD1 3.65Å; V143-L214 HydrophobicContact CG2-CG 4.4Å; V143-F218 HydrophobicContact CG2-CE2 3.85Å; V143-F218 HydrophobicContact CG2-CZ 3.91Å
144	S	96	Very high	92.8	Very high	20 Å²	20	49.4 Å²	49.4	14%	0.14	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	126	-176.4	-62.1	0	0	0	0	111	P83 V154 V155	P83-S144 PolarHBondContact O-OG 3.41Å; P83-S144 VanDerWaalsContact O-OG 3.12Å; S144-V154 WeakPolarHBondContact O-CA 3.44Å; S144-V155 PolarHBondContact N-O 3.17Å; S144-V155 PolarHBondContact O-N 3.21Å
145	Y	97.8	Very high	93	Very high	64 Å²	64	43.1 Å²	43.1	25%	0.251	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	121.7	169.3	165.3	-136.1	0	0	0	109.9	R147 H152 L153 K204 A207 E208	Y145-R147 HydrophobicContact CE2-CB 4.39Å; Y145-H152 HydrophobicContact CE2-CB 3.95Å; Y145-H152 AromaticContact CE2-ND1 3.7Å; Y145-H152 AromaticContact CZ-ND1 3.65Å; Y145-H152 PolarHBondContact OH-CE1 2.86Å; Y145-H152 PolarHBondContact OH-ND1 2.94Å; Y145-L153 CarbonylContact C-O 3.54Å; Y145-L153 WeakPolarHBondContact CA-O 3.33Å; Y145-L153 WeakPolarHBondContact CD2-O 3.17Å; Y145-K204 HydrophobicContact CE1-CG 4.05Å; Y145-A207 HydrophobicContact CD1-CB 4.27Å; Y145-A207 HydrophobicContact CD2-CB 3.41Å; Y145-A207 VanDerWaalsContact CD2-CB 3.41Å; Y145-A207 HydrophobicContact CE1-CB 4.42Å; Y145-A207 HydrophobicContact CE2-CB 3.64Å; Y145-A207 HydrophobicContact CG-CB 3.78Å; Y145-E208 HydrophobicContact CD1-CG 4.33Å; Y145-E208 HydrophobicContact CE1-CG 4.43Å
146	I	97.2	Very high	93.2	Very high	9 Å²	9	42.6 Å²	42.6	5%	0.046	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123.2	177	-61.2	174.5	0	0	0	109.2	R86 V89 L90 L153 V155	R86-I146 HydrophobicContact CG-CG2 3.91Å; V89-I146 HydrophobicContact CB-CD1 3.6Å; V89-I146 HydrophobicContact CG1-CD1 3.37Å; V89-I146 HydrophobicContact CG2-CD1 4.2Å; L90-I146 HydrophobicContact CD1-CG2 4.07Å; L90-I146 HydrophobicContact CD2-CG2 3.89Å; L90-I146 HydrophobicContact CG-CG2 3.98Å; I146-L153 HydrophobicContact CB-CB 4.45Å; I146-L153 PolarHBondContact N-O 3.46Å; I146-L153 WeakPolarHBondContact O-CA 3.09Å; I146-L153 WeakPolarHBondContact O-CB 3.41Å; I146-L153 PolarHBondContact O-N 3.03Å; I146-V155 HydrophobicContact CD1-CG2 4.33Å
147	R	95.8	Very high	93.6	Very high	152 Å²	152	42 Å²	42	57%	0.574	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	123.9	169	-171	174.6	172.6	-121.3	-11.9	110.4	R86 Y145 D149	R86-R147 PolarHBondContact NE-O 2.8Å; R86-R147 PolarHBondContact NH2-O 3.26Å; Y145-R147 HydrophobicContact CE2-CB 4.39Å; R147-D149 PolarHBondContact NE-O 3.49Å; R147-D149 PolarHBondContact NH2-O 3.05Å
148	D	92.3	Very high	93.9	Very high	26 Å²	26	42.2 Å²	42.2	14%	0.139	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	94.7	178	-174.3	31.1	0	0	0	108.9	L90 R97 S150 L151 L153	L90-D148 HydrophobicContact CD2-CB 4.17Å; R97-D148 IonicContact NH1-OD2 3.8Å; R97-D148 PolarHBondContact NH1-OD2 3.01Å; D148-S150 PolarHBondContact O-N 3.4Å; D148-L151 HydrophobicContact CB-CB 4.44Å; D148-L151 PolarHBondContact N-O 2.85Å; D148-L151 WeakPolarHBondContact O-CA 3.44Å; D148-L151 WeakPolarHBondContact O-CB 3.34Å; D148-L151 PolarHBondContact O-N 3.4Å; D148-L153 HydrophobicContact CB-CD1 4.02Å; D148-L153 HydrophobicContact CB-CG 4.49Å
149	D	90.2	Very high	94.3	Very high	133 Å²	133	38.9 Å²	38.9	71%	0.711	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	-101.9	-169.8	-64.1	-25.1	0	0	0	114	R147	R147-D149 PolarHBondContact NE-O 3.49Å; R147-D149 PolarHBondContact NH2-O 3.05Å
150	S	88.6	Confident	94.1	Very high	97 Å²	97	39.9 Å²	39.9	68%	0.678	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-10	176.3	57.2	0	0	0	0	113.7	D148	D148-S150 PolarHBondContact O-N 3.4Å
151	L	93.1	Very high	92.8	Very high	42 Å²	42	46.8 Å²	46.8	22%	0.22	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	135.7	174.8	-84.3	87.6	0	0	0	111.1	L106 D148 L153	L106-L151 HydrophobicContact CD1-CD2 3.6Å; L106-L151 HydrophobicContact CD1-CG 3.91Å; L106-L151 HydrophobicContact CG-CD2 4.2Å; D148-L151 HydrophobicContact CB-CB 4.44Å; D148-L151 PolarHBondContact N-O 2.85Å; D148-L151 WeakPolarHBondContact O-CA 3.44Å; D148-L151 WeakPolarHBondContact O-CB 3.34Å; D148-L151 PolarHBondContact O-N 3.4Å; L151-L153 HydrophobicContact CB-CD2 4.31Å; L151-L153 HydrophobicContact CB-CG 4.45Å; L151-L153 HydrophobicContact CD2-CD2 3.96Å
152	H	97.1	Very high	90.8	Very high	26 Å²	26	49.2 Å²	49.2	12%	0.12	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	100.5	170.3	-62.2	-83.4	0	0	0	108.4	Y145 A200 V201 N203 K204 A207	Y145-H152 HydrophobicContact CE2-CB 3.95Å; Y145-H152 AromaticContact CE2-ND1 3.7Å; Y145-H152 AromaticContact CZ-ND1 3.65Å; Y145-H152 PolarHBondContact OH-CE1 2.86Å; Y145-H152 PolarHBondContact OH-ND1 2.94Å; H152-A200 CarbonylContact O-C 3.6Å; H152-A200 WeakPolarHBondContact O-CA 3.42Å; H152-V201 HydrophobicContact CB-CG2 3.75Å; H152-V201 PolarHBondContact O-N 2.76Å; H152-N203 VanDerWaalsContact CD2-CA 3.43Å; H152-N203 WeakPolarHBondContact CD2-CA 3.3Å; H152-K204 PolarHBondContact CE1-N 3.13Å; H152-K204 VanDerWaalsContact CE1-N 3.34Å; H152-K204 PolarHBondContact ND1-N 3.19Å; H152-A207 HydrophobicContact CB-CB 4.5Å
153	L	97.3	Very high	88.6	Confident	0 Å²	0	52 Å²	52	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	133.2	-177.3	-58.2	176.4	0	0	0	110.4	L71 L90 I93 Y145 I146 D148 L151 L199 A200	L71-L153 HydrophobicContact CD2-CD2 3.99Å; L90-L153 HydrophobicContact CD2-CD1 4.09Å; I93-L153 HydrophobicContact CD1-CD1 4.17Å; Y145-L153 CarbonylContact C-O 3.54Å; Y145-L153 WeakPolarHBondContact CA-O 3.33Å; Y145-L153 WeakPolarHBondContact CD2-O 3.17Å; I146-L153 HydrophobicContact CB-CB 4.45Å; I146-L153 PolarHBondContact N-O 3.46Å; I146-L153 WeakPolarHBondContact O-CA 3.09Å; I146-L153 WeakPolarHBondContact O-CB 3.41Å; I146-L153 PolarHBondContact O-N 3.03Å; D148-L153 HydrophobicContact CB-CD1 4.02Å; D148-L153 HydrophobicContact CB-CG 4.49Å; L151-L153 HydrophobicContact CB-CD2 4.31Å; L151-L153 HydrophobicContact CB-CG 4.45Å; L151-L153 HydrophobicContact CD2-CD2 3.96Å; L153-L199 CarbonylContact C-O 3.49Å; L153-L199 VanDerWaalsContact CA-O 3.26Å; L153-L199 WeakPolarHBondContact CA-O 3.34Å; L153-A200 HydrophobicContact CD2-CB 4.08Å
154	V	98.3	Very high	85.6	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	116.5	166.4	179.8	0	0	0	0	107.3	V143 S144 I156 L199 V201 A207 L210	V143-V154 HydrophobicContact CG1-CG1 3.77Å; S144-V154 WeakPolarHBondContact O-CA 3.44Å; V154-I156 HydrophobicContact CG1-CG1 4.46Å; V154-L199 HydrophobicContact CB-CB 4.39Å; V154-L199 PolarHBondContact N-O 2.99Å; V154-L199 WeakPolarHBondContact O-CB 3.42Å; V154-L199 PolarHBondContact O-N 2.93Å; V154-V201 HydrophobicContact CG2-CG1 4.34Å; V154-V201 HydrophobicContact CG2-CG2 4.31Å; V154-A207 HydrophobicContact CG2-CB 3.96Å; V154-L210 HydrophobicContact CB-CD2 4.29Å; V154-L210 HydrophobicContact CG1-CD2 3.99Å; V154-L210 HydrophobicContact CG2-CD2 4.25Å
155	V	98.1	Very high	82.6	Confident	5 Å²	5	57.9 Å²	57.9	3%	0.03	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	123.7	-177.2	-176.3	0	0	0	0	108.5	V89 I93 V143 S144 I146 L196 L197	V89-V155 HydrophobicContact CG1-CB 4.43Å; V89-V155 HydrophobicContact CG1-CG1 4.14Å; V89-V155 HydrophobicContact CG1-CG2 4Å; I93-V155 HydrophobicContact CD1-CG2 3.97Å; V143-V155 CarbonylContact C-O 3.58Å; V143-V155 WeakPolarHBondContact CA-O 3.27Å; S144-V155 PolarHBondContact N-O 3.17Å; S144-V155 PolarHBondContact O-N 3.21Å; I146-V155 HydrophobicContact CD1-CG2 4.33Å; V155-L196 HydrophobicContact CG1-CB 4.18Å; V155-L196 HydrophobicContact CG1-CD1 4.5Å; V155-L196 HydrophobicContact CG1-CD2 4.03Å; V155-L196 HydrophobicContact CG1-CG 4.48Å; V155-L197 WeakPolarHBondContact CA-O 3.48Å
156	I	97.8	Very high	79.9	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.005	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	115	179.1	-53.7	176.4	0	0	0	107.6	I121 I140 V143 V154 T158 L197 L199 L214	I121-I156 HydrophobicContact CD1-CD1 3.81Å; I140-I156 HydrophobicContact CD1-CG2 4.33Å; I140-I156 HydrophobicContact CG1-CG2 4.3Å; I140-I156 HydrophobicContact CG2-CG2 3.48Å; I140-I156 VanDerWaalsContact CG2-CG2 3.48Å; V143-I156 HydrophobicContact CG1-CG1 4.27Å; V143-I156 HydrophobicContact CG2-CG1 4.28Å; V143-I156 HydrophobicContact CG2-CG2 4.31Å; V154-I156 HydrophobicContact CG1-CG1 4.46Å; I156-T158 HydrophobicContact CG2-CG2 3.87Å; I156-L197 HydrophobicContact CB-CB 4.15Å; I156-L197 HydrophobicContact CD1-CD2 4.15Å; I156-L197 PolarHBondContact N-O 2.96Å; I156-L197 PolarHBondContact O-N 2.86Å; I156-L199 HydrophobicContact CD1-CD1 4.07Å; I156-L214 HydrophobicContact CD1-CD1 4.25Å
157	K	96.3	Very high	76.6	Confident	27 Å²	27	65.5 Å²	65.5	12%	0.117	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	121.1	175.6	-177.6	-175.5	177	-177.3	0	108.5	G79 L81 P83 A141 A142 C194 C195 L196	G79-K157 PolarHBondContact O-NZ 2.94Å; L81-K157 PolarHBondContact O-NZ 2.85Å; P83-K157 HydrophobicContact CB-CD 4.48Å; A141-K157 HydrophobicContact CB-CD 4.16Å; A141-K157 HydrophobicContact CB-CG 4.2Å; A141-K157 PolarHBondContact N-O 3.48Å; A142-K157 HydrophobicContact CB-CB 4.31Å; A142-K157 PolarHBondContact N-O 2.8Å; A142-K157 PolarHBondContact O-N 3.02Å; K157-C194 HydrophobicContact CG-CB 4.38Å; K157-C195 WeakPolarHBondContact CA-O 3.4Å; K157-L196 HydrophobicContact CB-CD2 3.9Å; K157-L196 HydrophobicContact CG-CD2 4.06Å
158	T	94.7	Very high	73.9	Confident	5 Å²	5	64.6 Å²	64.6	3%	0.031	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	156.4	-177.6	75.7	0	0	0	0	111	V135 D139 I140 I156 C194 C195	V135-T158 HydrophobicContact CG1-CG2 3.73Å; V135-T158 HydrophobicContact CG2-CG2 4.42Å; D139-T158 CarbonylContact O-C 3.54Å; D139-T158 WeakPolarHBondContact O-CA 3.43Å; I140-T158 HydrophobicContact CG1-CG2 4.32Å; I156-T158 HydrophobicContact CG2-CG2 3.87Å; T158-C194 WeakPolarHBondContact O-CA 3.1Å; T158-C194 VanDerWaalsContact O-CB 3.26Å; T158-C194 WeakPolarHBondContact O-CB 3.49Å; T158-C195 PolarHBondContact N-O 2.8Å; T158-C195 PolarHBondContact O-N 2.91Å; T158-C195 WeakPolarHBondContact OG1-CB 3.45Å
159	A	90.3	Very high	71.1	Confident	52 Å²	52	68.9 Å²	68.9	43%	0.43	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	149.4	164.7	0	0	0	0	0	109.8	D139	D139-A159 HydrophobicContact CB-CB 4.23Å; D139-A159 PolarHBondContact O-N 3.2Å
160	Q	83	Confident	68.4	Low	55 Å²	55	67.6 Å²	67.6	26%	0.257	46%	0.459	S	S	.	.			trans	-99.9	109.6	172.5	-176.8	165	-28.8	0	0	108.2	S162 V193 C194	Q160-S162 PolarHBondContact O-N 2.78Å; Q160-S162 VanDerWaalsContact O-N 3.08Å; Q160-V193 HydrophobicContact CB-CG2 4.19Å; Q160-V193 WeakPolarHBondContact CB-O 3.46Å; Q160-V193 HydrophobicContact CG-CG2 4.27Å; Q160-C194 PolarHBondContact OE1-O 2.85Å
161	E	66.3	Low	65.5	Low	147 Å²	147	69 Å²	69	69%	0.687	47%	0.467	S	S	*	.			trans	-48.4	115	171.6	-77.5	-81.4	177.2	0	0	110.1	G163	E161-G163 PolarHBondContact O-N 2.69Å
162	S	48.4	Very low	62.9	Low	122 Å²	122	72 Å²	72	85%	0.853	49%	0.489	S	S	*	.			trans	-78.1	72.5	177.1	49.6	0	0	0	0	109.8	Q160 G164	Q160-S162 PolarHBondContact O-N 2.78Å; Q160-S162 VanDerWaalsContact O-N 3.08Å; S162-G164 PolarHBondContact O-N 3.19Å
163	G	45.1	Very low	59.7	Low	79 Å²	79	77.7 Å²	77.7	81%	0.814	52%	0.52	S	S	*	.			trans	52.9	60.7	160.7	0	0	0	0	0	116.6	E161	E161-G163 PolarHBondContact O-N 2.69Å
164	G	33.6	Very low	56.6	Low	65 Å²	65	84.1 Å²	84.1	67%	0.67	55%	0.554	S	S	*	*			trans	-91.4	108.1	157.5	0	0	0	0	0	110.8	S162	S162-G164 PolarHBondContact O-N 3.19Å
165	S	33.4	Very low	53.4	Low	109 Å²	109	89.8 Å²	89.8	76%	0.762	58%	0.584	S	S	*	*			trans	-55.8	141.8	-179	171.6	0	0	0	0	114.6
166	P	41.2	Very low	50.4	Low	118 Å²	118	98.6 Å²	98.6	77%	0.766	62%	0.622	S	S	*	*			trans	-101.8	116.4	151.6	31.5	-20.6	0	0	0	110.5
167	C	27.3	Very low	47.2	Very low	114 Å²	114	103.3 Å²	103.3	77%	0.77	66%	0.655	S	S	*	*			trans	29.4	141.4	158.3	-58.9	0	0	0	0	122.2	S169	C167-S169 PolarHBondContact O-N 3.13Å
168	P	39.4	Very low	44	Very low	133 Å²	133	110 Å²	110	86%	0.864	69%	0.687	S	S	*	*			trans	-85.7	107.4	-174.5	34.8	-30.4	0	0	0	111.7
169	S	33.8	Very low	41	Very low	116 Å²	116	115.7 Å²	115.7	81%	0.811	72%	0.722	S	S	*	*			trans	-93.9	110.8	158.8	62.5	0	0	0	0	109.3	C167	C167-S169 PolarHBondContact O-N 3.13Å
170	S	33.8	Very low	38.3	Very low	107 Å²	107	121.3 Å²	121.3	75%	0.748	74%	0.744	S	S	*	*			trans	-41.7	129.4	172.9	50.2	0	0	0	0	114.9
171	C	28.4	Very low	36.2	Very low	125 Å²	125	123.7 Å²	123.7	85%	0.845	77%	0.766	S	S	*	*				-174.9	154	119.2	-88.3	0	0	0	0	111.5
172	P	37.9	Very low	34.6	Very low	106 Å²	106	121.3 Å²	121.3	69%	0.688	77%	0.766	S	S	*	*			trans	-99.6	155.6	-154.5	37.7	-32.5	0	0	0	115.6
173	D	29.7	Very low	34.1	Very low	146 Å²	146	123.7 Å²	123.7	78%	0.781	77%	0.768	S	S	*	*			trans	49.9	135.8	147.7	-66.5	-46.9	0	0	0	119.7
174	L	31.9	Very low	33.4	Very low	135 Å²	135	125 Å²	125	71%	0.707	77%	0.765	S	S	*	*			cis	-174.9	146.1	40.7	-157.4	72.1	0	0	0	110.6
175	N	30.7	Very low	33.9	Very low	119 Å²	119	131.7 Å²	131.7	64%	0.636	78%	0.779	S	S	*	*			trans	95.5	103	148.5	-75	-29.3	0	0	0	124
176	K	36	Very low	34.1	Very low	189 Å²	189	130.8 Å²	130.8	82%	0.822	77%	0.773	S	S	*	*				78.6	105.9	128.3	-68	178.7	-179.6	177.7	0	119.2
177	S	30.6	Very low	34	Very low	100 Å²	100	128.9 Å²	128.9	70%	0.699	78%	0.775	S	S	*	*				-171.7	127	91.3	-154.9	0	0	0	0	113.5
178	Q	28.8	Very low	34.7	Very low	168 Å²	168	127.8 Å²	127.8	79%	0.785	77%	0.774	S	S	*	*			trans	62.2	89.1	146.6	-70.3	169.1	-3.8	0	0	120.5	L180	Q178-L180 PolarHBondContact O-N 3.32Å
179	T	32	Very low	34.9	Very low	125 Å²	125	127.6 Å²	127.6	77%	0.767	77%	0.769	S	S	*	*			trans	-45.7	118.5	139.4	35.8	0	0	0	0	112
180	L	33.8	Very low	35.9	Very low	169 Å²	169	129.8 Å²	129.8	89%	0.885	77%	0.772	S	S	*	*			trans	-106.8	79.2	153.9	-72.8	179.6	0	0	0	108.5	Q178	Q178-L180 PolarHBondContact O-N 3.32Å
181	S	38.9	Very low	37.2	Very low	105 Å²	105	129.1 Å²	129.1	73%	0.734	76%	0.763	S	S	*	*			trans	-113.1	83.7	162.9	34.3	0	0	0	0	107.7
182	S	31.4	Very low	39.8	Very low	97 Å²	97	130.7 Å²	130.7	68%	0.678	76%	0.757	S	S	*	*			trans	-161.3	110.5	160.4	61.4	0	0	0	0	111.5
183	L	38.1	Very low	42.3	Very low	172 Å²	172	128.4 Å²	128.4	90%	0.901	74%	0.741	S	S	*	*			trans	62.3	101.2	148.7	-58.6	166.8	0	0	0	118.3
184	S	29.7	Very low	45.3	Very low	106 Å²	106	121.7 Å²	121.7	74%	0.741	71%	0.706	S	S	*	*			trans	-146.8	103.2	135.8	-170.2	0	0	0	0	109.4	S186	S184-S186 PolarHBondContact O-N 3.36Å; S184-S186 VanDerWaalsContact O-N 3.08Å
185	E	44.4	Very low	48.3	Very low	206 Å²	206	115.6 Å²	115.6	96%	0.963	68%	0.675	S	S	*	*			trans	-74	82.6	163.6	-162.2	177.9	161.4	0	0	106.8
186	S	37.2	Very low	51.5	Low	91 Å²	91	110 Å²	110	64%	0.636	65%	0.645	S	S	*	*	S	Bend	trans	-153.6	123.5	171.8	-166.6	0	0	0	0	106.1	S184 A188	S184-S186 PolarHBondContact O-N 3.36Å; S184-S186 VanDerWaalsContact O-N 3.08Å; S186-A188 PolarHBondContact O-N 3.17Å
187	G	40.8	Very low	54.4	Low	78 Å²	78	101.1 Å²	101.1	80%	0.804	61%	0.606	S	S	*	*			trans	-42.6	96.3	-171.1	0	0	0	0	0	112.3	V189	G187-V189 VanDerWaalsContact C-N 3.34Å; G187-V189 PolarHBondContact O-N 2.94Å
188	A	40.8	Very low	57.6	Low	91 Å²	91	96.4 Å²	96.4	75%	0.752	57%	0.573	S	S	*	*			trans	-74.7	98	176.7	0	0	0	0	0	105.5	S186 L190	S186-A188 PolarHBondContact O-N 3.17Å; A188-L190 VanDerWaalsContact C-N 3.28Å; A188-L190 PolarHBondContact O-N 2.92Å
189	V	45.1	Very low	60.9	Low	128 Å²	128	88.4 Å²	88.4	78%	0.776	54%	0.536	S	S	*	.			trans	-52.5	105.8	156.3	-178.9	0	0	0	0	104.3	G187 V191	G187-V189 VanDerWaalsContact C-N 3.34Å; G187-V189 PolarHBondContact O-N 2.94Å; V189-V191 VanDerWaalsContact C-N 3.3Å; V189-V191 PolarHBondContact O-N 2.85Å
190	L	53.8	Low	64	Low	163 Å²	163	82.6 Å²	82.6	85%	0.853	50%	0.501	S	S	*	.			trans	-53.2	105.4	168.2	-91.2	160.2	0	0	0	104.9	A188 E192	A188-L190 VanDerWaalsContact C-N 3.28Å; A188-L190 PolarHBondContact O-N 2.92Å; L190-E192 VanDerWaalsContact C-N 3.27Å; L190-E192 PolarHBondContact O-N 3.41Å
191	V	61.2	Low	67	Low	93 Å²	93	75.2 Å²	75.2	56%	0.564	46%	0.462	S	S	*	.			trans	-67.6	102.6	171.7	178.4	0	0	0	0	103.7	V189 V193	V189-V191 VanDerWaalsContact C-N 3.3Å; V189-V191 PolarHBondContact O-N 2.85Å; V191-V193 PolarHBondContact O-N 2.82Å
192	E	82.3	Confident	69.7	Low	157 Å²	157	76.2 Å²	76.2	73%	0.734	46%	0.459	S	S	*	.			trans	-52.9	125.6	173.9	-169.3	179.3	171.9	0	0	107.4	G79 L190	G79-E192 WeakPolarHBondContact CA-O 3.36Å; G79-E192 PolarHBondContact N-O 2.9Å; L190-E192 VanDerWaalsContact C-N 3.27Å; L190-E192 PolarHBondContact O-N 3.41Å
193	V	90.8	Very high	72.8	Confident	58 Å²	58	75 Å²	75	35%	0.352	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	146.8	177.9	-71.4	0	0	0	0	109.1	V77 Q160 V191	V77-V193 CarbonylContact O-C 3.47Å; V77-V193 VanDerWaalsContact O-CA 3.28Å; V77-V193 WeakPolarHBondContact O-CA 3.49Å; Q160-V193 HydrophobicContact CB-CG2 4.19Å; Q160-V193 WeakPolarHBondContact CB-O 3.46Å; Q160-V193 HydrophobicContact CG-CG2 4.27Å; V191-V193 PolarHBondContact O-N 2.82Å
194	C	93.4	Very high	75.5	Confident	6 Å²	6	72.1 Å²	72.1	4%	0.041	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	170.8	177.7	68.4	0	0	0	0	110.6	V77 K157 T158 Q160	V77-C194 WeakPolarHBondContact CB-O 3.42Å; V77-C194 PolarHBondContact N-O 2.83Å; V77-C194 PolarHBondContact O-N 2.83Å; K157-C194 HydrophobicContact CG-CB 4.38Å; T158-C194 WeakPolarHBondContact O-CA 3.1Å; T158-C194 VanDerWaalsContact O-CB 3.26Å; T158-C194 WeakPolarHBondContact O-CB 3.49Å; Q160-C194 PolarHBondContact OE1-O 2.85Å
195	C	95.5	Very high	78.6	Confident	7 Å²	7	69.7 Å²	69.7	5%	0.047	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	152	170.6	-62.8	0	0	0	0	110.9	Q73 L74 K157 T158	Q73-C195 HydrophobicContact CG-CB 4.26Å; L74-C195 CarbonylContact O-C 3.09Å; L74-C195 WeakPolarHBondContact O-CA 3.48Å; L74-C195 WeakPolarHBondContact O-CB 3.42Å; K157-C195 WeakPolarHBondContact CA-O 3.4Å; T158-C195 PolarHBondContact N-O 2.8Å; T158-C195 PolarHBondContact O-N 2.91Å; T158-C195 WeakPolarHBondContact OG1-CB 3.45Å
196	L	97	Very high	81.1	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.01	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	112	169.3	-61.2	180	0	0	0	109.8	Q73 L74 V77 L81 L92 V155 K157	Q73-L196 CarbonylContact C-O 3.57Å; Q73-L196 WeakPolarHBondContact CA-O 3.5Å; L74-L196 HydrophobicContact CB-CB 4.18Å; L74-L196 HydrophobicContact CD1-CD1 4.38Å; L74-L196 PolarHBondContact N-O 2.96Å; L74-L196 PolarHBondContact O-N 2.78Å; V77-L196 HydrophobicContact CG1-CD1 4.14Å; V77-L196 HydrophobicContact CG1-CG 4.22Å; V77-L196 HydrophobicContact CG2-CD1 4.31Å; V77-L196 HydrophobicContact CG2-CG 4.14Å; L81-L196 HydrophobicContact CD2-CD1 3.68Å; L81-L196 HydrophobicContact CD2-CD2 3.82Å; L81-L196 HydrophobicContact CD2-CG 4.18Å; L92-L196 HydrophobicContact CD1-CD1 4.06Å; V155-L196 HydrophobicContact CG1-CB 4.18Å; V155-L196 HydrophobicContact CG1-CD1 4.5Å; V155-L196 HydrophobicContact CG1-CD2 4.03Å; V155-L196 HydrophobicContact CG1-CG 4.48Å; K157-L196 HydrophobicContact CB-CD2 3.9Å; K157-L196 HydrophobicContact CG-CD2 4.06Å
197	L	97	Very high	83.9	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	119.4	168.8	171.4	58.3	0	0	0	108.8	Y70 L123 L133 V155 I156 L199	Y70-L197 HydrophobicContact CD2-CD1 3.66Å; Y70-L197 HydrophobicContact CE2-CD1 3.28Å; L123-L197 HydrophobicContact CD2-CD1 4.2Å; L133-L197 HydrophobicContact CD1-CD2 3.9Å; L133-L197 HydrophobicContact CD2-CD1 3.92Å; L133-L197 HydrophobicContact CD2-CD2 4.45Å; V155-L197 WeakPolarHBondContact CA-O 3.48Å; I156-L197 HydrophobicContact CB-CB 4.15Å; I156-L197 HydrophobicContact CD1-CD2 4.15Å; I156-L197 PolarHBondContact N-O 2.96Å; I156-L197 PolarHBondContact O-N 2.86Å; L197-L199 HydrophobicContact CD1-CD2 4Å; L197-L199 HydrophobicContact CG-CD2 4.15Å; L197-L199 HydrophobicContact CG-CG 4.27Å
198	V	97.5	Very high	86.5	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	114.4	-175	-171.8	0	0	0	0	109.9	L71 G72 I93 L102	L71-V198 HydrophobicContact CB-CB 4.24Å; L71-V198 HydrophobicContact CB-CG1 4.1Å; L71-V198 WeakPolarHBondContact CB-O 3.47Å; L71-V198 HydrophobicContact CD2-CG1 4.03Å; L71-V198 PolarHBondContact N-O 3.17Å; G72-V198 PolarHBondContact O-N 3.34Å; I93-V198 HydrophobicContact CD1-CG1 4.06Å; I93-V198 HydrophobicContact CD1-CG2 4.28Å; I93-V198 HydrophobicContact CG1-CG1 4.48Å; I93-V198 HydrophobicContact CG1-CG2 4.16Å; L102-V198 HydrophobicContact CD1-CB 4.49Å; L102-V198 HydrophobicContact CD1-CG2 4.13Å; L102-V198 HydrophobicContact CD2-CG2 4.42Å
199	L	98	Very high	89	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	151.6	177.4	-51.4	177.6	0	0	0	109.9	V68 K69 Y70 V114 L123 L153 V154 I156 L197	V68-L199 HydrophobicContact CG2-CD1 4.46Å; V68-L199 HydrophobicContact CG2-CD2 4.19Å; K69-L199 CarbonylContact O-C 3.54Å; K69-L199 VanDerWaalsContact O-CA 3.31Å; K69-L199 WeakPolarHBondContact O-CA 3.24Å; Y70-L199 HydrophobicContact CD2-CD2 3.96Å; V114-L199 HydrophobicContact CG2-CD1 3.83Å; L123-L199 HydrophobicContact CD1-CD2 4.08Å; L123-L199 HydrophobicContact CD2-CD2 4.1Å; L153-L199 CarbonylContact C-O 3.49Å; L153-L199 VanDerWaalsContact CA-O 3.26Å; L153-L199 WeakPolarHBondContact CA-O 3.34Å; V154-L199 HydrophobicContact CB-CB 4.39Å; V154-L199 PolarHBondContact N-O 2.99Å; V154-L199 WeakPolarHBondContact O-CB 3.42Å; V154-L199 PolarHBondContact O-N 2.93Å; I156-L199 HydrophobicContact CD1-CD1 4.07Å; L197-L199 HydrophobicContact CD1-CD2 4Å; L197-L199 HydrophobicContact CG-CD2 4.15Å; L197-L199 HydrophobicContact CG-CG 4.27Å
200	A	97.4	Very high	91.4	Very high	3 Å²	3	48.2 Å²	48.2	3%	0.025	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	145.3	165.3	0	0	0	0	0	110.3	V68 K69 L71 L106 H152 L153	V68-A200 CarbonylContact C-O 3.53Å; K69-A200 HydrophobicContact CB-CB 4.3Å; K69-A200 PolarHBondContact N-O 3.13Å; K69-A200 PolarHBondContact O-N 3.23Å; L71-A200 HydrophobicContact CD1-CB 3.61Å; L106-A200 HydrophobicContact CD1-CB 4.08Å; L106-A200 HydrophobicContact CD2-CB 4.25Å; H152-A200 CarbonylContact O-C 3.6Å; H152-A200 WeakPolarHBondContact O-CA 3.42Å; L153-A200 HydrophobicContact CD2-CB 4.08Å
201	V	97.4	Very high	93.4	Very high	14 Å²	14	41.9 Å²	41.9	9%	0.085	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	162.5	177.1	-61.7	0	0	0	0	110.2	V68 H152 V154 N203 A206 A207	V68-V201 HydrophobicContact CB-CG1 4.37Å; V68-V201 HydrophobicContact CG1-CG1 3.93Å; H152-V201 HydrophobicContact CB-CG2 3.75Å; H152-V201 PolarHBondContact O-N 2.76Å; V154-V201 HydrophobicContact CG2-CG1 4.34Å; V154-V201 HydrophobicContact CG2-CG2 4.31Å; V201-N203 VanDerWaalsContact C-N 3.33Å; V201-N203 PolarHBondContact O-N 3.08Å; V201-A206 HydrophobicContact CB-CB 4.19Å; V201-A206 HydrophobicContact CG2-CB 4.33Å; V201-A207 HydrophobicContact CG2-CB 3.54Å
202	D	95	Very high	94.9	Very high	125 Å²	125	40.3 Å²	40.3	67%	0.668	22%	0.219	S	C	*	.	S	Bend	trans	-67.9	-32.2	-168.5	-67.6	-21.8	0	0	0	113.8
203	N	96.1	Very high	95.4	Very high	73 Å²	73	32.9 Å²	32.9	39%	0.39	18%	0.184	S	C	.	.	S	Bend	trans	-155.6	169.8	-174.3	62.5	68.6	0	0	0	112.2	H152 V201 A205 A206 A207	H152-N203 VanDerWaalsContact CD2-CA 3.43Å; H152-N203 WeakPolarHBondContact CD2-CA 3.3Å; V201-N203 VanDerWaalsContact C-N 3.33Å; V201-N203 PolarHBondContact O-N 3.08Å; N203-A205 VanDerWaalsContact C-N 3.31Å; N203-A205 PolarHBondContact O-N 3.28Å; N203-A205 WeakPolarHBondContact OD1-CA 3.29Å; N203-A205 WeakPolarHBondContact OD1-CB 3.37Å; N203-A205 PolarHBondContact OD1-N 3.08Å; N203-A206 PolarHBondContact O-N 3.47Å; N203-A206 PolarHBondContact OD1-N 2.93Å; N203-A207 PolarHBondContact O-N 3.39Å
204	K	96	Very high	95.5	Very high	111 Å²	111	30.2 Å²	30.2	48%	0.483	17%	0.167	S	C	.	.	H	α-helix	trans	-54.7	-44.1	177.8	176.9	-179.5	171.3	-170.5	0	112.7	Y145 H152 A207 E208	Y145-K204 HydrophobicContact CE1-CG 4.05Å; H152-K204 PolarHBondContact CE1-N 3.13Å; H152-K204 VanDerWaalsContact CE1-N 3.34Å; H152-K204 PolarHBondContact ND1-N 3.19Å; K204-A207 WeakPolarHBondContact O-CB 3.33Å; K204-A207 PolarHBondContact O-N 2.65Å; K204-E208 WeakPolarHBondContact CE-OE1 3.23Å; K204-E208 WeakPolarHBondContact CE-OE2 3.35Å; K204-E208 HydrophobicContact CG-CG 4.39Å; K204-E208 IonicContact NZ-OE1 2.7Å; K204-E208 PolarHBondContact NZ-OE1 3.31Å; K204-E208 WeakPolarHBondContact O-CG 3.22Å; K204-E208 PolarHBondContact O-N 3.4Å
205	A	94.9	Very high	95.2	Very high	55 Å²	55	33 Å²	33	46%	0.455	19%	0.187	S	C	.	.	H	α-helix	trans	-65.6	-42.5	-175.5	0	0	0	0	0	111.2	N203 A207 E208 E209	N203-A205 VanDerWaalsContact C-N 3.31Å; N203-A205 PolarHBondContact O-N 3.28Å; N203-A205 WeakPolarHBondContact OD1-CA 3.29Å; N203-A205 WeakPolarHBondContact OD1-CB 3.37Å; N203-A205 PolarHBondContact OD1-N 3.08Å; A205-A207 VanDerWaalsContact C-N 3.28Å; A205-A207 PolarHBondContact O-N 2.95Å; A205-E208 PolarHBondContact O-N 2.79Å; A205-E209 VanDerWaalsContact O-CB 3.25Å; A205-E209 WeakPolarHBondContact O-CB 3.26Å; A205-E209 PolarHBondContact O-N 3.36Å
206	A	95.4	Very high	94.9	Very high	27 Å²	27	34 Å²	34	22%	0.223	19%	0.191	C	C	.	.	H	α-helix	trans	-61.7	-35.7	174.6	0	0	0	0	0	112.5	V201 N203 L210	V201-A206 HydrophobicContact CB-CB 4.19Å; V201-A206 HydrophobicContact CG2-CB 4.33Å; N203-A206 PolarHBondContact O-N 3.47Å; N203-A206 PolarHBondContact OD1-N 2.93Å; A206-L210 WeakPolarHBondContact O-CB 3.42Å; A206-L210 PolarHBondContact O-N 3.45Å
207	A	96.8	Very high	94.4	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-68.1	-46.1	176.4	0	0	0	0	0	111.9	Y145 H152 V154 V201 N203 K204 A205 L210 C211	Y145-A207 HydrophobicContact CD1-CB 4.27Å; Y145-A207 HydrophobicContact CD2-CB 3.41Å; Y145-A207 VanDerWaalsContact CD2-CB 3.41Å; Y145-A207 HydrophobicContact CE1-CB 4.42Å; Y145-A207 HydrophobicContact CE2-CB 3.64Å; Y145-A207 HydrophobicContact CG-CB 3.78Å; H152-A207 HydrophobicContact CB-CB 4.5Å; V154-A207 HydrophobicContact CG2-CB 3.96Å; V201-A207 HydrophobicContact CG2-CB 3.54Å; N203-A207 PolarHBondContact O-N 3.39Å; K204-A207 WeakPolarHBondContact O-CB 3.33Å; K204-A207 PolarHBondContact O-N 2.65Å; A205-A207 VanDerWaalsContact C-N 3.28Å; A205-A207 PolarHBondContact O-N 2.95Å; A207-L210 PolarHBondContact O-N 3.49Å; A207-C211 PolarHBondContact O-N 3.39Å; A207-C211 PolarHBondContact O-SG 3.46Å
208	E	94.6	Very high	93.8	Very high	78 Å²	78	35.6 Å²	35.6	36%	0.364	20%	0.198	S	C	.	.	H	α-helix	trans	-64.1	-43.5	177.8	-72.2	177.4	155.2	0	0	110.9	Y145 K204 A205 C211 L212	Y145-E208 HydrophobicContact CD1-CG 4.33Å; Y145-E208 HydrophobicContact CE1-CG 4.43Å; K204-E208 WeakPolarHBondContact CE-OE1 3.23Å; K204-E208 WeakPolarHBondContact CE-OE2 3.35Å; K204-E208 HydrophobicContact CG-CG 4.39Å; K204-E208 IonicContact NZ-OE1 2.7Å; K204-E208 PolarHBondContact NZ-OE1 3.31Å; K204-E208 WeakPolarHBondContact O-CG 3.22Å; K204-E208 PolarHBondContact O-N 3.4Å; A205-E208 PolarHBondContact O-N 2.79Å; E208-C211 PolarHBondContact O-N 3.06Å; E208-L212 WeakPolarHBondContact O-CB 3.38Å; E208-L212 VanDerWaalsContact O-CG 3.28Å; E208-L212 WeakPolarHBondContact O-CG 3.24Å; E208-L212 PolarHBondContact O-N 2.91Å
209	E	94.5	Very high	92.9	Very high	34 Å²	34	38.8 Å²	38.8	16%	0.159	21%	0.213	C	C	.	.	H	α-helix	trans	-56.6	-51.9	174.3	-177.1	-178.6	-177.1	0	0	111.1	L47 K66 A205 C211 L212 L213	L47-E209 HydrophobicContact CD1-CG 3.94Å; L47-E209 WeakPolarHBondContact CD1-OE1 3.3Å; K66-E209 WeakPolarHBondContact CE-OE1 3.36Å; K66-E209 IonicContact NZ-OE1 3.32Å; K66-E209 PolarHBondContact NZ-OE1 3.3Å; K66-E209 IonicContact NZ-OE2 2.88Å; A205-E209 VanDerWaalsContact O-CB 3.25Å; A205-E209 WeakPolarHBondContact O-CB 3.26Å; A205-E209 PolarHBondContact O-N 3.36Å; E209-C211 VanDerWaalsContact C-N 3.28Å; E209-C211 PolarHBondContact O-N 3.47Å; E209-L212 PolarHBondContact O-N 3.4Å; E209-L212 VanDerWaalsContact O-N 3.1Å; E209-L213 HydrophobicContact CG-CD1 4.41Å; E209-L213 VanDerWaalsContact O-CG 3.28Å; E209-L213 WeakPolarHBondContact O-CG 3.39Å; E209-L213 PolarHBondContact O-N 3.01Å
210	L	95.7	Very high	91.8	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.016	22%	0.216	C	C	.	.	H	α-helix	trans	-59.9	-38.5	178.8	-175.3	59.9	0	0	0	112.5	V68 V114 L116 V154 A206 A207 L214	V68-L210 HydrophobicContact CG1-CD2 4.26Å; V114-L210 HydrophobicContact CG1-CD1 4.45Å; L116-L210 HydrophobicContact CD1-CD1 3.9Å; L116-L210 HydrophobicContact CD2-CD1 3.79Å; L116-L210 HydrophobicContact CG-CD1 4.43Å; V154-L210 HydrophobicContact CB-CD2 4.29Å; V154-L210 HydrophobicContact CG1-CD2 3.99Å; V154-L210 HydrophobicContact CG2-CD2 4.25Å; A206-L210 WeakPolarHBondContact O-CB 3.42Å; A206-L210 PolarHBondContact O-N 3.45Å; A207-L210 PolarHBondContact O-N 3.49Å; L210-L214 HydrophobicContact CD1-CD1 4.4Å; L210-L214 HydrophobicContact CG-CD1 4.35Å; L210-L214 WeakPolarHBondContact O-CG 3.29Å; L210-L214 PolarHBondContact O-N 3.47Å; L210-L214 VanDerWaalsContact O-N 3.11Å
211	C	94.8	Very high	90.5	Very high	30 Å²	30	40.5 Å²	40.5	20%	0.203	22%	0.222	C	C	.	.	H	α-helix	trans	-66.4	-40.4	175.2	-65.6	0	0	0	0	112.1	A207 E208 E209 L214 S215	A207-C211 PolarHBondContact O-N 3.39Å; A207-C211 PolarHBondContact O-SG 3.46Å; E208-C211 PolarHBondContact O-N 3.06Å; E209-C211 VanDerWaalsContact C-N 3.28Å; E209-C211 PolarHBondContact O-N 3.47Å; C211-L214 PolarHBondContact O-N 2.92Å; C211-S215 WeakPolarHBondContact O-CB 3.25Å; C211-S215 PolarHBondContact O-N 3Å
212	L	92.6	Very high	89.1	Confident	61 Å²	61	43.1 Å²	43.1	32%	0.319	23%	0.231	S	C	.	.	H	α-helix	trans	-67.3	-39.9	177.5	-72.9	169.5	0	0	0	112	H52 E208 E209 S215 Q216	H52-L212 HydrophobicContact CB-CD1 4.31Å; E208-L212 WeakPolarHBondContact O-CB 3.38Å; E208-L212 VanDerWaalsContact O-CG 3.28Å; E208-L212 WeakPolarHBondContact O-CG 3.24Å; E208-L212 PolarHBondContact O-N 2.91Å; E209-L212 PolarHBondContact O-N 3.4Å; E209-L212 VanDerWaalsContact O-N 3.1Å; L212-S215 WeakPolarHBondContact O-CB 3.41Å; L212-S215 PolarHBondContact O-N 2.86Å; L212-Q216 WeakPolarHBondContact O-CG 3.39Å; L212-Q216 PolarHBondContact O-N 3.04Å; L212-Q216 PolarHBondContact O-NE2 3.07Å
213	L	93	Very high	87.5	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-59.7	-47.1	173.8	-66.9	-179.2	0	0	0	111	L47 I54 I64 K66 L116 E209 S215 Q216 V217	L47-L213 HydrophobicContact CD1-CD2 4.35Å; I54-L213 HydrophobicContact CD1-CD2 2.99Å; I54-L213 HydrophobicContact CD1-CG 4.47Å; I54-L213 HydrophobicContact CG1-CD2 4.4Å; I64-L213 HydrophobicContact CG2-CD1 4.37Å; K66-L213 HydrophobicContact CG-CD1 4.16Å; L116-L213 HydrophobicContact CD2-CB 4.02Å; E209-L213 HydrophobicContact CG-CD1 4.41Å; E209-L213 VanDerWaalsContact O-CG 3.28Å; E209-L213 WeakPolarHBondContact O-CG 3.39Å; E209-L213 PolarHBondContact O-N 3.01Å; L213-S215 VanDerWaalsContact C-N 3.34Å; L213-S215 PolarHBondContact O-N 3.28Å; L213-Q216 WeakPolarHBondContact O-CB 3.38Å; L213-Q216 PolarHBondContact O-N 3.14Å; L213-V217 WeakPolarHBondContact O-CG2 3.49Å; L213-V217 PolarHBondContact O-N 2.86Å
214	L	92.5	Very high	85.6	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-67.5	-35.3	178.2	-74.5	167.2	0	0	0	112.5	L116 I121 V143 I156 L210 C211 Q216 V217 F218	L116-L214 HydrophobicContact CD2-CD1 4.3Å; L116-L214 HydrophobicContact CD2-CD2 3.55Å; L116-L214 HydrophobicContact CD2-CG 3.58Å; I121-L214 HydrophobicContact CD1-CD1 3.93Å; I121-L214 HydrophobicContact CD1-CD2 3.34Å; I121-L214 HydrophobicContact CD1-CG 4.3Å; I121-L214 HydrophobicContact CG1-CD2 3.77Å; V143-L214 HydrophobicContact CB-CD1 4.4Å; V143-L214 HydrophobicContact CG1-CD1 3.95Å; V143-L214 HydrophobicContact CG2-CB 4.11Å; V143-L214 HydrophobicContact CG2-CD1 3.65Å; V143-L214 HydrophobicContact CG2-CG 4.4Å; I156-L214 HydrophobicContact CD1-CD1 4.25Å; L210-L214 HydrophobicContact CD1-CD1 4.4Å; L210-L214 HydrophobicContact CG-CD1 4.35Å; L210-L214 WeakPolarHBondContact O-CG 3.29Å; L210-L214 PolarHBondContact O-N 3.47Å; L210-L214 VanDerWaalsContact O-N 3.11Å; C211-L214 PolarHBondContact O-N 2.92Å; L214-Q216 VanDerWaalsContact C-N 3.31Å; L214-Q216 PolarHBondContact O-N 3.48Å; L214-V217 PolarHBondContact O-N 2.93Å; L214-F218 HydrophobicContact CB-CE2 4.23Å; L214-F218 WeakPolarHBondContact O-CD2 3.47Å; L214-F218 VanDerWaalsContact O-CG 3.23Å; L214-F218 WeakPolarHBondContact O-CG 3.35Å; L214-F218 PolarHBondContact O-N 2.74Å
215	S	88.4	Confident	83.5	Confident	65 Å²	65	35.1 Å²	35.1	46%	0.455	20%	0.196	S	C	.	.	H	α-helix	trans	-59.5	-42.6	171.7	-167.6	0	0	0	0	111.8	C211 L212 L213 F218 Q219	C211-S215 WeakPolarHBondContact O-CB 3.25Å; C211-S215 PolarHBondContact O-N 3Å; L212-S215 WeakPolarHBondContact O-CB 3.41Å; L212-S215 PolarHBondContact O-N 2.86Å; L213-S215 VanDerWaalsContact C-N 3.34Å; L213-S215 PolarHBondContact O-N 3.28Å; S215-F218 PolarHBondContact O-N 2.96Å; S215-Q219 WeakPolarHBondContact O-CB 3.46Å; S215-Q219 PolarHBondContact O-N 3.4Å
216	Q	87.6	Confident	81.6	Confident	29 Å²	29	32.8 Å²	32.8	14%	0.136	18%	0.176	C	C	.	.	H	α-helix	trans	-65.5	-42.9	175.9	-72.6	173.1	75.5	0	0	111.6	H52 L59 L212 L213 L214 Q219 I220	H52-Q216 PolarHBondContact O-NE2 2.96Å; L59-Q216 HydrophobicContact CD1-CB 4.21Å; L212-Q216 WeakPolarHBondContact O-CG 3.39Å; L212-Q216 PolarHBondContact O-N 3.04Å; L212-Q216 PolarHBondContact O-NE2 3.07Å; L213-Q216 WeakPolarHBondContact O-CB 3.38Å; L213-Q216 PolarHBondContact O-N 3.14Å; L214-Q216 VanDerWaalsContact C-N 3.31Å; L214-Q216 PolarHBondContact O-N 3.48Å; Q216-Q219 WeakPolarHBondContact O-CB 3.34Å; Q216-Q219 PolarHBondContact O-N 3.17Å; Q216-I220 WeakPolarHBondContact O-CG1 3.48Å; Q216-I220 PolarHBondContact O-N 3.46Å
217	V	87.4	Confident	79.9	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-60.7	-46.7	175.5	169	0	0	0	0	111.6	L59 S117 I137 L213 L214 Q219 I220 V221	L59-V217 HydrophobicContact CD1-CG2 3.9Å; L59-V217 HydrophobicContact CD2-CG2 4.07Å; L59-V217 HydrophobicContact CG-CG2 4.44Å; S117-V217 WeakPolarHBondContact O-CG1 3.31Å; I137-V217 HydrophobicContact CB-CG1 4.4Å; I137-V217 HydrophobicContact CD1-CG1 3.53Å; I137-V217 HydrophobicContact CG1-CG1 3.58Å; I137-V217 HydrophobicContact CG2-CG1 3.89Å; L213-V217 WeakPolarHBondContact O-CG2 3.49Å; L213-V217 PolarHBondContact O-N 2.86Å; L214-V217 PolarHBondContact O-N 2.93Å; V217-Q219 VanDerWaalsContact C-N 3.27Å; V217-Q219 PolarHBondContact O-N 3.16Å; V217-I220 PolarHBondContact O-N 3.39Å; V217-V221 WeakPolarHBondContact O-CG2 3.36Å; V217-V221 PolarHBondContact O-N 3.39Å
218	F	84.7	Confident	78.1	Confident	36 Å²	36	34.5 Å²	34.5	16%	0.158	18%	0.181	C	C	.	.	H	α-helix	trans	-59	-42.3	175.1	-66.8	-35.6	0	0	0	111.4	I137 I140 V143 L214 S215 I220 V221 Y222	I137-F218 HydrophobicContact CG2-CD1 3.57Å; I137-F218 HydrophobicContact CG2-CE1 3.78Å; I140-F218 HydrophobicContact CB-CE1 3.89Å; I140-F218 HydrophobicContact CB-CZ 3.94Å; I140-F218 HydrophobicContact CD1-CE1 4.42Å; I140-F218 HydrophobicContact CG2-CE1 4.06Å; I140-F218 HydrophobicContact CG2-CZ 3.55Å; V143-F218 HydrophobicContact CG2-CE2 3.85Å; V143-F218 HydrophobicContact CG2-CZ 3.91Å; L214-F218 HydrophobicContact CB-CE2 4.23Å; L214-F218 WeakPolarHBondContact O-CD2 3.47Å; L214-F218 VanDerWaalsContact O-CG 3.23Å; L214-F218 WeakPolarHBondContact O-CG 3.35Å; L214-F218 PolarHBondContact O-N 2.74Å; S215-F218 PolarHBondContact O-N 2.96Å; F218-I220 PolarHBondContact O-N 2.92Å; F218-V221 PolarHBondContact O-N 3.04Å; F218-Y222 HydrophobicContact CB-CD2 3.85Å; F218-Y222 HydrophobicContact CB-CE2 3.97Å; F218-Y222 AromaticContact CD1-CE2 3.9Å; F218-Y222 HydrophobicContact CD1-CE2 3.9Å; F218-Y222 HydrophobicContact CG-CE2 4.16Å; F218-Y222 VanDerWaalsContact O-CB 3.25Å; F218-Y222 WeakPolarHBondContact O-CB 3.43Å; F218-Y222 WeakPolarHBondContact O-CD2 3.48Å; F218-Y222 PolarHBondContact O-N 3.44Å
219	Q	79.1	Confident	76.2	Confident	66 Å²	66	34.7 Å²	34.7	31%	0.308	18%	0.181	S	C	.	.	H	α-helix	trans	-61.9	-44.9	177.9	170.6	162.9	75.1	0	0	112.6	S215 Q216 V217 T223 E365	S215-Q219 WeakPolarHBondContact O-CB 3.46Å; S215-Q219 PolarHBondContact O-N 3.4Å; Q216-Q219 WeakPolarHBondContact O-CB 3.34Å; Q216-Q219 PolarHBondContact O-N 3.17Å; V217-Q219 VanDerWaalsContact C-N 3.27Å; V217-Q219 PolarHBondContact O-N 3.16Å; Q219-T223 WeakPolarHBondContact O-CB 3.28Å; Q219-T223 PolarHBondContact O-N 3.03Å; Q219-T223 PolarHBondContact O-OG1 3.3Å; Q219-E365 PolarHBondContact NE2-OE2 3.33Å
220	I	74.8	Confident	74.8	Confident	16 Å²	16	33.1 Å²	33.1	8%	0.082	17%	0.173	C	C	.	.	H	α-helix	trans	-58.9	-56.2	177	-67.6	166.5	0	0	0	109.4	P56 L59 L60 Q216 V217 F218 Y222 T223 E224	P56-I220 HydrophobicContact CB-CD1 3.89Å; P56-I220 HydrophobicContact CB-CG1 4.19Å; L59-I220 HydrophobicContact CB-CD1 3.81Å; L59-I220 HydrophobicContact CD1-CD1 3.71Å; L59-I220 HydrophobicContact CG-CD1 4.38Å; L60-I220 HydrophobicContact CD1-CG2 4.34Å; L60-I220 HydrophobicContact CD2-CG2 3.51Å; L60-I220 HydrophobicContact CG-CG2 3.91Å; Q216-I220 WeakPolarHBondContact O-CG1 3.48Å; Q216-I220 PolarHBondContact O-N 3.46Å; V217-I220 PolarHBondContact O-N 3.39Å; F218-I220 PolarHBondContact O-N 2.92Å; I220-Y222 PolarHBondContact O-N 3.33Å; I220-T223 PolarHBondContact O-N 2.93Å; I220-E224 WeakPolarHBondContact O-CB 2.91Å; I220-E224 WeakPolarHBondContact O-CG 3.18Å; I220-E224 PolarHBondContact O-N 3.06Å
221	V	69.6	Low	73.2	Confident	25 Å²	25	34.4 Å²	34.4	15%	0.152	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-46.1	-175.3	177.4	0	0	0	0	111.9	A118 I137 V217 F218 S225	A118-V221 HydrophobicContact CB-CG2 4.33Å; A118-V221 WeakPolarHBondContact O-CG2 3.33Å; I137-V221 HydrophobicContact CB-CG2 4.35Å; I137-V221 HydrophobicContact CG2-CB 4.21Å; I137-V221 HydrophobicContact CG2-CG1 4.37Å; I137-V221 HydrophobicContact CG2-CG2 3.96Å; V217-V221 WeakPolarHBondContact O-CG2 3.36Å; V217-V221 PolarHBondContact O-N 3.39Å; F218-V221 PolarHBondContact O-N 3.04Å; V221-S225 WeakPolarHBondContact O-CB 3.39Å; V221-S225 PolarHBondContact O-N 2.96Å; V221-S225 PolarHBondContact O-OG 2.9Å
222	Y	67.1	Low	71.9	Confident	69 Å²	69	39.9 Å²	39.9	27%	0.271	20%	0.197	S	C	.	.	H	α-helix	trans	-78.3	-21.9	-177.5	-67.8	-60	0	0	0	113.5	F218 I220 T226	F218-Y222 HydrophobicContact CB-CD2 3.85Å; F218-Y222 HydrophobicContact CB-CE2 3.97Å; F218-Y222 AromaticContact CD1-CE2 3.9Å; F218-Y222 HydrophobicContact CD1-CE2 3.9Å; F218-Y222 HydrophobicContact CG-CE2 4.16Å; F218-Y222 VanDerWaalsContact O-CB 3.25Å; F218-Y222 WeakPolarHBondContact O-CB 3.43Å; F218-Y222 WeakPolarHBondContact O-CD2 3.48Å; F218-Y222 PolarHBondContact O-N 3.44Å; I220-Y222 PolarHBondContact O-N 3.33Å; Y222-T226 WeakPolarHBondContact O-CB 3.38Å; Y222-T226 PolarHBondContact O-OG1 3.02Å
223	T	62.7	Low	70.3	Confident	27 Å²	27	37.9 Å²	37.9	17%	0.166	19%	0.189	C	C	.	.	H	α-helix	trans	-87	-45.3	176.4	-47.1	0	0	0	0	111	Q219 I220 T226 I227 P364	Q219-T223 WeakPolarHBondContact O-CB 3.28Å; Q219-T223 PolarHBondContact O-N 3.03Å; Q219-T223 PolarHBondContact O-OG1 3.3Å; I220-T223 PolarHBondContact O-N 2.93Å; T223-T226 PolarHBondContact O-N 3.35Å; T223-I227 HydrophobicContact CG2-CD1 3.98Å; T223-I227 VanDerWaalsContact O-CG1 3.3Å; T223-I227 WeakPolarHBondContact O-CG1 3.05Å; T223-I227 PolarHBondContact O-N 3.28Å; T223-P364 HydrophobicContact CG2-CB 4.03Å; T223-P364 HydrophobicContact CG2-CG 3.58Å
224	E	56.6	Low	68.9	Low	73 Å²	73	37.9 Å²	37.9	34%	0.341	19%	0.189	S	C	.	.	H	α-helix	trans	-69.2	-47.2	178.8	-68.4	-168.4	147.6	0	0	111.9	L60 I220 T226 I227 D228	L60-E224 WeakPolarHBondContact CD2-OE2 3.27Å; I220-E224 WeakPolarHBondContact O-CB 2.91Å; I220-E224 WeakPolarHBondContact O-CG 3.18Å; I220-E224 PolarHBondContact O-N 3.06Å; E224-T226 PolarHBondContact O-N 3.49Å; E224-I227 PolarHBondContact O-N 3.42Å; E224-D228 WeakPolarHBondContact O-CB 3.25Å; E224-D228 PolarHBondContact O-N 2.91Å
225	S	51.2	Low	67.4	Low	41 Å²	41	42.8 Å²	42.8	29%	0.287	21%	0.211	S	C	.	.	H	α-helix	trans	-62.8	-34.1	178.3	-52.9	0	0	0	0	111.7	V221 F229	V221-S225 WeakPolarHBondContact O-CB 3.39Å; V221-S225 PolarHBondContact O-N 2.96Å; V221-S225 PolarHBondContact O-OG 2.9Å; S225-F229 VanDerWaalsContact O-CB 3.27Å; S225-F229 WeakPolarHBondContact O-CB 3.23Å; S225-F229 PolarHBondContact O-N 3.27Å
226	T	53.8	Low	66	Low	6 Å²	6	45.2 Å²	45.2	4%	0.037	22%	0.219	C	C	.	.	H	α-helix	trans	-77.2	-36.9	-178.6	-54.3	0	0	0	0	112.3	Y222 T223 E224 L230 L297 L305 F362	Y222-T226 WeakPolarHBondContact O-CB 3.38Å; Y222-T226 PolarHBondContact O-OG1 3.02Å; T223-T226 PolarHBondContact O-N 3.35Å; E224-T226 PolarHBondContact O-N 3.49Å; T226-L230 WeakPolarHBondContact O-CB 3.13Å; T226-L230 PolarHBondContact O-N 3.38Å; T226-L297 WeakPolarHBondContact OG1-CD2 3.38Å; T226-L305 HydrophobicContact CG2-CD1 4.21Å; T226-L305 HydrophobicContact CG2-CD2 4.08Å; T226-F362 HydrophobicContact CG2-CD1 3.36Å; T226-F362 HydrophobicContact CG2-CE1 3.64Å; T226-F362 HydrophobicContact CG2-CG 4.31Å
227	I	61.7	Low	64.2	Low	18 Å²	18	44.9 Å²	44.9	9%	0.092	22%	0.223	C	C	.	.	H	α-helix	trans	-69.1	-41.8	173.4	-67.3	171.6	0	0	0	110.3	T223 E224 F229 L230 D231 P364	T223-I227 HydrophobicContact CG2-CD1 3.98Å; T223-I227 VanDerWaalsContact O-CG1 3.3Å; T223-I227 WeakPolarHBondContact O-CG1 3.05Å; T223-I227 PolarHBondContact O-N 3.28Å; E224-I227 PolarHBondContact O-N 3.42Å; I227-F229 VanDerWaalsContact C-N 3.3Å; I227-F229 PolarHBondContact O-N 2.96Å; I227-L230 VanDerWaalsContact O-CB 3.32Å; I227-L230 WeakPolarHBondContact O-CB 3.02Å; I227-L230 PolarHBondContact O-N 3.35Å; I227-L230 VanDerWaalsContact O-N 3.12Å; I227-D231 PolarHBondContact O-N 3.29Å; I227-P364 HydrophobicContact CD1-CG 4.44Å
228	D	57.8	Low	62.3	Low	44 Å²	44	45.8 Å²	45.8	24%	0.235	23%	0.23	C	C	.	.	H	α-helix	trans	-61.5	-39.4	175	-78.7	-30.8	0	0	0	112.1	E224 D231 R232 R332	E224-D228 WeakPolarHBondContact O-CB 3.25Å; E224-D228 PolarHBondContact O-N 2.91Å; D228-D231 PolarHBondContact O-N 3.47Å; D228-R232 VanDerWaalsContact O-CG 3.31Å; D228-R232 WeakPolarHBondContact O-CG 3.14Å; D228-R232 PolarHBondContact O-N 3.49Å; D228-R332 VanDerWaalsContact CG-CZ 3.45Å; D228-R332 IonicContact OD1-CZ 3Å; D228-R332 IonicContact OD1-NE 2.83Å; D228-R332 IonicContact OD1-NH1 3.28Å; D228-R332 PolarHBondContact OD1-NH1 3.03Å; D228-R332 IonicContact OD1-NH2 2.69Å; D228-R332 PolarHBondContact OD1-NH2 3.37Å; D228-R332 VanDerWaalsContact OD1-NH2 3.16Å; D228-R332 IonicContact OD2-CZ 3.01Å; D228-R332 VanDerWaalsContact OD2-CZ 3.24Å; D228-R332 IonicContact OD2-NH1 3.96Å; D228-R332 PolarHBondContact OD2-NH1 3.44Å; D228-R332 IonicContact OD2-NH2 2.76Å; D228-R332 PolarHBondContact OD2-NH2 3.5Å
229	F	55.8	Low	60.3	Low	82 Å²	82	49.1 Å²	49.1	36%	0.36	25%	0.254	S	S	.	.	H	α-helix	trans	-70.2	-36.9	173.5	-165.5	-77.7	0	0	0	112.3	S225 I227 D231 R232 A233 L297 L305	S225-F229 VanDerWaalsContact O-CB 3.27Å; S225-F229 WeakPolarHBondContact O-CB 3.23Å; S225-F229 PolarHBondContact O-N 3.27Å; I227-F229 VanDerWaalsContact C-N 3.3Å; I227-F229 PolarHBondContact O-N 2.96Å; F229-D231 VanDerWaalsContact C-N 3.27Å; F229-D231 PolarHBondContact O-N 2.97Å; F229-R232 PolarHBondContact O-N 2.54Å; F229-A233 HydrophobicContact CD1-CB 4.22Å; F229-A233 HydrophobicContact CE1-CB 4.28Å; F229-A233 WeakPolarHBondContact O-CB 3.45Å; F229-A233 PolarHBondContact O-N 3.42Å; F229-L297 HydrophobicContact CB-CD1 3.47Å; F229-L297 VanDerWaalsContact CB-CD1 3.47Å; F229-L297 HydrophobicContact CB-CD2 4.5Å; F229-L297 HydrophobicContact CB-CG 4.08Å; F229-L297 HydrophobicContact CD1-CD1 3.7Å; F229-L297 HydrophobicContact CD2-CD1 3.6Å; F229-L297 HydrophobicContact CD2-CG 3.96Å; F229-L297 HydrophobicContact CE1-CD1 4.23Å; F229-L297 HydrophobicContact CE2-CD1 4.19Å; F229-L297 HydrophobicContact CG-CD1 3.3Å; F229-L297 HydrophobicContact CG-CG 4.07Å; F229-L297 HydrophobicContact CZ-CD1 4.46Å; F229-L305 HydrophobicContact CB-CD2 4.06Å; F229-L305 HydrophobicContact CD1-CD2 3.2Å; F229-L305 HydrophobicContact CD1-CG 4.36Å; F229-L305 HydrophobicContact CE1-CD2 3.89Å; F229-L305 HydrophobicContact CG-CD2 3.96Å
230	L	63.2	Low	58.4	Low	1 Å²	1	50.3 Å²	50.3	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-56.9	-46.6	174.5	-133.1	154.8	0	0	0	109.6	T226 I227 A233 I234 L305 M309 F324 L328 L359 F362	T226-L230 WeakPolarHBondContact O-CB 3.13Å; T226-L230 PolarHBondContact O-N 3.38Å; I227-L230 VanDerWaalsContact O-CB 3.32Å; I227-L230 WeakPolarHBondContact O-CB 3.02Å; I227-L230 PolarHBondContact O-N 3.35Å; I227-L230 VanDerWaalsContact O-N 3.12Å; L230-A233 PolarHBondContact O-N 3.48Å; L230-I234 HydrophobicContact CD2-CD1 3.7Å; L230-I234 HydrophobicContact CD2-CG1 4.21Å; L230-I234 VanDerWaalsContact O-CD1 3.31Å; L230-I234 WeakPolarHBondContact O-CD1 3.28Å; L230-I234 WeakPolarHBondContact O-CG1 3.41Å; L230-I234 PolarHBondContact O-N 3.23Å; L230-L305 HydrophobicContact CB-CD1 4.16Å; L230-L305 HydrophobicContact CD1-CD1 3.41Å; L230-L305 VanDerWaalsContact CD1-CD1 3.41Å; L230-L305 HydrophobicContact CD2-CD1 4.47Å; L230-L305 HydrophobicContact CG-CD1 3.37Å; L230-L305 HydrophobicContact CG-CG 4.37Å; L230-M309 HydrophobicContact CD2-SD 3.69Å; L230-F324 HydrophobicContact CD2-CE1 3.66Å; L230-F324 HydrophobicContact CD2-CZ 4.04Å; L230-L328 HydrophobicContact CD2-CD1 3.81Å; L230-L359 HydrophobicContact CD1-CD1 4.38Å; L230-F362 HydrophobicContact CD1-CB 4.5Å; L230-F362 HydrophobicContact CD1-CD2 4.15Å; L230-F362 HydrophobicContact CD1-CG 4.31Å
231	D	64	Low	56.5	Low	31 Å²	31	55.2 Å²	55.2	17%	0.166	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-51.3	179.1	-161.3	40.2	0	0	0	112	I227 D228 F229 A233 I234 F235	I227-D231 PolarHBondContact O-N 3.29Å; D228-D231 PolarHBondContact O-N 3.47Å; F229-D231 VanDerWaalsContact C-N 3.27Å; F229-D231 PolarHBondContact O-N 2.97Å; D231-A233 VanDerWaalsContact C-N 3.34Å; D231-A233 PolarHBondContact O-N 3.21Å; D231-I234 WeakPolarHBondContact O-CB 3.4Å; D231-I234 PolarHBondContact O-N 3.22Å; D231-F235 VanDerWaalsContact O-CD2 3.29Å; D231-F235 WeakPolarHBondContact O-CD2 3.47Å; D231-F235 PolarHBondContact O-N 2.83Å; D231-F235 WeakPolarHBondContact OD1-CD2 3.25Å; D231-F235 WeakPolarHBondContact OD1-CE2 3.37Å
232	R	65.9	Low	55.1	Low	144 Å²	144	60 Å²	60	54%	0.543	33%	0.328	S	S	.	.	H	α-helix	trans	-56.6	-45.2	175.4	-70.9	175.2	-177.5	179.6	2.3	112.3	D228 F229 I234 F235 D236	D228-R232 VanDerWaalsContact O-CG 3.31Å; D228-R232 WeakPolarHBondContact O-CG 3.14Å; D228-R232 PolarHBondContact O-N 3.49Å; F229-R232 PolarHBondContact O-N 2.54Å; R232-I234 VanDerWaalsContact C-N 3.29Å; R232-I234 PolarHBondContact O-N 2.81Å; R232-F235 PolarHBondContact O-N 3.43Å; R232-D236 WeakPolarHBondContact O-CB 3.46Å; R232-D236 PolarHBondContact O-N 2.82Å
233	A	59.8	Low	53.4	Low	20 Å²	20	68.2 Å²	68.2	17%	0.165	36%	0.359	C	S	.	.	H	α-helix	trans	-66.4	-30.3	178.2	0	0	0	0	0	112.6	F229 L230 D231 G237 M309 R313	F229-A233 HydrophobicContact CD1-CB 4.22Å; F229-A233 HydrophobicContact CE1-CB 4.28Å; F229-A233 WeakPolarHBondContact O-CB 3.45Å; F229-A233 PolarHBondContact O-N 3.42Å; L230-A233 PolarHBondContact O-N 3.48Å; D231-A233 VanDerWaalsContact C-N 3.34Å; D231-A233 PolarHBondContact O-N 3.21Å; A233-G237 PolarHBondContact O-N 2.99Å; A233-M309 HydrophobicContact CB-CE 4.32Å; A233-R313 PolarHBondContact O-NH2 2.95Å
234	I	63.1	Low	52	Low	1 Å²	1	75 Å²	75	1%	0.005	39%	0.388	C	S	.	.	H	α-helix	trans	-70.8	-49.9	173.3	-64.9	156.7	0	0	0	110.2	L230 D231 R232 G237 A238 M309 I321 F324 A325 L328	L230-I234 HydrophobicContact CD2-CD1 3.7Å; L230-I234 HydrophobicContact CD2-CG1 4.21Å; L230-I234 VanDerWaalsContact O-CD1 3.31Å; L230-I234 WeakPolarHBondContact O-CD1 3.28Å; L230-I234 WeakPolarHBondContact O-CG1 3.41Å; L230-I234 PolarHBondContact O-N 3.23Å; D231-I234 WeakPolarHBondContact O-CB 3.4Å; D231-I234 PolarHBondContact O-N 3.22Å; R232-I234 VanDerWaalsContact C-N 3.29Å; R232-I234 PolarHBondContact O-N 2.81Å; I234-G237 PolarHBondContact O-N 2.74Å; I234-A238 WeakPolarHBondContact O-CB 3.43Å; I234-A238 PolarHBondContact O-N 3.5Å; I234-M309 HydrophobicContact CB-CE 4.03Å; I234-M309 HydrophobicContact CG1-CE 3.29Å; I234-M309 HydrophobicContact CG1-SD 3.72Å; I234-I321 HydrophobicContact CG2-CG2 3.46Å; I234-I321 VanDerWaalsContact CG2-CG2 3.46Å; I234-F324 HydrophobicContact CD1-CD1 3.48Å; I234-F324 VanDerWaalsContact CD1-CD1 3.48Å; I234-F324 HydrophobicContact CD1-CE1 3.52Å; I234-F324 HydrophobicContact CG1-CD1 4.18Å; I234-F324 HydrophobicContact CG1-CE1 4.29Å; I234-A325 HydrophobicContact CB-CB 4.21Å; I234-A325 HydrophobicContact CD1-CB 4.18Å; I234-A325 HydrophobicContact CG2-CB 3.61Å; I234-L328 HydrophobicContact CD1-CD1 3.6Å
235	F	61.2	Low	50.9	Low	103 Å²	103	77.3 Å²	77.3	45%	0.452	41%	0.409	S	S	.	.	H	α-helix	trans	-65	-44.3	-177.5	-82.2	-72.2	0	0	0	113	D231 R232 G237 A238 T239 A325	D231-F235 VanDerWaalsContact O-CD2 3.29Å; D231-F235 WeakPolarHBondContact O-CD2 3.47Å; D231-F235 PolarHBondContact O-N 2.83Å; D231-F235 WeakPolarHBondContact OD1-CD2 3.25Å; D231-F235 WeakPolarHBondContact OD1-CE2 3.37Å; R232-F235 PolarHBondContact O-N 3.43Å; F235-G237 VanDerWaalsContact C-N 3.27Å; F235-G237 PolarHBondContact O-N 2.87Å; F235-A238 PolarHBondContact O-N 2.56Å; F235-T239 WeakPolarHBondContact O-CG2 3.5Å; F235-T239 PolarHBondContact O-N 2.87Å; F235-T239 PolarHBondContact O-OG1 3.46Å; F235-A325 HydrophobicContact CE2-CB 4.02Å; F235-A325 HydrophobicContact CZ-CB 4.12Å
236	D	58.4	Low	49.9	Very low	117 Å²	117	80 Å²	80	63%	0.626	43%	0.428	S	S	*	.	H	α-helix	trans	-65.8	-32.8	175.8	-74.4	-13.9	0	0	0	111.7	R232 T239 T240	R232-D236 WeakPolarHBondContact O-CB 3.46Å; R232-D236 PolarHBondContact O-N 2.82Å; D236-T239 PolarHBondContact O-OG1 2.99Å; D236-T240 PolarHBondContact O-OG1 2.88Å
237	G	50.3	Low	49	Very low	21 Å²	21	87.6 Å²	87.6	22%	0.216	47%	0.467	C	S	.	.	H	α-helix	trans	-81.9	-28.8	179.4	0	0	0	0	0	114.8	A233 I234 F235	A233-G237 PolarHBondContact O-N 2.99Å; I234-G237 PolarHBondContact O-N 2.74Å; F235-G237 VanDerWaalsContact C-N 3.27Å; F235-G237 PolarHBondContact O-N 2.87Å
238	A	46.8	Very low	47.6	Very low	21 Å²	21	97.2 Å²	97.2	17%	0.174	50%	0.504	C	S	.	.	H	α-helix	trans	-82.3	-20.2	-178.6	0	0	0	0	0	113	I234 F235 I321 Q322	I234-A238 WeakPolarHBondContact O-CB 3.43Å; I234-A238 PolarHBondContact O-N 3.5Å; F235-A238 PolarHBondContact O-N 2.56Å; A238-I321 HydrophobicContact CB-CG2 4.34Å; A238-Q322 HydrophobicContact CB-CG 4.15Å
239	T	43.5	Very low	46.3	Very low	106 Å²	106	100.3 Å²	100.3	65%	0.65	53%	0.529	S	S	*	.	S	Bend	trans	-86.8	-16.9	178.2	53.1	0	0	0	0	113.5	F235 D236	F235-T239 WeakPolarHBondContact O-CG2 3.5Å; F235-T239 PolarHBondContact O-N 2.87Å; F235-T239 PolarHBondContact O-OG1 3.46Å; D236-T239 PolarHBondContact O-OG1 2.99Å
240	T	39.1	Very low	45	Very low	90 Å²	90	104 Å²	104	55%	0.552	55%	0.553	S	S	*	*	S	Bend	trans	-98.3	122.7	175.3	52	0	0	0	0	112.3	D236 T242	D236-T240 PolarHBondContact O-OG1 2.88Å; T240-T242 PolarHBondContact O-N 3.33Å
241	P	34.6	Very low	43.4	Very low	120 Å²	120	110.8 Å²	110.8	78%	0.779	59%	0.589	S	S	*	*			trans	-63.9	132.8	171	-14.7	27.6	0	0	0	110.1	R243	P241-R243 PolarHBondContact O-N 3.42Å
242	T	40.4	Very low	41.7	Very low	124 Å²	124	115 Å²	115	76%	0.761	62%	0.621	S	S	*	*			trans	-53.5	92.5	176.4	-38.9	0	0	0	0	111.1	T240 H244	T240-T242 PolarHBondContact O-N 3.33Å; T242-H244 PolarHBondContact O-N 3.11Å
243	R	32.4	Very low	40.1	Very low	243 Å²	243	112.8 Å²	112.8	92%	0.917	63%	0.628	S	S	*	*			trans	-72.9	112	159.3	-77.3	-160.5	176	-170.7	1.6	106.9	P241	P241-R243 PolarHBondContact O-N 3.42Å
244	H	31.6	Very low	38.8	Very low	169 Å²	169	116.5 Å²	116.5	78%	0.782	65%	0.652	S	S	*	*			trans	-36.4	130.4	173.6	-78.5	-96.3	0	0	0	112	T242 S246	T242-H244 PolarHBondContact O-N 3.11Å; H244-S246 VanDerWaalsContact C-N 3.26Å; H244-S246 PolarHBondContact O-N 2.88Å
245	P	33.6	Very low	37.4	Very low	122 Å²	122	126.1 Å²	126.1	79%	0.792	69%	0.694	S	S	*	*			trans	-73.4	90.2	164.4	29.3	-27.6	0	0	0	106.8	L247	P245-L247 PolarHBondContact O-N 2.87Å; P245-L247 VanDerWaalsContact O-N 3.13Å
246	S	30.5	Very low	36	Very low	97 Å²	97	128.2 Å²	128.2	68%	0.678	72%	0.715	S	S	*	*			trans	-69.8	108.9	169.4	57.3	0	0	0	0	108.5	H244 Y248	H244-S246 VanDerWaalsContact C-N 3.26Å; H244-S246 PolarHBondContact O-N 2.88Å; S246-Y248 PolarHBondContact O-N 3.1Å
247	L	36.2	Very low	34.8	Very low	165 Å²	165	129.3 Å²	129.3	86%	0.864	72%	0.721	S	S	*	*			trans	-48.3	112.2	155.2	-68.9	162.5	0	0	0	109.3	P245	P245-L247 PolarHBondContact O-N 2.87Å; P245-L247 VanDerWaalsContact O-N 3.13Å
248	Y	30.8	Very low	33.9	Very low	221 Å²	221	134.7 Å²	134.7	87%	0.867	75%	0.749	S	S	*	*			trans	-139.6	106.5	153.3	-95.1	-81.8	0	0	0	108.8	S246	S246-Y248 PolarHBondContact O-N 3.1Å
249	S	30.3	Very low	33.3	Very low	109 Å²	109	142.3 Å²	142.3	76%	0.762	78%	0.778	S	S	*	*			trans	-67.1	148.2	159.2	-65.9	0	0	0	0	110.7
250	D	30.1	Very low	32.5	Very low	159 Å²	159	146.7 Å²	146.7	85%	0.85	79%	0.792	S	S	*	*			trans	37.3	122.8	147.3	-72.7	-36.2	0	0	0	120.6
251	D	28.4	Very low	31.8	Very low	143 Å²	143	146.2 Å²	146.2	77%	0.765	80%	0.797	S	S	*	*				154.6	115.7	102.2	-173.1	27.8	0	0	0	110.7
252	S	28.9	Very low	31.4	Very low	120 Å²	120	148.6 Å²	148.6	84%	0.839	80%	0.795	S	S	*	*			trans	-176.2	119.8	132.6	-96.8	0	0	0	0	113.7
253	S	33.1	Very low	30.7	Very low	98 Å²	98	147.6 Å²	147.6	69%	0.685	78%	0.782	S	S	*	*			trans	-72.3	148.2	168.6	166.2	0	0	0	0	113.8
254	S	30.7	Very low	30.3	Very low	98 Å²	98	144.2 Å²	144.2	69%	0.685	77%	0.769	S	S	*	*			trans	63.5	121.1	143.9	63.9	0	0	0	0	122.5
255	K	35.5	Very low	30	Very low	202 Å²	202	143.4 Å²	143.4	88%	0.878	77%	0.765	S	S	*	*			trans	38.3	121.4	135.6	-65.1	-177.9	176.1	175.1	0	118.3
256	V	30.6	Very low	29.6	Very low	148 Å²	148	142.9 Å²	142.9	90%	0.897	76%	0.76	S	S	*	*				-160.2	140.6	111.1	-156.9	0	0	0	0	110.1
257	D	32.6	Very low	29.3	Very low	140 Å²	140	143.1 Å²	143.1	75%	0.749	76%	0.762	S	S	*	*			trans	-51.4	151.1	162.1	-144.3	-83.4	0	0	0	112.9
258	V	32	Very low	29.3	Very low	133 Å²	133	139.5 Å²	139.5	81%	0.806	75%	0.748	S	S	*	*			trans	173.8	119	130.3	158	0	0	0	0	110.3
259	K	35.2	Very low	29.2	Very low	181 Å²	181	137.8 Å²	137.8	79%	0.787	75%	0.746	S	S	*	*			trans	-59.7	137.1	164.9	170.1	-175.8	179.8	177.7	0	112.6
260	E	26	Very low	29.6	Very low	199 Å²	199	137.4 Å²	137.4	93%	0.93	74%	0.74	S	S	*	*			trans	-148.2	145.8	138.6	-105.8	-163.9	163	0	0	112.1
261	A	25.1	Very low	29.4	Very low	79 Å²	79	138.8 Å²	138.8	65%	0.653	74%	0.739	S	S	*	*			trans	-111.3	-176.5	-172.2	0	0	0	0	0	110.2
262	F	25.9	Very low	29.3	Very low	171 Å²	171	140.6 Å²	140.6	75%	0.75	74%	0.743	S	S	*	*			trans	84.4	141.4	168.3	-104	-137.7	0	0	0	116.6
263	E	24.8	Very low	29.1	Very low	102 Å²	102	138.7 Å²	138.7	48%	0.477	74%	0.735	S	S	.	*			cis	-164.3	134.9	-2.4	-130	-175.1	-175.5	0	0	106.8
264	R	25.3	Very low	28.8	Very low	172 Å²	172	140.7 Å²	140.7	65%	0.649	74%	0.743	S	S	*	*				58.6	121.9	108	-161.3	-162.7	-69	121.7	17.6	116.3
265	E	25.3	Very low	28.6	Very low	152 Å²	152	145.3 Å²	145.3	71%	0.71	75%	0.754	S	S	*	*				175.6	115.8	111.1	-90.5	-158.3	173.9	0	0	111.8
266	T	23.8	Very low	28.1	Very low	112 Å²	112	139 Å²	139	69%	0.687	75%	0.746	S	S	*	*				84.3	104.2	115.6	54.5	0	0	0	0	114.7
267	S	24.3	Very low	27.9	Very low	101 Å²	101	138.2 Å²	138.2	71%	0.706	75%	0.747	S	S	*	*				71.4	148.7	72	-178.1	0	0	0	0	112.4
268	P	37.6	Very low	27.6	Very low	89 Å²	89	137.1 Å²	137.1	58%	0.578	75%	0.75	S	S	*	*			cis	-158	-179.9	-25.6	43.6	-25.1	0	0	0	119.6
269	F	27.9	Very low	28.1	Very low	186 Å²	186	136.3 Å²	136.3	82%	0.816	75%	0.748	S	S	*	*			trans	75.8	166	139.5	-69.2	-39.3	0	0	0	121.6
270	P	39.5	Very low	27.5	Very low	100 Å²	100	132.2 Å²	132.2	65%	0.649	74%	0.742	S	S	*	*			cis	-149.4	178.2	-46.4	43	-25.8	0	0	0	116.5
271	F	25.1	Very low	27.3	Very low	188 Å²	188	129.2 Å²	129.2	83%	0.825	74%	0.737	S	S	*	*			trans	66.7	143.4	146.8	-104.2	-115.4	0	0	0	119.8
272	E	27.2	Very low	27.2	Very low	181 Å²	181	131.2 Å²	131.2	85%	0.846	75%	0.747	S	S	*	*				-147.3	157.9	50.3	-81.1	-173.7	132.5	0	0	114.9
273	A	22.8	Very low	27.3	Very low	81 Å²	81	129.6 Å²	129.6	67%	0.669	75%	0.751	S	S	*	*			trans	-110.8	146.9	168.1	0	0	0	0	0	110.1
274	T	27.3	Very low	27.6	Very low	140 Å²	140	130.5 Å²	130.5	86%	0.859	77%	0.766	S	S	*	*			trans	-151.1	137.7	155.2	-39	0	0	0	0	111.4
275	E	26.8	Very low	27.4	Very low	195 Å²	195	126.9 Å²	126.9	91%	0.911	77%	0.772	S	S	*	*			trans	-78	163.1	-170.8	-57	171.5	127.1	0	0	114.5
276	G	25	Very low	27.4	Very low	69 Å²	69	125.4 Å²	125.4	71%	0.711	78%	0.779	S	S	*	*			trans	148.9	99.4	143.5	0	0	0	0	0	119
277	S	25.8	Very low	27.7	Very low	131 Å²	131	124.8 Å²	124.8	92%	0.916	78%	0.777	S	S	*	*			trans	94	102.4	141.9	-52	0	0	0	0	121
278	S	26.3	Very low	27.8	Very low	117 Å²	117	129.5 Å²	129.5	82%	0.818	79%	0.788	S	S	*	*			trans	-91.7	-178.6	153.5	-49	0	0	0	0	110
279	P	42.3	Very low	27.1	Very low	116 Å²	116	131.6 Å²	131.6	75%	0.753	80%	0.799	S	S	*	*			cis	-135.5	169.6	18.6	34.8	-10.8	0	0	0	115
280	S	23.1	Very low	27.1	Very low	96 Å²	96	132.4 Å²	132.4	67%	0.671	80%	0.802	S	S	*	*				-178	134.4	72.8	-53.4	0	0	0	0	113.4
281	T	22.5	Very low	26.3	Very low	135 Å²	135	132 Å²	132	83%	0.828	81%	0.807	S	S	*	*			trans	54.5	111.2	135.6	57	0	0	0	0	122.5
282	S	23.6	Very low	26.5	Very low	122 Å²	122	128.6 Å²	128.6	85%	0.853	80%	0.804	S	S	*	*				-175.3	119.2	111.9	56.2	0	0	0	0	112.3
283	T	26.1	Very low	26.6	Very low	137 Å²	137	126.1 Å²	126.1	84%	0.84	81%	0.807	S	S	*	*			trans	-91	152.1	150.8	15.9	0	0	0	0	108
284	P	31.1	Very low	27.2	Very low	121 Å²	121	130 Å²	130	79%	0.786	81%	0.811	S	S	*	*				-152.7	158.3	73.1	37.2	-15.4	0	0	0	118.6
285	A	22.6	Very low	27.9	Very low	95 Å²	95	125.7 Å²	125.7	79%	0.785	80%	0.795	S	S	*	*			trans	42.4	126.9	139.4	0	0	0	0	0	122.6
286	S	23.9	Very low	28.8	Very low	121 Å²	121	125.4 Å²	125.4	85%	0.846	79%	0.793	S	S	*	*				-173.7	158.7	119.1	-126.1	0	0	0	0	113.2
287	P	30.5	Very low	30	Very low	100 Å²	100	123.2 Å²	123.2	65%	0.649	77%	0.765	S	S	*	*			trans	-93.8	145.7	-157.4	36.4	-32.5	0	0	0	114	T289	P287-T289 PolarHBondContact O-N 3.25Å; P287-T289 VanDerWaalsContact O-N 3.16Å
288	Q	26.1	Very low	31.2	Very low	200 Å²	200	119.2 Å²	119.2	94%	0.935	74%	0.737	S	S	*	*			trans	-74.5	98.6	162.5	-74.8	-176.8	-34.8	0	0	109.4	K290	Q288-K290 PolarHBondContact O-N 3.3Å
289	T	23.4	Very low	32.3	Very low	132 Å²	132	118.8 Å²	118.8	81%	0.81	73%	0.73	S	S	*	*			trans	-66.6	106.1	157.1	28.4	0	0	0	0	108.8	P287 A291	P287-T289 PolarHBondContact O-N 3.25Å; P287-T289 VanDerWaalsContact O-N 3.16Å; T289-A291 PolarHBondContact O-N 3.06Å
290	K	27.9	Very low	32.7	Very low	203 Å²	203	117.2 Å²	117.2	88%	0.883	72%	0.719	S	S	*	*			trans	-69.3	112.9	156.4	-90.6	-179.1	173.1	-178.9	0	107.5	Q288	Q288-K290 PolarHBondContact O-N 3.3Å
291	A	22.6	Very low	34.3	Very low	92 Å²	92	113.7 Å²	113.7	76%	0.76	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-63.8	130.5	163.6	0	0	0	0	0	108.8	T289	T289-A291 PolarHBondContact O-N 3.06Å
292	P	30	Very low	36	Very low	117 Å²	117	108.6 Å²	108.6	76%	0.76	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-74.8	140.5	173.3	29.6	-30.2	0	0	0	110.5
293	S	29	Very low	37.9	Very low	128 Å²	128	108.7 Å²	108.7	90%	0.895	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-52.4	128.2	-174.4	-157.4	0	0	0	0	113.4
294	E	36.3	Very low	39.8	Very low	162 Å²	162	104.7 Å²	104.7	76%	0.757	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-91.6	132.7	176.8	-63.3	-165.3	146	0	0	112
295	G	40.2	Very low	41.6	Very low	51 Å²	51	99 Å²	99	53%	0.526	59%	0.59	S	S	.	*			trans	95.7	69.4	156.5	0	0	0	0	0	116.8
296	E	47.2	Very low	43.6	Very low	188 Å²	188	100.8 Å²	100.8	88%	0.879	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-83.6	122.6	164.3	-67.8	-171	172.1	0	0	110.2
297	L	50.6	Low	45.9	Very low	23 Å²	23	99.1 Å²	99.1	12%	0.12	56%	0.563	C	S	.	*	P	Polyproline II helix	trans	-68.2	154.4	175.3	-73.1	177	0	0	0	112.2	T226 F229 T299 A302 L305	T226-L297 WeakPolarHBondContact OG1-CD2 3.38Å; F229-L297 HydrophobicContact CB-CD1 3.47Å; F229-L297 VanDerWaalsContact CB-CD1 3.47Å; F229-L297 HydrophobicContact CB-CD2 4.5Å; F229-L297 HydrophobicContact CB-CG 4.08Å; F229-L297 HydrophobicContact CD1-CD1 3.7Å; F229-L297 HydrophobicContact CD2-CD1 3.6Å; F229-L297 HydrophobicContact CD2-CG 3.96Å; F229-L297 HydrophobicContact CE1-CD1 4.23Å; F229-L297 HydrophobicContact CE2-CD1 4.19Å; F229-L297 HydrophobicContact CG-CD1 3.3Å; F229-L297 HydrophobicContact CG-CG 4.07Å; F229-L297 HydrophobicContact CZ-CD1 4.46Å; L297-T299 PolarHBondContact O-N 3.44Å; L297-A302 HydrophobicContact CB-CB 4.27Å; L297-L305 HydrophobicContact CD1-CD2 3.74Å
298	S	50.8	Low	48.2	Very low	47 Å²	47	94.4 Å²	94.4	33%	0.329	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-54.6	136.2	165.9	177	0	0	0	0	110.3	T300 A301 A302	S298-T300 VanDerWaalsContact C-N 3.26Å; S298-T300 PolarHBondContact O-N 3.04Å; S298-T300 VanDerWaalsContact O-N 3.17Å; S298-A301 WeakPolarHBondContact O-CA 3.25Å; S298-A301 WeakPolarHBondContact O-CB 3.45Å; S298-A301 PolarHBondContact O-N 2.84Å; S298-A302 PolarHBondContact O-N 3.31Å
299	T	48.9	Very low	50.7	Low	109 Å²	109	85.1 Å²	85.1	67%	0.669	49%	0.489	S	S	*	.	H	α-helix	trans	-52	-41.6	-176.3	54.4	0	0	0	0	112.9	L297 A302 E303	L297-T299 PolarHBondContact O-N 3.44Å; T299-A302 PolarHBondContact O-N 3.21Å; T299-E303 WeakPolarHBondContact O-CG 3.37Å; T299-E303 PolarHBondContact O-N 2.99Å; T299-E303 VanDerWaalsContact O-N 3.1Å
300	T	51	Low	53.2	Low	83 Å²	83	82 Å²	82	51%	0.509	47%	0.47	S	S	.	.	H	α-helix	trans	-68.9	-37	177.4	-52	0	0	0	0	112.9	S298 L304	S298-T300 VanDerWaalsContact C-N 3.26Å; S298-T300 PolarHBondContact O-N 3.04Å; S298-T300 VanDerWaalsContact O-N 3.17Å; T300-L304 WeakPolarHBondContact O-CG 3.46Å; T300-L304 PolarHBondContact O-N 2.99Å
301	A	56.2	Low	55.7	Low	21 Å²	21	73.7 Å²	73.7	17%	0.174	44%	0.437	C	S	.	.	H	α-helix	trans	-69.1	-39.3	176.6	0	0	0	0	0	110.9	S298 L304 L305	S298-A301 WeakPolarHBondContact O-CA 3.25Å; S298-A301 WeakPolarHBondContact O-CB 3.45Å; S298-A301 PolarHBondContact O-N 2.84Å; A301-L304 PolarHBondContact O-N 3.37Å; A301-L305 VanDerWaalsContact O-CB 3.25Å; A301-L305 WeakPolarHBondContact O-CB 3.44Å; A301-L305 PolarHBondContact O-N 3.21Å
302	A	57.1	Low	58.5	Low	29 Å²	29	69.4 Å²	69.4	24%	0.24	40%	0.401	C	S	.	.	H	α-helix	trans	-62.1	-42.2	175.9	0	0	0	0	0	112.5	L297 S298 T299 L305 Q306	L297-A302 HydrophobicContact CB-CB 4.27Å; S298-A302 PolarHBondContact O-N 3.31Å; T299-A302 PolarHBondContact O-N 3.21Å; A302-L305 WeakPolarHBondContact O-CB 3.44Å; A302-L305 PolarHBondContact O-N 2.92Å; A302-Q306 WeakPolarHBondContact O-CB 3.4Å; A302-Q306 PolarHBondContact O-N 3.37Å
303	E	64.8	Low	60.7	Low	123 Å²	123	69.1 Å²	69.1	58%	0.575	39%	0.385	S	S	*	.	H	α-helix	trans	-63	-49.2	176.3	-74.4	176.1	-175	0	0	112.3	T299 L305 Q306 D307	T299-E303 WeakPolarHBondContact O-CG 3.37Å; T299-E303 PolarHBondContact O-N 2.99Å; T299-E303 VanDerWaalsContact O-N 3.1Å; E303-L305 PolarHBondContact O-N 3.36Å; E303-Q306 PolarHBondContact O-N 3.4Å; E303-D307 PolarHBondContact O-N 3.43Å
304	L	65.3	Low	63.1	Low	54 Å²	54	67.8 Å²	67.8	28%	0.283	37%	0.371	S	S	.	.	H	α-helix	trans	-59.5	-38	177.7	-70.9	168.8	0	0	0	111.9	T300 A301 Y308 F362 C394	T300-L304 WeakPolarHBondContact O-CG 3.46Å; T300-L304 PolarHBondContact O-N 2.99Å; A301-L304 PolarHBondContact O-N 3.37Å; L304-Y308 WeakPolarHBondContact O-CB 3.12Å; L304-Y308 PolarHBondContact O-N 3.48Å; L304-F362 HydrophobicContact CB-CZ 4.07Å; L304-C394 WeakPolarHBondContact CD1-SG 3.32Å
305	L	68.5	Low	65.5	Low	1 Å²	1	65.8 Å²	65.8	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-68.3	-42.9	178.1	-164.7	61.5	0	0	0	111.8	T226 F229 L230 L297 A301 A302 E303 Y308 M309 F362	T226-L305 HydrophobicContact CG2-CD1 4.21Å; T226-L305 HydrophobicContact CG2-CD2 4.08Å; F229-L305 HydrophobicContact CB-CD2 4.06Å; F229-L305 HydrophobicContact CD1-CD2 3.2Å; F229-L305 HydrophobicContact CD1-CG 4.36Å; F229-L305 HydrophobicContact CE1-CD2 3.89Å; F229-L305 HydrophobicContact CG-CD2 3.96Å; L230-L305 HydrophobicContact CB-CD1 4.16Å; L230-L305 HydrophobicContact CD1-CD1 3.41Å; L230-L305 VanDerWaalsContact CD1-CD1 3.41Å; L230-L305 HydrophobicContact CD2-CD1 4.47Å; L230-L305 HydrophobicContact CG-CD1 3.37Å; L230-L305 HydrophobicContact CG-CG 4.37Å; L297-L305 HydrophobicContact CD1-CD2 3.74Å; A301-L305 VanDerWaalsContact O-CB 3.25Å; A301-L305 WeakPolarHBondContact O-CB 3.44Å; A301-L305 PolarHBondContact O-N 3.21Å; A302-L305 WeakPolarHBondContact O-CB 3.44Å; A302-L305 PolarHBondContact O-N 2.92Å; E303-L305 PolarHBondContact O-N 3.36Å; L305-Y308 PolarHBondContact O-N 3.16Å; L305-M309 VanDerWaalsContact O-CB 3.31Å; L305-M309 WeakPolarHBondContact O-CB 3.32Å; L305-M309 VanDerWaalsContact O-CG 3.28Å; L305-M309 WeakPolarHBondContact O-CG 3.3Å; L305-M309 PolarHBondContact O-N 3.47Å; L305-F362 HydrophobicContact CB-CE1 4.5Å; L305-F362 HydrophobicContact CB-CZ 4.25Å; L305-F362 HydrophobicContact CD1-CD1 4.48Å; L305-F362 HydrophobicContact CD1-CD2 4.48Å; L305-F362 HydrophobicContact CD1-CE1 4.01Å; L305-F362 HydrophobicContact CD1-CE2 4.04Å; L305-F362 HydrophobicContact CD1-CZ 3.78Å
306	Q	65.7	Low	67.5	Low	132 Å²	132	63.9 Å²	63.9	62%	0.617	34%	0.338	S	S	*	.	H	α-helix	trans	-62.8	-42.5	176.7	-174.8	177.2	-10.8	0	0	111.5	A302 E303 M309 T310	A302-Q306 WeakPolarHBondContact O-CB 3.4Å; A302-Q306 PolarHBondContact O-N 3.37Å; E303-Q306 PolarHBondContact O-N 3.4Å; Q306-M309 PolarHBondContact O-N 2.84Å; Q306-T310 VanDerWaalsContact O-CB 3.28Å; Q306-T310 WeakPolarHBondContact O-CB 3.43Å; Q306-T310 PolarHBondContact O-N 3.12Å; Q306-T310 PolarHBondContact O-OG1 2.92Å
307	D	72.6	Confident	69.2	Low	86 Å²	86	57.6 Å²	57.6	46%	0.46	32%	0.315	S	S	.	.	H	α-helix	trans	-63.8	-42.1	176	-77.9	-12.2	0	0	0	111.7	E303 T311	E303-D307 PolarHBondContact O-N 3.43Å; D307-T311 WeakPolarHBondContact O-CB 3.35Å; D307-T311 PolarHBondContact O-N 3.19Å; D307-T311 PolarHBondContact O-OG1 3.03Å
308	Y	78.7	Confident	70.4	Confident	1 Å²	1	60 Å²	60	0%	0.004	33%	0.334	C	S	.	.	H	α-helix	trans	-63.7	-49.9	175.9	-176.2	-124.4	0	0	0	111.8	L304 L305 T310 T311 L312 F324 Y348 L355 L359 F362 F391	L304-Y308 WeakPolarHBondContact O-CB 3.12Å; L304-Y308 PolarHBondContact O-N 3.48Å; L305-Y308 PolarHBondContact O-N 3.16Å; Y308-T310 VanDerWaalsContact C-N 3.34Å; Y308-T310 PolarHBondContact O-N 3.26Å; Y308-T311 CarbonylContact O-C 3.58Å; Y308-T311 WeakPolarHBondContact O-CA 3.19Å; Y308-T311 WeakPolarHBondContact O-CB 3.11Å; Y308-T311 PolarHBondContact O-N 3.13Å; Y308-L312 HydrophobicContact CD1-CD1 4.03Å; Y308-L312 HydrophobicContact CD1-CG 4.43Å; Y308-L312 HydrophobicContact CD2-CG 4.4Å; Y308-L312 HydrophobicContact CE1-CD1 3.54Å; Y308-L312 HydrophobicContact CE1-CD2 4.49Å; Y308-L312 HydrophobicContact CE1-CG 4.1Å; Y308-L312 HydrophobicContact CE2-CD1 4.37Å; Y308-L312 HydrophobicContact CE2-CD2 3.94Å; Y308-L312 HydrophobicContact CE2-CG 4.05Å; Y308-L312 WeakPolarHBondContact O-CG 3.27Å; Y308-L312 PolarHBondContact O-N 3.14Å; Y308-F324 HydrophobicContact CE1-CZ 4.05Å; Y308-Y348 PolarHBondContact OH-OH 3.34Å; Y308-L355 VanDerWaalsContact CE2-O 3.26Å; Y308-L355 WeakPolarHBondContact CE2-O 3.31Å; Y308-L355 PolarHBondContact OH-O 3.4Å; Y308-L359 HydrophobicContact CE1-CD1 3.94Å; Y308-F362 HydrophobicContact CD1-CE2 4.2Å; Y308-F362 HydrophobicContact CG-CE2 4.39Å; Y308-F391 HydrophobicContact CD2-CE1 4.46Å
309	M	78.3	Confident	71.7	Confident	5 Å²	5	64 Å²	64	3%	0.025	35%	0.347	C	S	.	.	H	α-helix	trans	-62.4	-39.3	178.9	-76.4	-57.9	-67.1	0	0	112.7	L230 A233 I234 L305 Q306 T311 L312 R313	L230-M309 HydrophobicContact CD2-SD 3.69Å; A233-M309 HydrophobicContact CB-CE 4.32Å; I234-M309 HydrophobicContact CB-CE 4.03Å; I234-M309 HydrophobicContact CG1-CE 3.29Å; I234-M309 HydrophobicContact CG1-SD 3.72Å; L305-M309 VanDerWaalsContact O-CB 3.31Å; L305-M309 WeakPolarHBondContact O-CB 3.32Å; L305-M309 VanDerWaalsContact O-CG 3.28Å; L305-M309 WeakPolarHBondContact O-CG 3.3Å; L305-M309 PolarHBondContact O-N 3.47Å; Q306-M309 PolarHBondContact O-N 2.84Å; M309-T311 VanDerWaalsContact C-N 3.29Å; M309-T311 PolarHBondContact O-N 2.93Å; M309-L312 PolarHBondContact O-N 3.1Å; M309-L312 HydrophobicContact SD-CD1 4.11Å; M309-R313 WeakPolarHBondContact O-CB 3.43Å; M309-R313 VanDerWaalsContact O-CG 3.27Å; M309-R313 WeakPolarHBondContact O-CG 3.31Å; M309-R313 PolarHBondContact O-N 3.24Å
310	T	76.4	Confident	73.4	Confident	67 Å²	67	60.8 Å²	60.8	41%	0.411	33%	0.325	S	S	.	.	H	α-helix	trans	-61	-42.8	172.9	-59.5	0	0	0	0	110.4	Q306 Y308 R313 T314	Q306-T310 VanDerWaalsContact O-CB 3.28Å; Q306-T310 WeakPolarHBondContact O-CB 3.43Å; Q306-T310 PolarHBondContact O-N 3.12Å; Q306-T310 PolarHBondContact O-OG1 2.92Å; Y308-T310 VanDerWaalsContact C-N 3.34Å; Y308-T310 PolarHBondContact O-N 3.26Å; T310-R313 PolarHBondContact O-N 3.27Å; T310-T314 WeakPolarHBondContact O-CG2 3.09Å; T310-T314 PolarHBondContact O-N 3.21Å; T310-T314 VanDerWaalsContact O-N 3.16Å; T310-T314 PolarHBondContact O-OG1 2.98Å
311	T	80.4	Confident	74.9	Confident	29 Å²	29	57.5 Å²	57.5	18%	0.178	30%	0.304	C	S	.	.	H	α-helix	trans	-67.3	-43.4	177.8	-58.1	0	0	0	0	112.2	D307 Y308 M309 R313 T314 K315 L355 F391	D307-T311 WeakPolarHBondContact O-CB 3.35Å; D307-T311 PolarHBondContact O-N 3.19Å; D307-T311 PolarHBondContact O-OG1 3.03Å; Y308-T311 CarbonylContact O-C 3.58Å; Y308-T311 WeakPolarHBondContact O-CA 3.19Å; Y308-T311 WeakPolarHBondContact O-CB 3.11Å; Y308-T311 PolarHBondContact O-N 3.13Å; M309-T311 VanDerWaalsContact C-N 3.29Å; M309-T311 PolarHBondContact O-N 2.93Å; T311-R313 VanDerWaalsContact C-N 3.33Å; T311-R313 PolarHBondContact O-N 3.28Å; T311-T314 PolarHBondContact O-N 3.1Å; T311-T314 VanDerWaalsContact O-N 3.16Å; T311-T314 PolarHBondContact O-OG1 3.47Å; T311-K315 HydrophobicContact CG2-CG 4.19Å; T311-K315 WeakPolarHBondContact O-CB 3.41Å; T311-K315 WeakPolarHBondContact O-CG 3.24Å; T311-K315 PolarHBondContact O-N 3.07Å; T311-K315 VanDerWaalsContact O-N 3.1Å; T311-L355 HydrophobicContact CG2-CD2 3.69Å; T311-F391 HydrophobicContact CG2-CE2 4.06Å; T311-F391 HydrophobicContact CG2-CZ 3.73Å; T311-F391 VanDerWaalsContact OG1-CZ 3.25Å; T311-F391 WeakPolarHBondContact OG1-CZ 3.28Å
312	L	80.3	Confident	75.8	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-57.7	-46.9	174.8	-69.3	-175.8	0	0	0	111.2	Y308 M309 T314 K315 L316 F324 Y348 L355	Y308-L312 HydrophobicContact CD1-CD1 4.03Å; Y308-L312 HydrophobicContact CD1-CG 4.43Å; Y308-L312 HydrophobicContact CD2-CG 4.4Å; Y308-L312 HydrophobicContact CE1-CD1 3.54Å; Y308-L312 HydrophobicContact CE1-CD2 4.49Å; Y308-L312 HydrophobicContact CE1-CG 4.1Å; Y308-L312 HydrophobicContact CE2-CD1 4.37Å; Y308-L312 HydrophobicContact CE2-CD2 3.94Å; Y308-L312 HydrophobicContact CE2-CG 4.05Å; Y308-L312 WeakPolarHBondContact O-CG 3.27Å; Y308-L312 PolarHBondContact O-N 3.14Å; M309-L312 PolarHBondContact O-N 3.1Å; M309-L312 HydrophobicContact SD-CD1 4.11Å; L312-T314 PolarHBondContact O-N 2.94Å; L312-K315 PolarHBondContact O-N 3.21Å; L312-L316 HydrophobicContact CB-CD1 4.39Å; L312-L316 HydrophobicContact CD2-CD1 3.87Å; L312-L316 WeakPolarHBondContact O-CB 3.21Å; L312-L316 PolarHBondContact O-N 2.88Å; L312-F324 HydrophobicContact CD1-CD1 3.75Å; L312-F324 HydrophobicContact CD1-CE1 3.27Å; L312-F324 HydrophobicContact CD1-CZ 3.81Å; L312-Y348 HydrophobicContact CD2-CE1 4.37Å; L312-L355 HydrophobicContact CD2-CB 4.38Å; L312-L355 HydrophobicContact CD2-CD1 4.01Å; L312-L355 HydrophobicContact CD2-CD2 4.34Å; L312-L355 HydrophobicContact CD2-CG 4.48Å
313	R	76.4	Confident	77	Confident	110 Å²	110	64.5 Å²	64.5	42%	0.415	33%	0.328	S	S	.	.	H	α-helix	trans	-62.6	-23.7	178.2	-71.3	173.1	-173.2	148.1	-1	114.4	A233 M309 T310 T311 I321	A233-R313 PolarHBondContact O-NH2 2.95Å; M309-R313 WeakPolarHBondContact O-CB 3.43Å; M309-R313 VanDerWaalsContact O-CG 3.27Å; M309-R313 WeakPolarHBondContact O-CG 3.31Å; M309-R313 PolarHBondContact O-N 3.24Å; T310-R313 PolarHBondContact O-N 3.27Å; T311-R313 VanDerWaalsContact C-N 3.33Å; T311-R313 PolarHBondContact O-N 3.28Å; R313-I321 HydrophobicContact CB-CD1 4.44Å; R313-I321 HydrophobicContact CG-CD1 4.04Å
314	T	80	Confident	78.1	Confident	100 Å²	100	58.7 Å²	58.7	61%	0.613	30%	0.301	S	S	*	.	H	α-helix	trans	-90.4	-17.3	175.5	62.4	0	0	0	0	113.7	T310 T311 L312	T310-T314 WeakPolarHBondContact O-CG2 3.09Å; T310-T314 PolarHBondContact O-N 3.21Å; T310-T314 VanDerWaalsContact O-N 3.16Å; T310-T314 PolarHBondContact O-OG1 2.98Å; T311-T314 PolarHBondContact O-N 3.1Å; T311-T314 VanDerWaalsContact O-N 3.16Å; T311-T314 PolarHBondContact O-OG1 3.47Å; L312-T314 PolarHBondContact O-N 2.94Å
315	K	85.2	Confident	78.8	Confident	120 Å²	120	56.1 Å²	56.1	52%	0.522	29%	0.287	S	S	.	.	H	α-helix	trans	-113.1	-17.7	-173.5	-62.8	-61.7	-176.9	-176.5	0	114.2	T311 L312 R352 L355	T311-K315 HydrophobicContact CG2-CG 4.19Å; T311-K315 WeakPolarHBondContact O-CB 3.41Å; T311-K315 WeakPolarHBondContact O-CG 3.24Å; T311-K315 PolarHBondContact O-N 3.07Å; T311-K315 VanDerWaalsContact O-N 3.1Å; L312-K315 PolarHBondContact O-N 3.21Å; K315-R352 WeakPolarHBondContact O-CD 3.28Å; K315-R352 PolarHBondContact O-NH1 3.31Å; K315-L355 HydrophobicContact CB-CD1 4.04Å; K315-L355 HydrophobicContact CB-CD2 4.44Å; K315-L355 HydrophobicContact CG-CD2 4.32Å
316	L	83	Confident	79.4	Confident	11 Å²	11	58.2 Å²	58.2	6%	0.058	30%	0.304	C	S	.	.	S	Bend	trans	-119.8	148.2	179.8	-56.5	-177.2	0	0	0	110.1	L312 E320 I321 Y348 L355	L312-L316 HydrophobicContact CB-CD1 4.39Å; L312-L316 HydrophobicContact CD2-CD1 3.87Å; L312-L316 WeakPolarHBondContact O-CB 3.21Å; L312-L316 PolarHBondContact O-N 2.88Å; L316-E320 WeakPolarHBondContact CA-OE2 3.36Å; L316-E320 HydrophobicContact CB-CB 4.03Å; L316-I321 HydrophobicContact CB-CD1 4.34Å; L316-I321 HydrophobicContact CB-CG1 3.76Å; L316-I321 HydrophobicContact CD1-CG1 4.44Å; L316-Y348 HydrophobicContact CD1-CD1 4.18Å; L316-Y348 HydrophobicContact CD1-CE1 3.75Å; L316-Y348 HydrophobicContact CD2-CD1 4.1Å; L316-Y348 HydrophobicContact CD2-CE1 4.49Å; L316-L355 HydrophobicContact CD2-CD1 4.18Å; L316-L355 HydrophobicContact CG-CD1 4.39Å
317	S	83.1	Confident	80.4	Confident	56 Å²	56	52.9 Å²	52.9	39%	0.392	28%	0.28	S	S	.	.			trans	-73.7	163.1	170.1	64.3	0	0	0	0	111.6	Q319 E320 I321	S317-Q319 PolarHBondContact O-N 3.3Å; S317-E320 PolarHBondContact N-OE2 3.25Å; S317-E320 PolarHBondContact O-N 3.41Å; S317-E320 VanDerWaalsContact O-N 3.11Å; S317-E320 VanDerWaalsContact OG-CG 3.26Å; S317-E320 WeakPolarHBondContact OG-CG 3.39Å; S317-E320 PolarHBondContact OG-N 2.8Å; S317-E320 PolarHBondContact OG-OE2 3.43Å; S317-I321 VanDerWaalsContact O-CG1 3.26Å; S317-I321 WeakPolarHBondContact O-CG1 2.74Å; S317-I321 PolarHBondContact O-N 2.95Å
318	S	75.9	Confident	80.9	Confident	75 Å²	75	49.1 Å²	49.1	52%	0.524	26%	0.26	S	S	.	.	H	α-helix	trans	-56	-37.5	176.8	-54	0	0	0	0	113	I321 Q322	S318-I321 PolarHBondContact O-N 3.12Å; S318-Q322 WeakPolarHBondContact O-CG 3.5Å; S318-Q322 PolarHBondContact O-N 3.5Å
319	Q	77.6	Confident	80.7	Confident	130 Å²	130	53.2 Å²	53.2	61%	0.607	28%	0.279	S	S	*	.	H	α-helix	trans	-68.9	-41.5	176.9	-171.9	-179.2	15.5	0	0	111.9	S317 I321 Q322 Q323	S317-Q319 PolarHBondContact O-N 3.3Å; Q319-I321 VanDerWaalsContact C-N 3.29Å; Q319-I321 PolarHBondContact O-N 3.04Å; Q319-Q322 PolarHBondContact O-N 2.63Å; Q319-Q323 WeakPolarHBondContact O-CG 3.18Å; Q319-Q323 PolarHBondContact O-N 3.15Å
320	E	85.3	Confident	80.9	Confident	42 Å²	42	57.3 Å²	57.3	20%	0.196	30%	0.298	C	S	.	.	H	α-helix	trans	-66.9	-33.1	176	-71.5	169.4	134.3	0	0	111.6	L316 S317 Q323 F324 L347 R352	L316-E320 WeakPolarHBondContact CA-OE2 3.36Å; L316-E320 HydrophobicContact CB-CB 4.03Å; S317-E320 PolarHBondContact N-OE2 3.25Å; S317-E320 PolarHBondContact O-N 3.41Å; S317-E320 VanDerWaalsContact O-N 3.11Å; S317-E320 VanDerWaalsContact OG-CG 3.26Å; S317-E320 WeakPolarHBondContact OG-CG 3.39Å; S317-E320 PolarHBondContact OG-N 2.8Å; S317-E320 PolarHBondContact OG-OE2 3.43Å; E320-Q323 PolarHBondContact O-N 2.93Å; E320-F324 WeakPolarHBondContact O-CB 3.43Å; E320-F324 PolarHBondContact O-N 3.39Å; E320-L347 HydrophobicContact CB-CD1 3.9Å; E320-L347 HydrophobicContact CG-CD1 4.01Å; E320-R352 IonicContact OE1-CZ 3.28Å; E320-R352 IonicContact OE1-NH1 2.87Å; E320-R352 PolarHBondContact OE1-NH1 3.37Å; E320-R352 IonicContact OE1-NH2 2.86Å; E320-R352 PolarHBondContact OE1-NH2 3.26Å; E320-R352 IonicContact OE2-NH1 3.29Å; E320-R352 PolarHBondContact OE2-NH1 2.92Å
321	I	81.5	Confident	81.2	Confident	13 Å²	13	55.1 Å²	55.1	7%	0.067	28%	0.282	C	S	.	.	H	α-helix	trans	-67.5	-39.7	174.5	-69.7	166.2	0	0	0	110.9	I234 A238 R313 L316 S317 S318 Q319 F324 A325	I234-I321 HydrophobicContact CG2-CG2 3.46Å; I234-I321 VanDerWaalsContact CG2-CG2 3.46Å; A238-I321 HydrophobicContact CB-CG2 4.34Å; R313-I321 HydrophobicContact CB-CD1 4.44Å; R313-I321 HydrophobicContact CG-CD1 4.04Å; L316-I321 HydrophobicContact CB-CD1 4.34Å; L316-I321 HydrophobicContact CB-CG1 3.76Å; L316-I321 HydrophobicContact CD1-CG1 4.44Å; S317-I321 VanDerWaalsContact O-CG1 3.26Å; S317-I321 WeakPolarHBondContact O-CG1 2.74Å; S317-I321 PolarHBondContact O-N 2.95Å; S318-I321 PolarHBondContact O-N 3.12Å; Q319-I321 VanDerWaalsContact C-N 3.29Å; Q319-I321 PolarHBondContact O-N 3.04Å; I321-F324 WeakPolarHBondContact O-CB 3.33Å; I321-F324 PolarHBondContact O-N 2.9Å; I321-A325 PolarHBondContact O-N 3.38Å
322	Q	76.4	Confident	80.7	Confident	105 Å²	105	59.2 Å²	59.2	49%	0.491	29%	0.294	S	S	.	.	H	α-helix	trans	-64.6	-41	173	-72.4	170.4	-13.7	0	0	111.8	A238 S318 Q319 F324 A325 A326	A238-Q322 HydrophobicContact CB-CG 4.15Å; S318-Q322 WeakPolarHBondContact O-CG 3.5Å; S318-Q322 PolarHBondContact O-N 3.5Å; Q319-Q322 PolarHBondContact O-N 2.63Å; Q322-F324 VanDerWaalsContact C-N 3.32Å; Q322-F324 PolarHBondContact O-N 2.91Å; Q322-A325 WeakPolarHBondContact O-CB 3.47Å; Q322-A325 PolarHBondContact O-N 3.38Å; Q322-A326 PolarHBondContact O-N 3.08Å
323	Q	82.6	Confident	80.5	Confident	93 Å²	93	64.4 Å²	64.4	44%	0.435	32%	0.322	S	S	.	.	H	α-helix	trans	-64.1	-37.8	173.7	-71.8	173.7	-7.2	0	0	111.8	Q319 E320 A326 L327 L347	Q319-Q323 WeakPolarHBondContact O-CG 3.18Å; Q319-Q323 PolarHBondContact O-N 3.15Å; E320-Q323 PolarHBondContact O-N 2.93Å; Q323-A326 PolarHBondContact O-N 2.95Å; Q323-L327 WeakPolarHBondContact O-CG 3.38Å; Q323-L327 PolarHBondContact O-N 3.22Å; Q323-L347 HydrophobicContact CB-CD1 3.85Å; Q323-L347 HydrophobicContact CB-CD2 4.34Å; Q323-L347 VanDerWaalsContact OE1-CD1 3.26Å
324	F	86.8	Confident	80.5	Confident	1 Å²	1	62.4 Å²	62.4	0%	0.004	34%	0.336	C	S	.	.	H	α-helix	trans	-60.4	-44.1	173.5	174.8	-117.6	0	0	0	111.9	L230 I234 Y308 L312 E320 I321 Q322 L327 L328 L344 L347 Y348 L359	L230-F324 HydrophobicContact CD2-CE1 3.66Å; L230-F324 HydrophobicContact CD2-CZ 4.04Å; I234-F324 HydrophobicContact CD1-CD1 3.48Å; I234-F324 VanDerWaalsContact CD1-CD1 3.48Å; I234-F324 HydrophobicContact CD1-CE1 3.52Å; I234-F324 HydrophobicContact CG1-CD1 4.18Å; I234-F324 HydrophobicContact CG1-CE1 4.29Å; Y308-F324 HydrophobicContact CE1-CZ 4.05Å; L312-F324 HydrophobicContact CD1-CD1 3.75Å; L312-F324 HydrophobicContact CD1-CE1 3.27Å; L312-F324 HydrophobicContact CD1-CZ 3.81Å; E320-F324 WeakPolarHBondContact O-CB 3.43Å; E320-F324 PolarHBondContact O-N 3.39Å; I321-F324 WeakPolarHBondContact O-CB 3.33Å; I321-F324 PolarHBondContact O-N 2.9Å; Q322-F324 VanDerWaalsContact C-N 3.32Å; Q322-F324 PolarHBondContact O-N 2.91Å; F324-L327 PolarHBondContact O-N 2.75Å; F324-L328 HydrophobicContact CD1-CD1 4.19Å; F324-L328 HydrophobicContact CE1-CD1 3.65Å; F324-L328 HydrophobicContact CE2-CD1 4.09Å; F324-L328 HydrophobicContact CE2-CD2 4.43Å; F324-L328 HydrophobicContact CE2-CG 4.16Å; F324-L328 HydrophobicContact CZ-CD1 3.59Å; F324-L328 HydrophobicContact CZ-CD2 4.41Å; F324-L328 HydrophobicContact CZ-CG 4.15Å; F324-L328 PolarHBondContact O-N 3.42Å; F324-L328 VanDerWaalsContact O-N 3.13Å; F324-L344 HydrophobicContact CD2-CD1 3.39Å; F324-L344 HydrophobicContact CE2-CD1 3.57Å; F324-L347 HydrophobicContact CB-CD2 3.66Å; F324-L347 HydrophobicContact CD2-CD2 4.48Å; F324-Y348 HydrophobicContact CD2-CE1 4.35Å; F324-Y348 WeakPolarHBondContact CD2-OH 3.43Å; F324-Y348 WeakPolarHBondContact CE2-OH 3.47Å; F324-L359 HydrophobicContact CZ-CD1 4.33Å
325	A	79.4	Confident	80.6	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59.4	-48.3	175	0	0	0	0	0	111.6	I234 F235 I321 Q322 L327 L328 H329	I234-A325 HydrophobicContact CB-CB 4.21Å; I234-A325 HydrophobicContact CD1-CB 4.18Å; I234-A325 HydrophobicContact CG2-CB 3.61Å; F235-A325 HydrophobicContact CE2-CB 4.02Å; F235-A325 HydrophobicContact CZ-CB 4.12Å; I321-A325 PolarHBondContact O-N 3.38Å; Q322-A325 WeakPolarHBondContact O-CB 3.47Å; Q322-A325 PolarHBondContact O-N 3.38Å; A325-L327 VanDerWaalsContact C-N 3.27Å; A325-L327 PolarHBondContact O-N 3.23Å; A325-L328 WeakPolarHBondContact O-CB 3.42Å; A325-L328 PolarHBondContact O-N 2.87Å; A325-L328 VanDerWaalsContact O-N 3.07Å; A325-H329 PolarHBondContact O-N 2.96Å
326	A	82.3	Confident	80.7	Confident	44 Å²	44	56.7 Å²	56.7	36%	0.364	32%	0.315	S	S	.	.	H	α-helix	trans	-57	-41.6	178.7	0	0	0	0	0	112	Q322 Q323 H329 E330	Q322-A326 PolarHBondContact O-N 3.08Å; Q323-A326 PolarHBondContact O-N 2.95Å; A326-H329 PolarHBondContact O-N 3.39Å; A326-E330 WeakPolarHBondContact O-CG 3.42Å; A326-E330 PolarHBondContact O-N 3.02Å
327	L	85.9	Confident	80.8	Confident	20 Å²	20	57.1 Å²	57.1	11%	0.105	32%	0.317	C	S	.	.	H	α-helix	trans	-66	-36.9	176.9	-67.9	177.3	0	0	0	113.2	Q323 F324 A325 Y331 F340 N343 L344 L347	Q323-L327 WeakPolarHBondContact O-CG 3.38Å; Q323-L327 PolarHBondContact O-N 3.22Å; F324-L327 PolarHBondContact O-N 2.75Å; A325-L327 VanDerWaalsContact C-N 3.27Å; A325-L327 PolarHBondContact O-N 3.23Å; L327-Y331 WeakPolarHBondContact O-CB 3.45Å; L327-Y331 PolarHBondContact O-N 2.89Å; L327-F340 HydrophobicContact CB-CD2 4.18Å; L327-F340 HydrophobicContact CB-CE2 4.11Å; L327-F340 VanDerWaalsContact O-CD2 3.31Å; L327-F340 WeakPolarHBondContact O-CD2 3.31Å; L327-N343 HydrophobicContact CD1-CB 3.77Å; L327-N343 HydrophobicContact CD2-CB 3.44Å; L327-N343 VanDerWaalsContact CD2-CB 3.44Å; L327-N343 HydrophobicContact CG-CB 4.25Å; L327-L344 HydrophobicContact CD1-CD1 4.47Å; L327-L347 HydrophobicContact CD1-CD2 4.13Å
328	L	82.8	Confident	81	Confident	7 Å²	7	60.6 Å²	60.6	4%	0.037	33%	0.326	C	S	.	.	H	α-helix	trans	-65.8	-41.7	174.4	-73.3	171.2	0	0	0	111.4	L230 I234 F324 A325 Y331 R332 F340	L230-L328 HydrophobicContact CD2-CD1 3.81Å; I234-L328 HydrophobicContact CD1-CD1 3.6Å; F324-L328 HydrophobicContact CD1-CD1 4.19Å; F324-L328 HydrophobicContact CE1-CD1 3.65Å; F324-L328 HydrophobicContact CE2-CD1 4.09Å; F324-L328 HydrophobicContact CE2-CD2 4.43Å; F324-L328 HydrophobicContact CE2-CG 4.16Å; F324-L328 HydrophobicContact CZ-CD1 3.59Å; F324-L328 HydrophobicContact CZ-CD2 4.41Å; F324-L328 HydrophobicContact CZ-CG 4.15Å; F324-L328 PolarHBondContact O-N 3.42Å; F324-L328 VanDerWaalsContact O-N 3.13Å; A325-L328 WeakPolarHBondContact O-CB 3.42Å; A325-L328 PolarHBondContact O-N 2.87Å; A325-L328 VanDerWaalsContact O-N 3.07Å; L328-Y331 PolarHBondContact O-N 2.96Å; L328-R332 PolarHBondContact O-N 3.01Å; L328-F340 HydrophobicContact CD2-CE2 3.99Å; L328-F340 HydrophobicContact CD2-CZ 3.78Å; L328-F340 HydrophobicContact CG-CE2 4.48Å
329	H	76.3	Confident	81.6	Confident	88 Å²	88	61.7 Å²	61.7	41%	0.407	32%	0.323	S	S	.	.	H	α-helix	trans	-64.9	-44.7	177.5	-177.4	-82.5	0	0	0	112	A325 A326 Y331 R332 N333	A325-H329 PolarHBondContact O-N 2.96Å; A326-H329 PolarHBondContact O-N 3.39Å; H329-Y331 PolarHBondContact O-N 3.47Å; H329-R332 WeakPolarHBondContact O-CB 3.46Å; H329-R332 PolarHBondContact O-N 3.46Å; H329-N333 PolarHBondContact CE1-ND2 3.32Å; H329-N333 PolarHBondContact ND1-ND2 2.84Å; H329-N333 PolarHBondContact O-N 3.16Å
330	E	81.9	Confident	82.2	Confident	90 Å²	90	55.8 Å²	55.8	42%	0.421	30%	0.296	S	S	.	.	H	α-helix	trans	-60.4	-43.7	174.7	-76.2	177.6	-177.5	0	0	112.2	A326 R332 N333 G334 S335	A326-E330 WeakPolarHBondContact O-CG 3.42Å; A326-E330 PolarHBondContact O-N 3.02Å; E330-R332 VanDerWaalsContact C-N 3.28Å; E330-R332 PolarHBondContact O-N 2.72Å; E330-N333 PolarHBondContact O-N 3.39Å; E330-N333 VanDerWaalsContact O-N 3.14Å; E330-G334 PolarHBondContact O-N 3.18Å; E330-S335 WeakPolarHBondContact O-CB 3.39Å; E330-S335 PolarHBondContact O-N 3.29Å; E330-S335 PolarHBondContact O-OG 3.37Å
331	Y	82.5	Confident	82.3	Confident	22 Å²	22	53.9 Å²	53.9	9%	0.086	29%	0.287	C	S	.	.	H	α-helix	trans	-60.3	-38.9	175.5	171.4	-121.7	0	0	0	112.2	L327 L328 H329 N333 G334 F337 F340 P364 D367	L327-Y331 WeakPolarHBondContact O-CB 3.45Å; L327-Y331 PolarHBondContact O-N 2.89Å; L328-Y331 PolarHBondContact O-N 2.96Å; H329-Y331 PolarHBondContact O-N 3.47Å; Y331-N333 VanDerWaalsContact C-N 3.33Å; Y331-N333 PolarHBondContact O-N 3.07Å; Y331-G334 PolarHBondContact O-N 3.46Å; Y331-F337 HydrophobicContact CD2-CD2 4.27Å; Y331-F337 HydrophobicContact CE2-CB 4.16Å; Y331-F337 AromaticContact CE2-CD2 3.53Å; Y331-F337 HydrophobicContact CE2-CD2 3.53Å; Y331-F337 HydrophobicContact CE2-CE2 4.43Å; Y331-F337 HydrophobicContact CE2-CG 4.34Å; Y331-F337 AromaticContact CZ-CD2 3.76Å; Y331-F340 HydrophobicContact CD2-CB 4.25Å; Y331-F340 HydrophobicContact CD2-CD1 4.5Å; Y331-F340 HydrophobicContact CD2-CG 4.32Å; Y331-F340 HydrophobicContact CG-CB 4.38Å; Y331-F340 HydrophobicContact CG-CD1 4.28Å; Y331-F340 HydrophobicContact CG-CD2 4.25Å; Y331-F340 HydrophobicContact CG-CG 4.04Å; Y331-P364 HydrophobicContact CE1-CG 4.32Å; Y331-P364 VanDerWaalsContact OH-CD 3.31Å; Y331-P364 WeakPolarHBondContact OH-CD 3.47Å; Y331-P364 VanDerWaalsContact OH-CG 3.25Å; Y331-P364 WeakPolarHBondContact OH-CG 3.32Å; Y331-D367 PolarHBondContact OH-OD2 3.14Å
332	R	70.1	Confident	82.6	Confident	114 Å²	114	56.1 Å²	56.1	43%	0.43	30%	0.298	S	S	.	.	H	α-helix	trans	-64.5	-37.4	174.7	-172.9	179.6	174.1	103	-10.3	112.3	D228 L328 H329 E330 G334	D228-R332 VanDerWaalsContact CG-CZ 3.45Å; D228-R332 IonicContact OD1-CZ 3Å; D228-R332 IonicContact OD1-NE 2.83Å; D228-R332 IonicContact OD1-NH1 3.28Å; D228-R332 PolarHBondContact OD1-NH1 3.03Å; D228-R332 IonicContact OD1-NH2 2.69Å; D228-R332 PolarHBondContact OD1-NH2 3.37Å; D228-R332 VanDerWaalsContact OD1-NH2 3.16Å; D228-R332 IonicContact OD2-CZ 3.01Å; D228-R332 VanDerWaalsContact OD2-CZ 3.24Å; D228-R332 IonicContact OD2-NH1 3.96Å; D228-R332 PolarHBondContact OD2-NH1 3.44Å; D228-R332 IonicContact OD2-NH2 2.76Å; D228-R332 PolarHBondContact OD2-NH2 3.5Å; L328-R332 PolarHBondContact O-N 3.01Å; H329-R332 WeakPolarHBondContact O-CB 3.46Å; H329-R332 PolarHBondContact O-N 3.46Å; E330-R332 VanDerWaalsContact C-N 3.28Å; E330-R332 PolarHBondContact O-N 2.72Å; R332-G334 PolarHBondContact O-N 3.5Å; R332-G334 VanDerWaalsContact O-N 3.15Å
333	N	76.2	Confident	83.3	Confident	112 Å²	112	53 Å²	53	60%	0.599	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	15.9	-179.2	-67.8	-6.8	0	0	0	114	H329 E330 Y331	H329-N333 PolarHBondContact CE1-ND2 3.32Å; H329-N333 PolarHBondContact ND1-ND2 2.84Å; H329-N333 PolarHBondContact O-N 3.16Å; E330-N333 PolarHBondContact O-N 3.39Å; E330-N333 VanDerWaalsContact O-N 3.14Å; Y331-N333 VanDerWaalsContact C-N 3.33Å; Y331-N333 PolarHBondContact O-N 3.07Å
334	G	75.9	Confident	83.7	Confident	68 Å²	68	48.6 Å²	48.6	70%	0.701	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.6	9.2	172	0	0	0	0	0	115	E330 Y331 R332	E330-G334 PolarHBondContact O-N 3.18Å; Y331-G334 PolarHBondContact O-N 3.46Å; R332-G334 PolarHBondContact O-N 3.5Å; R332-G334 VanDerWaalsContact O-N 3.15Å
335	S	82	Confident	83.8	Confident	43 Å²	43	52.7 Å²	52.7	30%	0.301	28%	0.28	S	S	.	.			trans	-60	145.9	170.5	-70.8	0	0	0	0	111.2	E330 F337	E330-S335 WeakPolarHBondContact O-CB 3.39Å; E330-S335 PolarHBondContact O-N 3.29Å; E330-S335 PolarHBondContact O-OG 3.37Å; S335-F337 PolarHBondContact O-N 3.2Å
336	S	87.2	Confident	84.3	Confident	57 Å²	57	59 Å²	59	40%	0.399	31%	0.31	S	S	.	.			trans	-62.8	136.7	-175.5	77.7	0	0	0	0	111.4	H338 E339 F340	S336-H338 PolarHBondContact O-N 3.46Å; S336-H338 VanDerWaalsContact O-N 3.16Å; S336-E339 WeakPolarHBondContact O-CB 3.31Å; S336-E339 PolarHBondContact O-N 3.37Å; S336-E339 VanDerWaalsContact O-N 3.07Å; S336-E339 WeakPolarHBondContact OG-CB 3.25Å; S336-E339 PolarHBondContact OG-N 3.35Å; S336-F340 PolarHBondContact O-N 2.95Å
337	F	85.8	Confident	84.8	Confident	20 Å²	20	57.8 Å²	57.8	9%	0.088	30%	0.297	C	S	.	.	H	α-helix	trans	-58.2	-33	-179.8	-177.4	-107.3	0	0	0	113	Y331 S335 F340 C341 I363 D367 H370 F371	Y331-F337 HydrophobicContact CD2-CD2 4.27Å; Y331-F337 HydrophobicContact CE2-CB 4.16Å; Y331-F337 AromaticContact CE2-CD2 3.53Å; Y331-F337 HydrophobicContact CE2-CD2 3.53Å; Y331-F337 HydrophobicContact CE2-CE2 4.43Å; Y331-F337 HydrophobicContact CE2-CG 4.34Å; Y331-F337 AromaticContact CZ-CD2 3.76Å; S335-F337 PolarHBondContact O-N 3.2Å; F337-F340 HydrophobicContact CD2-CD1 4.15Å; F337-F340 HydrophobicContact CE2-CD1 4.03Å; F337-F340 HydrophobicContact CE2-CE1 4.43Å; F337-C341 WeakPolarHBondContact CE1-SG 3.26Å; F337-C341 WeakPolarHBondContact CZ-SG 3.48Å; F337-C341 PolarHBondContact O-N 3.03Å; F337-C341 PolarHBondContact O-SG 3.05Å; F337-I363 HydrophobicContact CE2-CD1 4.23Å; F337-I363 HydrophobicContact CE2-CG2 3.89Å; F337-I363 HydrophobicContact CZ-CG2 3.83Å; F337-D367 HydrophobicContact CB-CB 4.4Å; F337-D367 HydrophobicContact CD1-CB 3.77Å; F337-D367 HydrophobicContact CD2-CB 3.54Å; F337-D367 HydrophobicContact CE1-CB 3.85Å; F337-D367 WeakPolarHBondContact CE1-O 3.15Å; F337-D367 HydrophobicContact CE2-CB 3.61Å; F337-D367 HydrophobicContact CG-CB 3.61Å; F337-D367 VanDerWaalsContact CG-CG 3.47Å; F337-D367 HydrophobicContact CZ-CB 3.76Å; F337-H370 HydrophobicContact CD1-CB 3.78Å; F337-H370 HydrophobicContact CE1-CB 3.81Å; F337-F371 HydrophobicContact CE1-CB 3.96Å; F337-F371 HydrophobicContact CE1-CD2 4.3Å; F337-F371 HydrophobicContact CZ-CB 3.72Å; F337-F371 AromaticContact CZ-CD2 3.65Å; F337-F371 HydrophobicContact CZ-CD2 3.65Å; F337-F371 HydrophobicContact CZ-CG 4.05Å
338	H	87.2	Confident	85	Confident	128 Å²	128	56.8 Å²	56.8	59%	0.593	29%	0.292	S	S	*	.	H	α-helix	trans	-65.8	-43.4	176.9	-179.1	-97.2	0	0	0	112.1	S336 C341 I342	S336-H338 PolarHBondContact O-N 3.46Å; S336-H338 VanDerWaalsContact O-N 3.16Å; H338-C341 PolarHBondContact O-N 3.28Å; H338-I342 WeakPolarHBondContact CE1-CD1 3.32Å; H338-I342 WeakPolarHBondContact O-CG1 3.5Å; H338-I342 PolarHBondContact O-N 3.49Å
339	E	88.9	Confident	85.2	Confident	98 Å²	98	57.6 Å²	57.6	46%	0.458	30%	0.301	S	S	.	.	H	α-helix	trans	-65.7	-42.9	176.3	-177.2	168.8	-164.2	0	0	111.5	S336 C341 I342 N343	S336-E339 WeakPolarHBondContact O-CB 3.31Å; S336-E339 PolarHBondContact O-N 3.37Å; S336-E339 VanDerWaalsContact O-N 3.07Å; S336-E339 WeakPolarHBondContact OG-CB 3.25Å; S336-E339 PolarHBondContact OG-N 3.35Å; E339-C341 VanDerWaalsContact C-N 3.34Å; E339-C341 PolarHBondContact O-N 2.9Å; E339-I342 PolarHBondContact O-N 3.31Å; E339-N343 WeakPolarHBondContact O-CB 3.46Å; E339-N343 VanDerWaalsContact O-CG 3.27Å; E339-N343 PolarHBondContact O-N 3.28Å; E339-N343 PolarHBondContact O-ND2 3.03Å
340	F	89.2	Confident	85.7	Confident	6 Å²	6	58.2 Å²	58.2	3%	0.026	31%	0.308	C	S	.	.	H	α-helix	trans	-53.1	-50.3	171.2	172.3	-109.5	0	0	0	111.8	L327 L328 Y331 S336 F337 I342 N343 L344 L359 I363	L327-F340 HydrophobicContact CB-CD2 4.18Å; L327-F340 HydrophobicContact CB-CE2 4.11Å; L327-F340 VanDerWaalsContact O-CD2 3.31Å; L327-F340 WeakPolarHBondContact O-CD2 3.31Å; L328-F340 HydrophobicContact CD2-CE2 3.99Å; L328-F340 HydrophobicContact CD2-CZ 3.78Å; L328-F340 HydrophobicContact CG-CE2 4.48Å; Y331-F340 HydrophobicContact CD2-CB 4.25Å; Y331-F340 HydrophobicContact CD2-CD1 4.5Å; Y331-F340 HydrophobicContact CD2-CG 4.32Å; Y331-F340 HydrophobicContact CG-CB 4.38Å; Y331-F340 HydrophobicContact CG-CD1 4.28Å; Y331-F340 HydrophobicContact CG-CD2 4.25Å; Y331-F340 HydrophobicContact CG-CG 4.04Å; S336-F340 PolarHBondContact O-N 2.95Å; F337-F340 HydrophobicContact CD2-CD1 4.15Å; F337-F340 HydrophobicContact CE2-CD1 4.03Å; F337-F340 HydrophobicContact CE2-CE1 4.43Å; F340-I342 PolarHBondContact O-N 3.07Å; F340-N343 PolarHBondContact O-N 3.33Å; F340-L344 HydrophobicContact CE1-CD2 4.16Å; F340-L344 HydrophobicContact CZ-CD2 3.94Å; F340-L344 WeakPolarHBondContact O-CB 3.35Å; F340-L344 PolarHBondContact O-N 3.13Å; F340-L359 HydrophobicContact CE1-CD2 4.04Å; F340-L359 HydrophobicContact CZ-CD2 3.95Å; F340-I363 HydrophobicContact CE1-CD1 4.37Å
341	C	87.8	Confident	85.8	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.014	32%	0.322	C	S	.	.	H	α-helix	trans	-62.1	-40.5	178.8	-71.8	0	0	0	0	113.1	F337 H338 E339 R345 F374	F337-C341 WeakPolarHBondContact CE1-SG 3.26Å; F337-C341 WeakPolarHBondContact CZ-SG 3.48Å; F337-C341 PolarHBondContact O-N 3.03Å; F337-C341 PolarHBondContact O-SG 3.05Å; H338-C341 PolarHBondContact O-N 3.28Å; E339-C341 VanDerWaalsContact C-N 3.34Å; E339-C341 PolarHBondContact O-N 2.9Å; C341-R345 WeakPolarHBondContact O-CB 3.26Å; C341-R345 PolarHBondContact O-N 3.29Å; C341-F374 HydrophobicContact CB-CD1 3.89Å; C341-F374 HydrophobicContact CB-CD2 4.03Å; C341-F374 HydrophobicContact CB-CE1 3.79Å; C341-F374 HydrophobicContact CB-CE2 3.94Å; C341-F374 HydrophobicContact CB-CG 4Å; C341-F374 HydrophobicContact CB-CZ 3.8Å; C341-F374 WeakPolarHBondContact O-CZ 3.46Å
342	I	88.8	Confident	86.1	Confident	60 Å²	60	60.5 Å²	60.5	31%	0.308	33%	0.328	S	S	.	.	H	α-helix	trans	-62.8	-51.2	177	-73.8	172.8	0	0	0	110.5	H338 E339 F340 L344 R345 Q346	H338-I342 WeakPolarHBondContact CE1-CD1 3.32Å; H338-I342 WeakPolarHBondContact O-CG1 3.5Å; H338-I342 PolarHBondContact O-N 3.49Å; E339-I342 PolarHBondContact O-N 3.31Å; F340-I342 PolarHBondContact O-N 3.07Å; I342-L344 VanDerWaalsContact C-N 3.28Å; I342-L344 PolarHBondContact O-N 3.42Å; I342-R345 PolarHBondContact O-N 3.04Å; I342-Q346 WeakPolarHBondContact O-CG 3.48Å; I342-Q346 PolarHBondContact O-N 3.42Å
343	N	91	Very high	86.9	Confident	41 Å²	41	57 Å²	57	22%	0.219	32%	0.316	C	S	.	.	H	α-helix	trans	-63.2	-39.8	-177.9	-67.6	-17.4	0	0	0	110.7	L327 E339 F340 R345 Q346 L347	L327-N343 HydrophobicContact CD1-CB 3.77Å; L327-N343 HydrophobicContact CD2-CB 3.44Å; L327-N343 VanDerWaalsContact CD2-CB 3.44Å; L327-N343 HydrophobicContact CG-CB 4.25Å; E339-N343 WeakPolarHBondContact O-CB 3.46Å; E339-N343 VanDerWaalsContact O-CG 3.27Å; E339-N343 PolarHBondContact O-N 3.28Å; E339-N343 PolarHBondContact O-ND2 3.03Å; F340-N343 PolarHBondContact O-N 3.33Å; N343-R345 PolarHBondContact O-N 3.46Å; N343-Q346 WeakPolarHBondContact O-CB 3.48Å; N343-Q346 PolarHBondContact O-N 2.89Å; N343-L347 WeakPolarHBondContact O-CB 3.46Å; N343-L347 PolarHBondContact O-N 3.24Å
344	L	90.2	Very high	87.3	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.6	-39.9	177	-166.1	65.5	0	0	0	112.5	F324 L327 F340 I342 L347 Y348 L356 L359	F324-L344 HydrophobicContact CD2-CD1 3.39Å; F324-L344 HydrophobicContact CE2-CD1 3.57Å; L327-L344 HydrophobicContact CD1-CD1 4.47Å; F340-L344 HydrophobicContact CE1-CD2 4.16Å; F340-L344 HydrophobicContact CZ-CD2 3.94Å; F340-L344 WeakPolarHBondContact O-CB 3.35Å; F340-L344 PolarHBondContact O-N 3.13Å; I342-L344 VanDerWaalsContact C-N 3.28Å; I342-L344 PolarHBondContact O-N 3.42Å; L344-L347 HydrophobicContact CD1-CD2 4.49Å; L344-L347 PolarHBondContact O-N 3.02Å; L344-Y348 HydrophobicContact CD1-CE1 3.89Å; L344-Y348 HydrophobicContact CD1-CE2 3.94Å; L344-Y348 HydrophobicContact CD2-CE2 4.1Å; L344-Y348 HydrophobicContact CG-CD2 4.22Å; L344-Y348 HydrophobicContact CG-CE1 4.47Å; L344-Y348 HydrophobicContact CG-CE2 3.73Å; L344-Y348 PolarHBondContact O-N 3.07Å; L344-L356 HydrophobicContact CB-CD2 4.38Å; L344-L356 HydrophobicContact CD2-CD2 3.31Å; L344-L356 HydrophobicContact CG-CD2 3.72Å; L344-L359 HydrophobicContact CD2-CD2 3.39Å
345	R	88.1	Confident	87.7	Confident	87 Å²	87	53.5 Å²	53.5	33%	0.328	28%	0.277	S	S	.	.	H	α-helix	trans	-64.1	-40.7	172.6	178.8	-169.1	-174.8	-89.2	-9.4	111.7	C341 I342 N343 L347 Y348 G349 D350 F374	C341-R345 WeakPolarHBondContact O-CB 3.26Å; C341-R345 PolarHBondContact O-N 3.29Å; I342-R345 PolarHBondContact O-N 3.04Å; N343-R345 PolarHBondContact O-N 3.46Å; R345-L347 VanDerWaalsContact C-N 3.35Å; R345-Y348 PolarHBondContact O-N 3.29Å; R345-G349 WeakPolarHBondContact O-CA 3.42Å; R345-G349 PolarHBondContact O-N 2.85Å; R345-D350 IonicContact CZ-OD1 2.73Å; R345-D350 IonicContact NH2-OD1 3.78Å; R345-D350 PolarHBondContact NH2-OD1 3.02Å; R345-D350 IonicContact NH2-OD2 3.03Å; R345-F374 HydrophobicContact CB-CE1 4.35Å; R345-F374 HydrophobicContact CB-CZ 3.78Å; R345-F374 HydrophobicContact CG-CZ 4.41Å
346	Q	91.3	Very high	88	Confident	133 Å²	133	51.5 Å²	51.5	62%	0.621	26%	0.263	S	S	*	.	H	α-helix	trans	-62.9	-44.4	177.4	-71.6	179	20.2	0	0	111.1	I342 N343 G349	I342-Q346 WeakPolarHBondContact O-CG 3.48Å; I342-Q346 PolarHBondContact O-N 3.42Å; N343-Q346 WeakPolarHBondContact O-CB 3.48Å; N343-Q346 PolarHBondContact O-N 2.89Å; Q346-G349 PolarHBondContact O-N 2.97Å
347	L	91.6	Very high	87.8	Confident	17 Å²	17	50.4 Å²	50.4	9%	0.089	25%	0.252	C	S	.	.	H	α-helix	trans	-59.7	-47.5	176.7	-177.4	63.4	0	0	0	112	E320 Q323 F324 L327 N343 L344 R345 R352	E320-L347 HydrophobicContact CB-CD1 3.9Å; E320-L347 HydrophobicContact CG-CD1 4.01Å; Q323-L347 HydrophobicContact CB-CD1 3.85Å; Q323-L347 HydrophobicContact CB-CD2 4.34Å; Q323-L347 VanDerWaalsContact OE1-CD1 3.26Å; F324-L347 HydrophobicContact CB-CD2 3.66Å; F324-L347 HydrophobicContact CD2-CD2 4.48Å; L327-L347 HydrophobicContact CD1-CD2 4.13Å; N343-L347 WeakPolarHBondContact O-CB 3.46Å; N343-L347 PolarHBondContact O-N 3.24Å; L344-L347 HydrophobicContact CD1-CD2 4.49Å; L344-L347 PolarHBondContact O-N 3.02Å; R345-L347 VanDerWaalsContact C-N 3.35Å; L347-R352 PolarHBondContact O-NH2 3.4Å
348	Y	90.4	Very high	87.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-73.4	-34.6	-179.8	-64.9	-11.6	0	0	0	112.5	Y308 L312 L316 F324 L344 R345 R352 L355 L356	Y308-Y348 PolarHBondContact OH-OH 3.34Å; L312-Y348 HydrophobicContact CD2-CE1 4.37Å; L316-Y348 HydrophobicContact CD1-CD1 4.18Å; L316-Y348 HydrophobicContact CD1-CE1 3.75Å; L316-Y348 HydrophobicContact CD2-CD1 4.1Å; L316-Y348 HydrophobicContact CD2-CE1 4.49Å; F324-Y348 HydrophobicContact CD2-CE1 4.35Å; F324-Y348 WeakPolarHBondContact CD2-OH 3.43Å; F324-Y348 WeakPolarHBondContact CE2-OH 3.47Å; L344-Y348 HydrophobicContact CD1-CE1 3.89Å; L344-Y348 HydrophobicContact CD1-CE2 3.94Å; L344-Y348 HydrophobicContact CD2-CE2 4.1Å; L344-Y348 HydrophobicContact CG-CD2 4.22Å; L344-Y348 HydrophobicContact CG-CE1 4.47Å; L344-Y348 HydrophobicContact CG-CE2 3.73Å; L344-Y348 PolarHBondContact O-N 3.07Å; R345-Y348 PolarHBondContact O-N 3.29Å; Y348-R352 WeakPolarHBondContact O-CB 3.35Å; Y348-R352 PolarHBondContact O-NE 3.23Å; Y348-R352 PolarHBondContact O-NH2 2.88Å; Y348-L355 HydrophobicContact CD1-CD1 4.34Å; Y348-L355 HydrophobicContact CD2-CB 3.87Å; Y348-L355 HydrophobicContact CE2-CB 3.73Å; Y348-L355 HydrophobicContact CG-CB 4.41Å; Y348-L355 HydrophobicContact CG-CD1 4.42Å; Y348-L356 HydrophobicContact CD2-CD2 3.9Å; Y348-L356 HydrophobicContact CD2-CG 3.87Å; Y348-L356 HydrophobicContact CE2-CD2 3.75Å; Y348-L356 HydrophobicContact CE2-CG 4.03Å
349	G	87.9	Confident	87.2	Confident	23 Å²	23	43.9 Å²	43.9	24%	0.237	22%	0.224	C	C	.	.	H	α-helix	trans	67	174.5	-173.5	0	0	0	0	0	113.2	R345 Q346 S351 R352 K353	R345-G349 WeakPolarHBondContact O-CA 3.42Å; R345-G349 PolarHBondContact O-N 2.85Å; Q346-G349 PolarHBondContact O-N 2.97Å; G349-S351 VanDerWaalsContact C-N 3.25Å; G349-S351 PolarHBondContact O-N 3.39Å; G349-R352 PolarHBondContact O-N 2.54Å; G349-K353 PolarHBondContact O-N 2.94Å
350	D	85.2	Confident	86.7	Confident	102 Å²	102	42.7 Å²	42.7	55%	0.545	22%	0.216	S	C	.	.	H	α-helix	trans	-67.2	-24.6	-174.6	-76	-45.8	0	0	0	113.9	R345	R345-D350 IonicContact CZ-OD1 2.73Å; R345-D350 IonicContact NH2-OD1 3.78Å; R345-D350 PolarHBondContact NH2-OD1 3.02Å; R345-D350 IonicContact NH2-OD2 3.03Å
351	S	84.6	Confident	85.7	Confident	103 Å²	103	45.3 Å²	45.3	72%	0.72	23%	0.233	S	C	*	.	H	α-helix	trans	-76.6	-24.9	179.2	54.8	0	0	0	0	113.6	G349	G349-S351 VanDerWaalsContact C-N 3.25Å; G349-S351 PolarHBondContact O-N 3.39Å
352	R	89.7	Confident	84.9	Confident	57 Å²	57	45.9 Å²	45.9	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-123.2	9.4	-175.2	-50.8	169.9	-70.8	-169.5	0.3	113.5	K315 E320 L347 Y348 G349 F354 L355	K315-R352 WeakPolarHBondContact O-CD 3.28Å; K315-R352 PolarHBondContact O-NH1 3.31Å; E320-R352 IonicContact OE1-CZ 3.28Å; E320-R352 IonicContact OE1-NH1 2.87Å; E320-R352 PolarHBondContact OE1-NH1 3.37Å; E320-R352 IonicContact OE1-NH2 2.86Å; E320-R352 PolarHBondContact OE1-NH2 3.26Å; E320-R352 IonicContact OE2-NH1 3.29Å; E320-R352 PolarHBondContact OE2-NH1 2.92Å; L347-R352 PolarHBondContact O-NH2 3.4Å; Y348-R352 WeakPolarHBondContact O-CB 3.35Å; Y348-R352 PolarHBondContact O-NE 3.23Å; Y348-R352 PolarHBondContact O-NH2 2.88Å; G349-R352 PolarHBondContact O-N 2.54Å; R352-F354 PolarHBondContact O-N 3.2Å; R352-L355 HydrophobicContact CB-CD1 3.82Å; R352-L355 HydrophobicContact CB-CG 4.31Å; R352-L355 WeakPolarHBondContact O-CB 3.4Å; R352-L355 VanDerWaalsContact O-CG 3.25Å; R352-L355 WeakPolarHBondContact O-CG 3.5Å; R352-L355 PolarHBondContact O-N 3.16Å
353	K	85	Confident	84.4	Confident	39 Å²	39	43.7 Å²	43.7	17%	0.17	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-20.7	179.2	65.6	-180	-177.4	179.3	0	115.2	G349 L355 L356 I378 V380	G349-K353 PolarHBondContact O-N 2.94Å; K353-L355 PolarHBondContact O-N 3.43Å; K353-L356 WeakPolarHBondContact O-CB 3.26Å; K353-L356 WeakPolarHBondContact O-CD1 3.2Å; K353-L356 WeakPolarHBondContact O-CG 3.44Å; K353-L356 PolarHBondContact O-N 3.07Å; K353-I378 PolarHBondContact NZ-O 3.35Å; K353-V380 HydrophobicContact CB-CG2 4.15Å; K353-V380 HydrophobicContact CD-CG2 3.71Å; K353-V380 HydrophobicContact CG-CG2 3.65Å
354	F	84.9	Confident	83.4	Confident	93 Å²	93	42.5 Å²	42.5	41%	0.408	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-19.1	174.4	-57.4	-76.5	0	0	0	113.5	R352 L356 L357 V380 I387	R352-F354 PolarHBondContact O-N 3.2Å; F354-L356 PolarHBondContact O-N 2.84Å; F354-L357 WeakPolarHBondContact O-CB 3.25Å; F354-L357 PolarHBondContact O-N 3.16Å; F354-V380 HydrophobicContact CD1-CG1 4.26Å; F354-V380 HydrophobicContact CD1-CG2 4.48Å; F354-I387 HydrophobicContact CD1-CD1 3.6Å; F354-I387 HydrophobicContact CE1-CD1 4.01Å; F354-I387 HydrophobicContact CG-CD1 4.28Å
355	L	85.9	Confident	82.2	Confident	15 Å²	15	48.1 Å²	48.1	8%	0.079	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-21.2	173	-65.6	175	0	0	0	112.6	Y308 T311 L312 K315 L316 Y348 R352 K353 L357 G358	Y308-L355 VanDerWaalsContact CE2-O 3.26Å; Y308-L355 WeakPolarHBondContact CE2-O 3.31Å; Y308-L355 PolarHBondContact OH-O 3.4Å; T311-L355 HydrophobicContact CG2-CD2 3.69Å; L312-L355 HydrophobicContact CD2-CB 4.38Å; L312-L355 HydrophobicContact CD2-CD1 4.01Å; L312-L355 HydrophobicContact CD2-CD2 4.34Å; L312-L355 HydrophobicContact CD2-CG 4.48Å; K315-L355 HydrophobicContact CB-CD1 4.04Å; K315-L355 HydrophobicContact CB-CD2 4.44Å; K315-L355 HydrophobicContact CG-CD2 4.32Å; L316-L355 HydrophobicContact CD2-CD1 4.18Å; L316-L355 HydrophobicContact CG-CD1 4.39Å; Y348-L355 HydrophobicContact CD1-CD1 4.34Å; Y348-L355 HydrophobicContact CD2-CB 3.87Å; Y348-L355 HydrophobicContact CE2-CB 3.73Å; Y348-L355 HydrophobicContact CG-CB 4.41Å; Y348-L355 HydrophobicContact CG-CD1 4.42Å; R352-L355 HydrophobicContact CB-CD1 3.82Å; R352-L355 HydrophobicContact CB-CG 4.31Å; R352-L355 WeakPolarHBondContact O-CB 3.4Å; R352-L355 VanDerWaalsContact O-CG 3.25Å; R352-L355 WeakPolarHBondContact O-CG 3.5Å; R352-L355 PolarHBondContact O-N 3.16Å; K353-L355 PolarHBondContact O-N 3.43Å; L355-L357 PolarHBondContact O-N 3.42Å; L355-G358 PolarHBondContact O-N 2.81Å; L355-G358 VanDerWaalsContact O-N 3.15Å
356	L	86.8	Confident	81.4	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.3	-27.9	173.2	-65.7	167.3	0	0	0	112.3	L344 Y348 K353 F354 G358 L359 R360 F371 F374 L375 I378	L344-L356 HydrophobicContact CB-CD2 4.38Å; L344-L356 HydrophobicContact CD2-CD2 3.31Å; L344-L356 HydrophobicContact CG-CD2 3.72Å; Y348-L356 HydrophobicContact CD2-CD2 3.9Å; Y348-L356 HydrophobicContact CD2-CG 3.87Å; Y348-L356 HydrophobicContact CE2-CD2 3.75Å; Y348-L356 HydrophobicContact CE2-CG 4.03Å; K353-L356 WeakPolarHBondContact O-CB 3.26Å; K353-L356 WeakPolarHBondContact O-CD1 3.2Å; K353-L356 WeakPolarHBondContact O-CG 3.44Å; K353-L356 PolarHBondContact O-N 3.07Å; F354-L356 PolarHBondContact O-N 2.84Å; L356-G358 VanDerWaalsContact C-N 3.28Å; L356-G358 PolarHBondContact O-N 3.1Å; L356-L359 WeakPolarHBondContact O-CB 3.38Å; L356-L359 PolarHBondContact O-N 2.87Å; L356-L359 VanDerWaalsContact O-N 3.14Å; L356-R360 PolarHBondContact O-N 3.06Å; L356-F371 HydrophobicContact CB-CZ 4.12Å; L356-F371 HydrophobicContact CD2-CE2 4.4Å; L356-F371 HydrophobicContact CD2-CZ 4.46Å; L356-F371 WeakPolarHBondContact O-CZ 3.19Å; L356-F374 HydrophobicContact CD1-CE1 3.95Å; L356-L375 HydrophobicContact CB-CD2 3.6Å; L356-L375 HydrophobicContact CD1-CD2 4.14Å; L356-L375 HydrophobicContact CG-CD2 4.49Å; L356-I378 HydrophobicContact CD1-CD1 3.28Å
357	L	84	Confident	80.8	Confident	35 Å²	35	45.9 Å²	45.9	18%	0.183	24%	0.237	C	C	.	.	H	α-helix	trans	-65.6	-34.6	176	-65.6	174.6	0	0	0	111.9	F354 L355 L359 R360 L375 V380 I387	F354-L357 WeakPolarHBondContact O-CB 3.25Å; F354-L357 PolarHBondContact O-N 3.16Å; L355-L357 PolarHBondContact O-N 3.42Å; L357-L359 PolarHBondContact O-N 3.01Å; L357-R360 WeakPolarHBondContact O-CB 3.46Å; L357-R360 PolarHBondContact O-N 3.47Å; L357-L375 HydrophobicContact CD2-CD1 4.08Å; L357-V380 HydrophobicContact CD1-CG1 3.96Å; L357-V380 HydrophobicContact CD2-CG1 3.81Å; L357-V380 HydrophobicContact CG-CG1 3.71Å; L357-I387 HydrophobicContact CD1-CD1 4.27Å
358	G	78.3	Confident	80.1	Confident	7 Å²	7	46.3 Å²	46.3	7%	0.072	24%	0.241	C	C	.	.	H	α-helix	trans	-68.4	-22.8	175.4	0	0	0	0	0	113	L355 L356 P361 F362	L355-G358 PolarHBondContact O-N 2.81Å; L355-G358 VanDerWaalsContact O-N 3.15Å; L356-G358 VanDerWaalsContact C-N 3.28Å; L356-G358 PolarHBondContact O-N 3.1Å; G358-P361 WeakPolarHBondContact O-CD 3.45Å; G358-F362 WeakPolarHBondContact O-CD2 3.49Å; G358-F362 WeakPolarHBondContact O-CE2 3.34Å
359	L	81.8	Confident	79.5	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-81.7	-23.8	176.1	-164.5	65.6	0	0	0	112.9	L230 Y308 F324 F340 L344 L356 L357 P361 F362 I363 F371	L230-L359 HydrophobicContact CD1-CD1 4.38Å; Y308-L359 HydrophobicContact CE1-CD1 3.94Å; F324-L359 HydrophobicContact CZ-CD1 4.33Å; F340-L359 HydrophobicContact CE1-CD2 4.04Å; F340-L359 HydrophobicContact CZ-CD2 3.95Å; L344-L359 HydrophobicContact CD2-CD2 3.39Å; L356-L359 WeakPolarHBondContact O-CB 3.38Å; L356-L359 PolarHBondContact O-N 2.87Å; L356-L359 VanDerWaalsContact O-N 3.14Å; L357-L359 PolarHBondContact O-N 3.01Å; L359-P361 VanDerWaalsContact C-N 3.34Å; L359-P361 VanDerWaalsContact O-N 3.17Å; L359-F362 HydrophobicContact CD1-CD2 4.42Å; L359-F362 WeakPolarHBondContact O-CA 3.46Å; L359-F362 WeakPolarHBondContact O-CB 3.44Å; L359-F362 PolarHBondContact O-N 3.38Å; L359-I363 HydrophobicContact CD2-CD1 3.76Å; L359-I363 HydrophobicContact CG-CD1 3.74Å; L359-I363 HydrophobicContact CG-CG1 4.37Å; L359-I363 PolarHBondContact O-N 2.88Å; L359-F371 HydrophobicContact CB-CZ 4.4Å
360	R	78.9	Confident	79.2	Confident	74 Å²	74	56.2 Å²	56.2	28%	0.279	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-49.4	-39	-175.4	-172.4	-179.8	172.1	133.6	4.7	115.4	L356 L357 F362 F371 E372	L356-R360 PolarHBondContact O-N 3.06Å; L357-R360 WeakPolarHBondContact O-CB 3.46Å; L357-R360 PolarHBondContact O-N 3.47Å; R360-F362 PolarHBondContact O-N 3.28Å; R360-F371 HydrophobicContact CB-CD1 4.45Å; R360-F371 HydrophobicContact CB-CE1 3.9Å; R360-F371 HydrophobicContact CG-CD1 4.4Å; R360-F371 HydrophobicContact CG-CE1 4.3Å; R360-E372 IonicContact CZ-OE1 2.64Å; R360-E372 IonicContact CZ-OE2 2.76Å; R360-E372 IonicContact NE-OE1 3.92Å; R360-E372 PolarHBondContact NE-OE1 3.39Å; R360-E372 IonicContact NE-OE2 2.95Å; R360-E372 IonicContact NH1-OE1 3.7Å; R360-E372 PolarHBondContact NH1-OE1 3.17Å; R360-E372 IonicContact NH1-OE2 3.57Å; R360-E372 PolarHBondContact NH1-OE2 3.14Å; R360-E372 IonicContact NH2-OE1 2.72Å; R360-E372 PolarHBondContact NH2-OE1 3.23Å; R360-E372 IonicContact NH2-OE2 2.77Å; R360-E372 PolarHBondContact NH2-OE2 3.08Å
361	P	66.7	Low	79.3	Confident	60 Å²	60	51.4 Å²	51.4	39%	0.39	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-66.9	-20.8	177	-20.9	35.4	0	0	0	113.9	G358 L359	G358-P361 WeakPolarHBondContact O-CD 3.45Å; L359-P361 VanDerWaalsContact C-N 3.34Å; L359-P361 VanDerWaalsContact O-N 3.17Å
362	F	71.9	Confident	79.3	Confident	15 Å²	15	48.5 Å²	48.5	7%	0.066	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-104.2	-4.3	-171.5	-46.9	-60.7	0	0	0	113.4	T226 L230 L304 L305 Y308 G358 L359 R360	T226-F362 HydrophobicContact CG2-CD1 3.36Å; T226-F362 HydrophobicContact CG2-CE1 3.64Å; T226-F362 HydrophobicContact CG2-CG 4.31Å; L230-F362 HydrophobicContact CD1-CB 4.5Å; L230-F362 HydrophobicContact CD1-CD2 4.15Å; L230-F362 HydrophobicContact CD1-CG 4.31Å; L304-F362 HydrophobicContact CB-CZ 4.07Å; L305-F362 HydrophobicContact CB-CE1 4.5Å; L305-F362 HydrophobicContact CB-CZ 4.25Å; L305-F362 HydrophobicContact CD1-CD1 4.48Å; L305-F362 HydrophobicContact CD1-CD2 4.48Å; L305-F362 HydrophobicContact CD1-CE1 4.01Å; L305-F362 HydrophobicContact CD1-CE2 4.04Å; L305-F362 HydrophobicContact CD1-CZ 3.78Å; Y308-F362 HydrophobicContact CD1-CE2 4.2Å; Y308-F362 HydrophobicContact CG-CE2 4.39Å; G358-F362 WeakPolarHBondContact O-CD2 3.49Å; G358-F362 WeakPolarHBondContact O-CE2 3.34Å; L359-F362 HydrophobicContact CD1-CD2 4.42Å; L359-F362 WeakPolarHBondContact O-CA 3.46Å; L359-F362 WeakPolarHBondContact O-CB 3.44Å; L359-F362 PolarHBondContact O-N 3.38Å; R360-F362 PolarHBondContact O-N 3.28Å
363	I	77.3	Confident	79.1	Confident	13 Å²	13	49.3 Å²	49.3	7%	0.067	24%	0.239	C	C	.	.	S	Bend	trans	-75.5	127.8	176.7	-60.1	-56.1	0	0	0	109.9	F337 F340 L359 D367 F371	F337-I363 HydrophobicContact CE2-CD1 4.23Å; F337-I363 HydrophobicContact CE2-CG2 3.89Å; F337-I363 HydrophobicContact CZ-CG2 3.83Å; F340-I363 HydrophobicContact CE1-CD1 4.37Å; L359-I363 HydrophobicContact CD2-CD1 3.76Å; L359-I363 HydrophobicContact CG-CD1 3.74Å; L359-I363 HydrophobicContact CG-CG1 4.37Å; L359-I363 PolarHBondContact O-N 2.88Å; I363-D367 HydrophobicContact CG2-CB 3.96Å; I363-F371 HydrophobicContact CD1-CD2 4.49Å; I363-F371 HydrophobicContact CD1-CE2 4.38Å; I363-F371 HydrophobicContact CG1-CD1 3.88Å; I363-F371 HydrophobicContact CG1-CD2 4.23Å; I363-F371 HydrophobicContact CG1-CE1 3.95Å; I363-F371 HydrophobicContact CG1-CE2 4.3Å; I363-F371 HydrophobicContact CG1-CG 4.01Å; I363-F371 HydrophobicContact CG1-CZ 4.15Å; I363-F371 HydrophobicContact CG2-CB 4.21Å; I363-F371 HydrophobicContact CG2-CG 4.41Å
364	P	71.3	Confident	79.2	Confident	16 Å²	16	48.8 Å²	48.8	10%	0.104	24%	0.236	C	C	.	.			trans	-53.3	144.8	173.4	-24.3	31.5	0	0	0	112.9	T223 I227 Y331 K366 D367 S368	T223-P364 HydrophobicContact CG2-CB 4.03Å; T223-P364 HydrophobicContact CG2-CG 3.58Å; I227-P364 HydrophobicContact CD1-CG 4.44Å; Y331-P364 HydrophobicContact CE1-CG 4.32Å; Y331-P364 VanDerWaalsContact OH-CD 3.31Å; Y331-P364 WeakPolarHBondContact OH-CD 3.47Å; Y331-P364 VanDerWaalsContact OH-CG 3.25Å; Y331-P364 WeakPolarHBondContact OH-CG 3.32Å; P364-K366 VanDerWaalsContact C-N 3.27Å; P364-K366 HydrophobicContact CB-CG 3.87Å; P364-K366 PolarHBondContact O-N 3.04Å; P364-D367 CarbonylContact O-C 3.59Å; P364-D367 PolarHBondContact O-N 3.42Å; P364-S368 PolarHBondContact O-N 3.01Å
365	E	65.6	Low	79.3	Confident	119 Å²	119	44.5 Å²	44.5	56%	0.556	22%	0.218	S	C	*	.	H	α-helix	trans	-62.6	-32.8	-175.8	-176.5	165.2	-155.8	0	0	113.5	Q219 D367 S368	Q219-E365 PolarHBondContact NE2-OE2 3.33Å; E365-D367 PolarHBondContact O-N 3.29Å; E365-D367 VanDerWaalsContact O-N 3.1Å; E365-S368 WeakPolarHBondContact O-CB 3.34Å; E365-S368 PolarHBondContact O-N 3.16Å; E365-S368 VanDerWaalsContact O-N 3.1Å; E365-S368 PolarHBondContact O-OG 3.07Å
366	K	70.8	Confident	79.3	Confident	152 Å²	152	48.9 Å²	48.9	66%	0.661	24%	0.238	S	C	*	.	H	α-helix	trans	-51	-33.2	171.8	61.6	175.1	-175.4	-175.8	0	112.4	P364	P364-K366 VanDerWaalsContact C-N 3.27Å; P364-K366 HydrophobicContact CB-CG 3.87Å; P364-K366 PolarHBondContact O-N 3.04Å
367	D	78	Confident	79.2	Confident	21 Å²	21	54.6 Å²	54.6	11%	0.112	27%	0.273	C	S	.	.	H	α-helix	trans	-106.6	-7.7	-176	-67.6	-38.7	0	0	0	113.3	Y331 F337 I363 P364 E365 Q369 H370 F371	Y331-D367 PolarHBondContact OH-OD2 3.14Å; F337-D367 HydrophobicContact CB-CB 4.4Å; F337-D367 HydrophobicContact CD1-CB 3.77Å; F337-D367 HydrophobicContact CD2-CB 3.54Å; F337-D367 HydrophobicContact CE1-CB 3.85Å; F337-D367 WeakPolarHBondContact CE1-O 3.15Å; F337-D367 HydrophobicContact CE2-CB 3.61Å; F337-D367 HydrophobicContact CG-CB 3.61Å; F337-D367 VanDerWaalsContact CG-CG 3.47Å; F337-D367 HydrophobicContact CZ-CB 3.76Å; I363-D367 HydrophobicContact CG2-CB 3.96Å; P364-D367 CarbonylContact O-C 3.59Å; P364-D367 PolarHBondContact O-N 3.42Å; E365-D367 PolarHBondContact O-N 3.29Å; E365-D367 VanDerWaalsContact O-N 3.1Å; D367-Q369 PolarHBondContact O-N 3.11Å; D367-H370 WeakPolarHBondContact O-CB 3.43Å; D367-H370 PolarHBondContact O-N 3.42Å; D367-F371 PolarHBondContact O-N 2.9Å
368	S	77.3	Confident	79.2	Confident	25 Å²	25	53.8 Å²	53.8	18%	0.175	27%	0.269	C	S	.	.	H	α-helix	trans	-59.4	-42.6	-174.5	69.2	0	0	0	0	113.5	P364 E365 F371 E372	P364-S368 PolarHBondContact O-N 3.01Å; E365-S368 WeakPolarHBondContact O-CB 3.34Å; E365-S368 PolarHBondContact O-N 3.16Å; E365-S368 VanDerWaalsContact O-N 3.1Å; E365-S368 PolarHBondContact O-OG 3.07Å; S368-F371 WeakPolarHBondContact O-CB 3.33Å; S368-F371 PolarHBondContact O-N 3.18Å; S368-E372 WeakPolarHBondContact O-CG 3.22Å; S368-E372 PolarHBondContact O-N 2.89Å
369	Q	78.5	Confident	79.2	Confident	117 Å²	117	55.9 Å²	55.9	55%	0.547	29%	0.29	S	S	.	.	H	α-helix	trans	-69	-38.1	-179.6	-172.3	61.2	48.1	0	0	111.4	D367 F371 E372 N373	D367-Q369 PolarHBondContact O-N 3.11Å; Q369-F371 VanDerWaalsContact C-N 3.27Å; Q369-F371 PolarHBondContact O-N 3.03Å; Q369-E372 PolarHBondContact O-N 2.8Å; Q369-N373 PolarHBondContact NE2-OD1 2.78Å; Q369-N373 VanDerWaalsContact NE2-OD1 3.16Å; Q369-N373 PolarHBondContact O-N 3.15Å; Q369-N373 PolarHBondContact O-ND2 3.31Å; Q369-N373 PolarHBondContact O-OD1 3.1Å
370	H	81.9	Confident	78.9	Confident	114 Å²	114	55.9 Å²	55.9	53%	0.528	29%	0.29	S	S	.	.	H	α-helix	trans	-62.5	-38.9	173.1	-61.4	106.7	0	0	0	110.7	F337 D367 N373 F374	F337-H370 HydrophobicContact CD1-CB 3.78Å; F337-H370 HydrophobicContact CE1-CB 3.81Å; D367-H370 WeakPolarHBondContact O-CB 3.43Å; D367-H370 PolarHBondContact O-N 3.42Å; H370-N373 PolarHBondContact O-N 3.1Å; H370-F374 WeakPolarHBondContact O-CB 3.25Å; H370-F374 PolarHBondContact O-N 3.06Å
371	F	86.2	Confident	78.3	Confident	1 Å²	1	58.5 Å²	58.5	0%	0.004	30%	0.303	C	S	.	.	H	α-helix	trans	-65.2	-44.9	176.9	-163.5	-118.7	0	0	0	112.4	F337 L356 L359 R360 I363 D367 S368 Q369 N373 F374 L375	F337-F371 HydrophobicContact CE1-CB 3.96Å; F337-F371 HydrophobicContact CE1-CD2 4.3Å; F337-F371 HydrophobicContact CZ-CB 3.72Å; F337-F371 AromaticContact CZ-CD2 3.65Å; F337-F371 HydrophobicContact CZ-CD2 3.65Å; F337-F371 HydrophobicContact CZ-CG 4.05Å; L356-F371 HydrophobicContact CB-CZ 4.12Å; L356-F371 HydrophobicContact CD2-CE2 4.4Å; L356-F371 HydrophobicContact CD2-CZ 4.46Å; L356-F371 WeakPolarHBondContact O-CZ 3.19Å; L359-F371 HydrophobicContact CB-CZ 4.4Å; R360-F371 HydrophobicContact CB-CD1 4.45Å; R360-F371 HydrophobicContact CB-CE1 3.9Å; R360-F371 HydrophobicContact CG-CD1 4.4Å; R360-F371 HydrophobicContact CG-CE1 4.3Å; I363-F371 HydrophobicContact CD1-CD2 4.49Å; I363-F371 HydrophobicContact CD1-CE2 4.38Å; I363-F371 HydrophobicContact CG1-CD1 3.88Å; I363-F371 HydrophobicContact CG1-CD2 4.23Å; I363-F371 HydrophobicContact CG1-CE1 3.95Å; I363-F371 HydrophobicContact CG1-CE2 4.3Å; I363-F371 HydrophobicContact CG1-CG 4.01Å; I363-F371 HydrophobicContact CG1-CZ 4.15Å; I363-F371 HydrophobicContact CG2-CB 4.21Å; I363-F371 HydrophobicContact CG2-CG 4.41Å; D367-F371 PolarHBondContact O-N 2.9Å; S368-F371 WeakPolarHBondContact O-CB 3.33Å; S368-F371 PolarHBondContact O-N 3.18Å; Q369-F371 VanDerWaalsContact C-N 3.27Å; Q369-F371 PolarHBondContact O-N 3.03Å; F371-N373 PolarHBondContact O-N 3.05Å; F371-F374 WeakPolarHBondContact O-CB 3.12Å; F371-F374 PolarHBondContact O-N 2.98Å; F371-L375 HydrophobicContact CD1-CD1 3.89Å; F371-L375 HydrophobicContact CD1-CG 4.3Å; F371-L375 HydrophobicContact CE1-CD1 3.74Å; F371-L375 HydrophobicContact CE1-CD2 4.4Å; F371-L375 HydrophobicContact CE1-CG 4.17Å; F371-L375 HydrophobicContact CZ-CD1 4.43Å; F371-L375 HydrophobicContact CZ-CD2 4.29Å; F371-L375 HydrophobicContact CZ-CG 4.43Å; F371-L375 VanDerWaalsContact O-CG 3.31Å; F371-L375 WeakPolarHBondContact O-CG 3.32Å; F371-L375 PolarHBondContact O-N 2.93Å
372	E	85.8	Confident	77.8	Confident	43 Å²	43	62.5 Å²	62.5	20%	0.201	32%	0.322	C	S	.	.	H	α-helix	trans	-60.3	-45.8	175.4	-65.3	-51.8	149.9	0	0	112.1	R360 S368 Q369 F374 L375 E376	R360-E372 IonicContact CZ-OE1 2.64Å; R360-E372 IonicContact CZ-OE2 2.76Å; R360-E372 IonicContact NE-OE1 3.92Å; R360-E372 PolarHBondContact NE-OE1 3.39Å; R360-E372 IonicContact NE-OE2 2.95Å; R360-E372 IonicContact NH1-OE1 3.7Å; R360-E372 PolarHBondContact NH1-OE1 3.17Å; R360-E372 IonicContact NH1-OE2 3.57Å; R360-E372 PolarHBondContact NH1-OE2 3.14Å; R360-E372 IonicContact NH2-OE1 2.72Å; R360-E372 PolarHBondContact NH2-OE1 3.23Å; R360-E372 IonicContact NH2-OE2 2.77Å; R360-E372 PolarHBondContact NH2-OE2 3.08Å; S368-E372 WeakPolarHBondContact O-CG 3.22Å; S368-E372 PolarHBondContact O-N 2.89Å; Q369-E372 PolarHBondContact O-N 2.8Å; E372-F374 VanDerWaalsContact C-N 3.27Å; E372-F374 PolarHBondContact O-N 2.95Å; E372-L375 PolarHBondContact O-N 3.02Å; E372-E376 PolarHBondContact O-N 3.18Å
373	N	84.3	Confident	76.5	Confident	74 Å²	74	64 Å²	64	40%	0.396	34%	0.342	S	S	.	.	H	α-helix	trans	-62.5	-38.3	177.6	-66	-11.8	0	0	0	111	Q369 H370 F371 E376 T377	Q369-N373 PolarHBondContact NE2-OD1 2.78Å; Q369-N373 VanDerWaalsContact NE2-OD1 3.16Å; Q369-N373 PolarHBondContact O-N 3.15Å; Q369-N373 PolarHBondContact O-ND2 3.31Å; Q369-N373 PolarHBondContact O-OD1 3.1Å; H370-N373 PolarHBondContact O-N 3.1Å; F371-N373 PolarHBondContact O-N 3.05Å; N373-E376 PolarHBondContact O-N 3.31Å; N373-T377 WeakPolarHBondContact O-CB 3.41Å; N373-T377 PolarHBondContact O-N 3.32Å; N373-T377 PolarHBondContact O-OG1 2.69Å
374	F	87.5	Confident	75	Confident	28 Å²	28	76 Å²	76	12%	0.123	39%	0.386	C	S	.	.	H	α-helix	trans	-64.3	-49.3	175	179.2	-105.1	0	0	0	111.7	C341 R345 L356 H370 F371 E372 E376 T377 I378	C341-F374 HydrophobicContact CB-CD1 3.89Å; C341-F374 HydrophobicContact CB-CD2 4.03Å; C341-F374 HydrophobicContact CB-CE1 3.79Å; C341-F374 HydrophobicContact CB-CE2 3.94Å; C341-F374 HydrophobicContact CB-CG 4Å; C341-F374 HydrophobicContact CB-CZ 3.8Å; C341-F374 WeakPolarHBondContact O-CZ 3.46Å; R345-F374 HydrophobicContact CB-CE1 4.35Å; R345-F374 HydrophobicContact CB-CZ 3.78Å; R345-F374 HydrophobicContact CG-CZ 4.41Å; L356-F374 HydrophobicContact CD1-CE1 3.95Å; H370-F374 WeakPolarHBondContact O-CB 3.25Å; H370-F374 PolarHBondContact O-N 3.06Å; F371-F374 WeakPolarHBondContact O-CB 3.12Å; F371-F374 PolarHBondContact O-N 2.98Å; E372-F374 VanDerWaalsContact C-N 3.27Å; E372-F374 PolarHBondContact O-N 2.95Å; F374-E376 VanDerWaalsContact C-N 3.29Å; F374-E376 PolarHBondContact O-N 3.3Å; F374-T377 WeakPolarHBondContact O-CB 3.49Å; F374-T377 PolarHBondContact O-N 3.43Å; F374-T377 VanDerWaalsContact O-N 3.08Å; F374-I378 HydrophobicContact CD1-CD1 4.29Å; F374-I378 HydrophobicContact CD2-CG2 4.46Å; F374-I378 HydrophobicContact CE1-CD1 3.97Å; F374-I378 HydrophobicContact CE1-CG2 4.29Å; F374-I378 HydrophobicContact CE2-CG2 4.05Å; F374-I378 HydrophobicContact CZ-CG2 3.97Å; F374-I378 WeakPolarHBondContact O-CG1 3.41Å; F374-I378 PolarHBondContact O-N 3.28Å
375	L	86.9	Confident	73.5	Confident	2 Å²	2	78 Å²	78	1%	0.01	41%	0.409	C	S	.	.	H	α-helix	trans	-56	-43.2	175.8	-71.7	178.4	0	0	0	111.7	L356 L357 F371 E372 I378 G379 V380	L356-L375 HydrophobicContact CB-CD2 3.6Å; L356-L375 HydrophobicContact CD1-CD2 4.14Å; L356-L375 HydrophobicContact CG-CD2 4.49Å; L357-L375 HydrophobicContact CD2-CD1 4.08Å; F371-L375 HydrophobicContact CD1-CD1 3.89Å; F371-L375 HydrophobicContact CD1-CG 4.3Å; F371-L375 HydrophobicContact CE1-CD1 3.74Å; F371-L375 HydrophobicContact CE1-CD2 4.4Å; F371-L375 HydrophobicContact CE1-CG 4.17Å; F371-L375 HydrophobicContact CZ-CD1 4.43Å; F371-L375 HydrophobicContact CZ-CD2 4.29Å; F371-L375 HydrophobicContact CZ-CG 4.43Å; F371-L375 VanDerWaalsContact O-CG 3.31Å; F371-L375 WeakPolarHBondContact O-CG 3.32Å; F371-L375 PolarHBondContact O-N 2.93Å; E372-L375 PolarHBondContact O-N 3.02Å; L375-I378 HydrophobicContact CD2-CD1 4.19Å; L375-I378 WeakPolarHBondContact O-CG1 3.38Å; L375-I378 PolarHBondContact O-N 2.88Å; L375-G379 PolarHBondContact O-N 2.86Å; L375-V380 CarbonylContact C-O 3.4Å; L375-V380 HydrophobicContact CD2-CB 4.17Å; L375-V380 HydrophobicContact CD2-CG1 4.02Å; L375-V380 PolarHBondContact O-N 3.43Å
376	E	85.5	Confident	72.4	Confident	107 Å²	107	80.1 Å²	80.1	50%	0.5	42%	0.422	S	S	.	.	H	α-helix	trans	-62.4	-44.2	175	177.1	159.8	-138.5	0	0	111.9	E372 N373 F374 I378 G379 K381	E372-E376 PolarHBondContact O-N 3.18Å; N373-E376 PolarHBondContact O-N 3.31Å; F374-E376 VanDerWaalsContact C-N 3.29Å; F374-E376 PolarHBondContact O-N 3.3Å; E376-I378 VanDerWaalsContact C-N 3.31Å; E376-I378 PolarHBondContact O-N 3.03Å; E376-G379 PolarHBondContact O-N 3.34Å; E376-K381 WeakPolarHBondContact OE1-CE 3.18Å; E376-K381 IonicContact OE1-NZ 2.71Å; E376-K381 PolarHBondContact OE1-NZ 3.29Å
377	T	85.8	Confident	70.8	Confident	120 Å²	120	77.5 Å²	77.5	74%	0.736	42%	0.415	S	S	*	.	H	α-helix	trans	-61.8	-37.7	-179.7	-59.7	0	0	0	0	112.2	N373 F374 G379	N373-T377 WeakPolarHBondContact O-CB 3.41Å; N373-T377 PolarHBondContact O-N 3.32Å; N373-T377 PolarHBondContact O-OG1 2.69Å; F374-T377 WeakPolarHBondContact O-CB 3.49Å; F374-T377 PolarHBondContact O-N 3.43Å; F374-T377 VanDerWaalsContact O-N 3.08Å; T377-G379 VanDerWaalsContact C-N 3.25Å; T377-G379 PolarHBondContact O-N 3Å
378	I	83.3	Confident	68.6	Low	19 Å²	19	81.9 Å²	81.9	10%	0.097	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	2.5	178.9	66.3	172.6	0	0	0	113.1	K353 L356 F374 L375 E376 V380	K353-I378 PolarHBondContact NZ-O 3.35Å; L356-I378 HydrophobicContact CD1-CD1 3.28Å; F374-I378 HydrophobicContact CD1-CD1 4.29Å; F374-I378 HydrophobicContact CD2-CG2 4.46Å; F374-I378 HydrophobicContact CE1-CD1 3.97Å; F374-I378 HydrophobicContact CE1-CG2 4.29Å; F374-I378 HydrophobicContact CE2-CG2 4.05Å; F374-I378 HydrophobicContact CZ-CG2 3.97Å; F374-I378 WeakPolarHBondContact O-CG1 3.41Å; F374-I378 PolarHBondContact O-N 3.28Å; L375-I378 HydrophobicContact CD2-CD1 4.19Å; L375-I378 WeakPolarHBondContact O-CG1 3.38Å; L375-I378 PolarHBondContact O-N 2.88Å; E376-I378 VanDerWaalsContact C-N 3.31Å; E376-I378 PolarHBondContact O-N 3.03Å; I378-V380 HydrophobicContact CD1-CB 4.16Å; I378-V380 HydrophobicContact CD1-CG2 3.67Å; I378-V380 HydrophobicContact CG1-CB 4.04Å; I378-V380 HydrophobicContact CG1-CG2 3.75Å
379	G	77	Confident	66.6	Low	50 Å²	50	88.3 Å²	88.3	52%	0.515	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	25.3	179.3	0	0	0	0	0	114.1	L375 E376 T377 K381	L375-G379 PolarHBondContact O-N 2.86Å; E376-G379 PolarHBondContact O-N 3.34Å; T377-G379 VanDerWaalsContact C-N 3.25Å; T377-G379 PolarHBondContact O-N 3Å; G379-K381 PolarHBondContact O-N 3.28Å
380	V	77.1	Confident	64.7	Low	4 Å²	4	86.6 Å²	86.6	2%	0.024	48%	0.476	C	S	.	.			trans	-95.3	84.8	172.3	177.9	0	0	0	0	107.1	K353 F354 L357 L375 I378	K353-V380 HydrophobicContact CB-CG2 4.15Å; K353-V380 HydrophobicContact CD-CG2 3.71Å; K353-V380 HydrophobicContact CG-CG2 3.65Å; F354-V380 HydrophobicContact CD1-CG1 4.26Å; F354-V380 HydrophobicContact CD1-CG2 4.48Å; L357-V380 HydrophobicContact CD1-CG1 3.96Å; L357-V380 HydrophobicContact CD2-CG1 3.81Å; L357-V380 HydrophobicContact CG-CG1 3.71Å; L375-V380 CarbonylContact C-O 3.4Å; L375-V380 HydrophobicContact CD2-CB 4.17Å; L375-V380 HydrophobicContact CD2-CG1 4.02Å; L375-V380 PolarHBondContact O-N 3.43Å; I378-V380 HydrophobicContact CD1-CB 4.16Å; I378-V380 HydrophobicContact CD1-CG2 3.67Å; I378-V380 HydrophobicContact CG1-CB 4.04Å; I378-V380 HydrophobicContact CG1-CG2 3.75Å
381	K	65.3	Low	62.8	Low	128 Å²	128	85.6 Å²	85.6	56%	0.557	47%	0.47	S	S	*	.			trans	-98.7	146.8	174.8	-72.4	-168.2	172.2	-165.4	0	110.6	E376 G379 G383	E376-K381 WeakPolarHBondContact OE1-CE 3.18Å; E376-K381 IonicContact OE1-NZ 2.71Å; E376-K381 PolarHBondContact OE1-NZ 3.29Å; G379-K381 PolarHBondContact O-N 3.28Å; K381-G383 PolarHBondContact O-N 3.37Å
382	D	57.1	Low	60.7	Low	145 Å²	145	89.7 Å²	89.7	78%	0.775	51%	0.512	S	S	*	.			trans	-68.6	79.7	171.6	-153.3	19.7	0	0	0	108.8
383	G	44.7	Very low	58.4	Low	47 Å²	47	98.6 Å²	98.6	49%	0.485	54%	0.544	S	S	.	.			trans	-81.8	119.6	-173.3	0	0	0	0	0	110.9	K381 G385	K381-G383 PolarHBondContact O-N 3.37Å; G383-G385 PolarHBondContact O-N 2.91Å
384	R	45.7	Very low	55.8	Low	264 Å²	264	98.7 Å²	98.7	100%	0.996	55%	0.55	S	S	*	.	S	Bend	trans	-57.8	77.2	150.4	-71.8	-171.9	-158.6	-92.8	1.1	109.3
385	G	39.9	Very low	53.2	Low	57 Å²	57	107.1 Å²	107.1	59%	0.588	59%	0.586	S	S	*	*	S	Bend	trans	157.5	83.9	-175.6	0	0	0	0	0	112	G383	G383-G385 PolarHBondContact O-N 2.91Å
386	I	41.3	Very low	50.8	Low	164 Å²	164	114.1 Å²	114.1	84%	0.841	61%	0.613	S	S	*	*			trans	72.1	73.2	157.3	-40.2	176.8	0	0	0	114.7
387	I	38	Very low	47.9	Very low	97 Å²	97	115.2 Å²	115.2	50%	0.497	63%	0.627	S	S	.	*			trans	-129.2	129.4	138.6	-45.3	177.9	0	0	0	107	F354 L357 D389	F354-I387 HydrophobicContact CD1-CD1 3.6Å; F354-I387 HydrophobicContact CE1-CD1 4.01Å; F354-I387 HydrophobicContact CG-CD1 4.28Å; L357-I387 HydrophobicContact CD1-CD1 4.27Å; I387-D389 PolarHBondContact O-N 3.2Å
388	T	32.5	Very low	45.1	Very low	113 Å²	113	113.4 Å²	113.4	69%	0.693	62%	0.624	S	S	*	*			trans	-57.4	114.2	-178.7	48.7	0	0	0	0	111.9	S390	T388-S390 PolarHBondContact O-N 3.39Å
389	D	34.6	Very low	42.5	Very low	160 Å²	160	118.3 Å²	118.3	86%	0.856	66%	0.66	S	S	*	*	S	Bend	trans	34.9	37.8	131.1	-160.3	23.5	0	0	0	121.1	I387	I387-D389 PolarHBondContact O-N 3.2Å
390	S	38.9	Very low	40.1	Very low	81 Å²	81	121.3 Å²	121.3	57%	0.566	67%	0.673	S	S	*	*	S	Bend	trans	-138.2	-19.5	170.5	-51.1	0	0	0	0	116.1	T388	T388-S390 PolarHBondContact O-N 3.39Å
391	F	42.3	Very low	37.7	Very low	94 Å²	94	125.9 Å²	125.9	41%	0.412	71%	0.711	S	S	.	*	S	Bend	trans	-120.1	2.8	-175.2	-63.7	-76.3	0	0	0	114.3	Y308 T311 R393	Y308-F391 HydrophobicContact CD2-CE1 4.46Å; T311-F391 HydrophobicContact CG2-CE2 4.06Å; T311-F391 HydrophobicContact CG2-CZ 3.73Å; T311-F391 VanDerWaalsContact OG1-CZ 3.25Å; T311-F391 WeakPolarHBondContact OG1-CZ 3.28Å; F391-R393 VanDerWaalsContact C-N 3.27Å; F391-R393 PolarHBondContact O-N 3.03Å
392	G	40.6	Very low	36	Very low	86 Å²	86	124.9 Å²	124.9	89%	0.887	72%	0.721	S	S	*	*			trans	-79.4	22.2	-166.6	0	0	0	0	0	117
393	R	38.3	Very low	34.5	Very low	230 Å²	230	126 Å²	126	87%	0.868	73%	0.726	S	S	*	*			trans	-131.7	55.7	-175.8	-151.7	-171.8	-65.3	-119	3.3	113.8	F391	F391-R393 VanDerWaalsContact C-N 3.27Å; F391-R393 PolarHBondContact O-N 3.03Å
394	C	30.3	Very low	33.6	Very low	77 Å²	77	128.8 Å²	128.8	52%	0.52	74%	0.739	S	S	.	*			trans	-136.9	91.9	156.1	-90.6	0	0	0	0	109.9	L304 R396	L304-C394 WeakPolarHBondContact CD1-SG 3.32Å; C394-R396 PolarHBondContact O-N 3.27Å; C394-R396 VanDerWaalsContact O-N 3.08Å
395	K	31.7	Very low	32.7	Very low	204 Å²	204	123.1 Å²	123.1	89%	0.887	73%	0.734	S	S	*	*			trans	-69.5	98.4	167.3	-97.8	-179	167.2	177	0	108.5	T397	K395-T397 PolarHBondContact O-N 3.35Å
396	R	36.1	Very low	32.2	Very low	149 Å²	149	126.5 Å²	126.5	56%	0.562	74%	0.743	S	S	*	*			trans	-71.6	111.1	151.9	-168.7	177.7	-67.8	170.9	0.1	106	C394 A398	C394-R396 PolarHBondContact O-N 3.27Å; C394-R396 VanDerWaalsContact O-N 3.08Å; R396-A398 PolarHBondContact O-N 3.43Å
397	T	25.6	Very low	31.6	Very low	130 Å²	130	126.3 Å²	126.3	80%	0.798	74%	0.744	S	S	*	*			trans	-69.1	86.8	173.1	45.7	0	0	0	0	108.7	K395 S399	K395-T397 PolarHBondContact O-N 3.35Å; T397-S399 PolarHBondContact O-N 3.01Å
398	A	26.4	Very low	31	Very low	83 Å²	83	124.6 Å²	124.6	69%	0.686	75%	0.75	S	S	*	*			trans	-72.9	106.8	163.5	0	0	0	0	0	107.7	R396 S400	R396-A398 PolarHBondContact O-N 3.43Å; A398-S400 VanDerWaalsContact C-N 3.35Å; A398-S400 PolarHBondContact O-N 2.91Å
399	S	28.7	Very low	30.8	Very low	122 Å²	122	127.7 Å²	127.7	85%	0.853	76%	0.762	S	S	*	*			trans	-69.1	93.3	165.8	38.4	0	0	0	0	109	T397 A401	T397-S399 PolarHBondContact O-N 3.01Å; S399-A401 PolarHBondContact O-N 3.4Å
400	S	27.6	Very low	30.5	Very low	112 Å²	112	123.6 Å²	123.6	78%	0.783	76%	0.758	S	S	*	*			trans	-76.8	103.1	163.7	-63.1	0	0	0	0	109.1	A398	A398-S400 VanDerWaalsContact C-N 3.35Å; A398-S400 PolarHBondContact O-N 2.91Å
401	A	27	Very low	29.9	Very low	100 Å²	100	124.6 Å²	124.6	83%	0.826	77%	0.771	S	S	*	*			trans	-111.6	96.7	154.6	0	0	0	0	0	107	S399	S399-A401 PolarHBondContact O-N 3.4Å
402	S	28.5	Very low	29.2	Very low	108 Å²	108	125.4 Å²	125.4	76%	0.755	80%	0.795	S	S	*	*			trans	-77.5	128.7	161.9	-56.5	0	0	0	0	107.8
403	D	26.1	Very low	28.5	Very low	167 Å²	167	125.1 Å²	125.1	89%	0.893	79%	0.793	S	S	*	*			trans	-146.4	119.6	143	-97.7	-27.6	0	0	0	109.4
404	S	25.8	Very low	27.9	Very low	106 Å²	106	117.9 Å²	117.9	74%	0.741	79%	0.79	S	S	*	*			trans	-70	134.3	174.9	49	0	0	0	0	111.4
405	T	27.7	Very low	27.9	Very low	146 Å²	146	120.4 Å²	120.4	90%	0.896	81%	0.808	S	S	*	*			trans	-147.1	141.7	135.5	46.9	0	0	0	0	110.8
406	T	28.3	Very low	27.7	Very low	127 Å²	127	114.3 Å²	114.3	78%	0.779	80%	0.804	S	S	*	*			trans	-81	139.2	-175.4	60.4	0	0	0	0	110.9
407	N	28.3	Very low	27.5	Very low	160 Å²	160	114.1 Å²	114.1	86%	0.856	81%	0.814	S	S	*	*				-168.8	127.8	127	-115.8	16.9	0	0	0	111.1
408	G	24.8	Very low	27.8	Very low	62 Å²	62	112 Å²	112	64%	0.639	80%	0.804	S	S	*	*			trans	-79.5	154.9	171.9	0	0	0	0	0	112.4
409	N	29.5	Very low	27.9	Very low	177 Å²	177	115 Å²	115	95%	0.947	81%	0.814	S	S	*	*				175.1	139.3	119.2	-96.3	18.8	0	0	0	110.7
410	G	27.3	Very low	28	Very low	75 Å²	75	113.7 Å²	113.7	77%	0.773	81%	0.811	S	S	*	*			trans	109.4	79.5	136	0	0	0	0	0	119.8
411	A	26.8	Very low	28.1	Very low	101 Å²	101	113.3 Å²	113.3	84%	0.835	81%	0.808	S	S	*	*				53.7	130.8	123.6	0	0	0	0	0	124
412	A	28	Very low	28.3	Very low	111 Å²	111	116.8 Å²	116.8	92%	0.917	81%	0.807	S	S	*	*			trans	68.1	138.1	143.3	0	0	0	0	0	118.4
413	G	25.8	Very low	28.3	Very low	81 Å²	81	119.8 Å²	119.8	84%	0.835	81%	0.809	S	S	*	*			cis	155.3	149.7	7.3	0	0	0	0	0	109
414	G	26.2	Very low	28.5	Very low	78 Å²	78	115.5 Å²	115.5	80%	0.804	80%	0.804	S	S	*	*			trans	99	112.9	168.3	0	0	0	0	0	114.4
415	S	29	Very low	28.8	Very low	129 Å²	129	121.9 Å²	121.9	90%	0.902	81%	0.812	S	S	*	*			cis	88.6	109.2	39.5	-163.3	0	0	0	0	114.9
416	G	29.3	Very low	29.1	Very low	77 Å²	77	122.2 Å²	122.2	79%	0.794	81%	0.808	S	S	*	*			trans	75.7	153.7	146.4	0	0	0	0	0	118.2
417	D	30.1	Very low	29.6	Very low	145 Å²	145	121 Å²	121	78%	0.775	81%	0.811	S	S	*	*			cis	-177.8	157.9	-12.4	179.7	34.5	0	0	0	106.3
418	S	31.7	Very low	30.1	Very low	84 Å²	84	117.1 Å²	117.1	59%	0.587	80%	0.797	S	S	*	*			trans	64.4	127.4	152	-74	0	0	0	0	121.6
419	T	28.8	Very low	31	Very low	148 Å²	148	121.8 Å²	121.8	91%	0.908	80%	0.802	S	S	*	*				-176	129.1	103.9	27.8	0	0	0	0	111.9
420	A	30.7	Very low	31.4	Very low	94 Å²	94	114.8 Å²	114.8	78%	0.777	77%	0.771	S	S	*	*			trans	-107.1	148.9	168.4	0	0	0	0	0	109.9
421	S	30.4	Very low	32	Very low	103 Å²	103	115.6 Å²	115.6	72%	0.72	76%	0.758	S	S	*	*			trans	-177.3	119.1	146.7	7	0	0	0	0	108.1
422	E	31.3	Very low	33	Very low	173 Å²	173	118 Å²	118	81%	0.808	75%	0.752	S	S	*	*				71.4	136.6	104	-75.5	-174.8	151.4	0	0	113.1
423	E	29.3	Very low	33.7	Very low	171 Å²	171	120.8 Å²	120.8	80%	0.799	74%	0.739	S	S	*	*			cis	-169.5	149.6	12.2	-110.7	179.7	160.7	0	0	105.8
424	G	29.4	Very low	34.5	Very low	77 Å²	77	121.9 Å²	121.9	79%	0.794	73%	0.726	S	S	*	*			trans	178.1	81.6	173.1	0	0	0	0	0	112.4	D426	G424-D426 PolarHBondContact O-N 3.21Å
425	R	33.1	Very low	35.7	Very low	241 Å²	241	126.5 Å²	126.5	91%	0.909	72%	0.719	S	S	*	*			trans	-66	110.3	178	-76.8	175.5	172.5	147.1	-0.8	111.4
426	D	33.4	Very low	36.3	Very low	152 Å²	152	125.6 Å²	125.6	81%	0.813	70%	0.701	S	S	*	*			trans	-105.4	134.3	147.9	-77.6	-42.3	0	0	0	107.2	G424 S428	G424-D426 PolarHBondContact O-N 3.21Å; D426-S428 PolarHBondContact O-N 2.94Å
427	A	39.2	Very low	37	Very low	101 Å²	101	125.7 Å²	125.7	84%	0.835	68%	0.683	S	S	*	*			trans	-57.1	111	-176.8	0	0	0	0	0	109.7
428	S	37.9	Very low	37.8	Very low	80 Å²	80	122.3 Å²	122.3	56%	0.559	67%	0.667	S	S	*	*			trans	-90.6	148	-168.1	177.9	0	0	0	0	110.7	D426 G430 D431	D426-S428 PolarHBondContact O-N 2.94Å; S428-G430 PolarHBondContact O-N 3.49Å; S428-G430 PolarHBondContact OG-N 2.99Å; S428-D431 PolarHBondContact O-N 3.23Å
429	E	44.3	Very low	38.4	Very low	160 Å²	160	123.3 Å²	123.3	75%	0.748	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.2	-17.6	167.8	-64.7	173.5	149.8	0	0	113	D431 E432 W433	E429-D431 VanDerWaalsContact C-N 3.28Å; E429-D431 PolarHBondContact O-N 2.97Å; E429-E432 PolarHBondContact O-N 2.9Å; E429-W433 PolarHBondContact O-N 3.38Å
430	G	38.1	Very low	39.2	Very low	29 Å²	29	120.3 Å²	120.3	30%	0.299	64%	0.644	S	S	.	*	H	α-helix	trans	-57.5	-33.1	167.3	0	0	0	0	0	114.2	S428 E432 W433 D434	S428-G430 PolarHBondContact O-N 3.49Å; S428-G430 PolarHBondContact OG-N 2.99Å; G430-E432 VanDerWaalsContact C-N 3.31Å; G430-E432 PolarHBondContact O-N 3.45Å; G430-W433 PolarHBondContact O-N 3.03Å; G430-D434 VanDerWaalsContact O-CB 3.23Å; G430-D434 WeakPolarHBondContact O-CB 3.34Å; G430-D434 VanDerWaalsContact O-CG 3.29Å; G430-D434 PolarHBondContact O-N 2.88Å
431	D	40	Very low	39.9	Very low	92 Å²	92	118.7 Å²	118.7	49%	0.492	63%	0.627	S	S	.	*	H	α-helix	trans	-72.8	-21.8	178.9	-75.9	-21.3	0	0	0	112.8	S428 E429 R435	S428-D431 PolarHBondContact O-N 3.23Å; E429-D431 VanDerWaalsContact C-N 3.28Å; E429-D431 PolarHBondContact O-N 2.97Å; D431-R435 WeakPolarHBondContact O-CD 3.43Å; D431-R435 WeakPolarHBondContact O-CG 3.45Å; D431-R435 PolarHBondContact O-N 3.41Å; D431-R435 PolarHBondContact O-NE 2.86Å
432	E	45.8	Very low	40.5	Very low	153 Å²	153	117.7 Å²	117.7	72%	0.715	61%	0.613	S	S	*	*	H	α-helix	trans	-84.8	-38	172.9	-78.1	-169.2	150	0	0	111.6	E429 G430 R435 M436	E429-E432 PolarHBondContact O-N 2.9Å; G430-E432 VanDerWaalsContact C-N 3.31Å; G430-E432 PolarHBondContact O-N 3.45Å; E432-R435 PolarHBondContact O-N 2.7Å; E432-M436 PolarHBondContact O-N 3.4Å
433	W	44.5	Very low	41.3	Very low	169 Å²	169	114.6 Å²	114.6	64%	0.64	60%	0.602	S	S	*	*	H	α-helix	trans	-68.1	-42.1	173	-99.7	97.8	0	0	0	112.9	E429 G430 R435 M436 I437	E429-W433 PolarHBondContact O-N 3.38Å; G430-W433 PolarHBondContact O-N 3.03Å; W433-R435 VanDerWaalsContact C-N 3.27Å; W433-R435 PolarHBondContact O-N 2.83Å; W433-M436 PolarHBondContact O-N 2.92Å; W433-M436 VanDerWaalsContact O-N 3.1Å; W433-I437 HydrophobicContact CE3-CD1 4.37Å; W433-I437 HydrophobicContact CE3-CG1 4.13Å; W433-I437 HydrophobicContact CZ3-CD1 4.27Å; W433-I437 WeakPolarHBondContact O-CG1 3.43Å; W433-I437 PolarHBondContact O-N 3.48Å
434	D	42.7	Very low	42.1	Very low	104 Å²	104	111.8 Å²	111.8	56%	0.556	59%	0.592	S	S	*	*	H	α-helix	trans	-64.7	-33.9	176	-79.7	-22.2	0	0	0	111.2	G430 T438	G430-D434 VanDerWaalsContact O-CB 3.23Å; G430-D434 WeakPolarHBondContact O-CB 3.34Å; G430-D434 VanDerWaalsContact O-CG 3.29Å; G430-D434 PolarHBondContact O-N 2.88Å; D434-T438 VanDerWaalsContact O-CB 3.24Å; D434-T438 WeakPolarHBondContact O-CB 3.31Å; D434-T438 PolarHBondContact O-N 3.42Å; D434-T438 PolarHBondContact O-OG1 3.37Å
435	R	50.2	Low	43	Very low	175 Å²	175	114.6 Å²	114.6	66%	0.66	58%	0.584	S	S	*	*	H	α-helix	trans	-66.7	-42.1	170.4	-77.2	177.3	-159.7	-168.5	8.2	112	D431 E432 W433 T438 D439	D431-R435 WeakPolarHBondContact O-CD 3.43Å; D431-R435 WeakPolarHBondContact O-CG 3.45Å; D431-R435 PolarHBondContact O-N 3.41Å; D431-R435 PolarHBondContact O-NE 2.86Å; E432-R435 PolarHBondContact O-N 2.7Å; W433-R435 VanDerWaalsContact C-N 3.27Å; W433-R435 PolarHBondContact O-N 2.83Å; R435-T438 PolarHBondContact O-N 3.49Å; R435-D439 PolarHBondContact O-N 3.29Å
436	M	41.3	Very low	43.5	Very low	109 Å²	109	106 Å²	106	54%	0.537	56%	0.564	S	S	.	*	H	α-helix	trans	-66	-39.9	178.4	-171.5	177	-78.2	0	0	112	E432 W433 D439 I440	E432-M436 PolarHBondContact O-N 3.4Å; W433-M436 PolarHBondContact O-N 2.92Å; W433-M436 VanDerWaalsContact O-N 3.1Å; M436-D439 PolarHBondContact O-N 3.16Å; M436-I440 HydrophobicContact CG-CD1 4.15Å; M436-I440 WeakPolarHBondContact O-CD1 3.35Å; M436-I440 WeakPolarHBondContact O-CG1 3.39Å; M436-I440 PolarHBondContact O-N 3.22Å
437	I	44.9	Very low	44.2	Very low	79 Å²	79	104.7 Å²	104.7	41%	0.405	56%	0.557	S	S	.	*	H	α-helix	trans	-71.5	-34	176.2	-67.5	-65.2	0	0	0	112.1	W433 I440 S441	W433-I437 HydrophobicContact CE3-CD1 4.37Å; W433-I437 HydrophobicContact CE3-CG1 4.13Å; W433-I437 HydrophobicContact CZ3-CD1 4.27Å; W433-I437 WeakPolarHBondContact O-CG1 3.43Å; W433-I437 PolarHBondContact O-N 3.48Å; I437-I440 PolarHBondContact O-N 3.29Å; I437-S441 WeakPolarHBondContact O-CB 3.36Å; I437-S441 PolarHBondContact O-N 2.73Å; I437-S441 PolarHBondContact O-OG 3.07Å
438	T	47.7	Very low	44.5	Very low	74 Å²	74	101.7 Å²	101.7	45%	0.454	54%	0.536	S	S	.	.	H	α-helix	trans	-67.9	-40.5	173.8	-58.6	0	0	0	0	111.3	D434 R435 S441 N442	D434-T438 VanDerWaalsContact O-CB 3.24Å; D434-T438 WeakPolarHBondContact O-CB 3.31Å; D434-T438 PolarHBondContact O-N 3.42Å; D434-T438 PolarHBondContact O-OG1 3.37Å; R435-T438 PolarHBondContact O-N 3.49Å; T438-S441 PolarHBondContact O-N 3.48Å; T438-N442 WeakPolarHBondContact O-CB 3.4Å; T438-N442 PolarHBondContact O-N 3.41Å; T438-N442 PolarHBondContact O-ND2 3.26Å; T438-N442 VanDerWaalsContact O-ND2 3.08Å
439	D	43.8	Very low	44.7	Very low	106 Å²	106	102 Å²	102	57%	0.567	54%	0.537	S	S	*	.	H	α-helix	trans	-64.5	-41	174.3	-84.4	-5.8	0	0	0	111.8	R435 M436 N442 D443	R435-D439 PolarHBondContact O-N 3.29Å; M436-D439 PolarHBondContact O-N 3.16Å; D439-N442 PolarHBondContact O-N 2.95Å; D439-D443 PolarHBondContact O-N 2.72Å
440	I	46.1	Very low	44.4	Very low	85 Å²	85	98.9 Å²	98.9	44%	0.436	53%	0.533	S	S	.	.	H	α-helix	trans	-66.2	-39.7	176	-67.3	163.4	0	0	0	111.6	M436 I437 D443 I444	M436-I440 HydrophobicContact CG-CD1 4.15Å; M436-I440 WeakPolarHBondContact O-CD1 3.35Å; M436-I440 WeakPolarHBondContact O-CG1 3.39Å; M436-I440 PolarHBondContact O-N 3.22Å; I437-I440 PolarHBondContact O-N 3.29Å; I440-D443 PolarHBondContact O-N 3.29Å; I440-I444 HydrophobicContact CG2-CD1 4.07Å; I440-I444 WeakPolarHBondContact O-CD1 3.21Å; I440-I444 VanDerWaalsContact O-CG1 3.25Å; I440-I444 WeakPolarHBondContact O-CG1 3.23Å; I440-I444 PolarHBondContact O-N 3.06Å; I440-I444 VanDerWaalsContact O-N 3.14Å
441	S	44.6	Very low	44.9	Very low	59 Å²	59	105 Å²	105	41%	0.413	56%	0.555	S	S	.	*	H	α-helix	trans	-67.8	-39.6	176.4	-64.8	0	0	0	0	112.3	I437 T438 D443 I444 E445	I437-S441 WeakPolarHBondContact O-CB 3.36Å; I437-S441 PolarHBondContact O-N 2.73Å; I437-S441 PolarHBondContact O-OG 3.07Å; T438-S441 PolarHBondContact O-N 3.48Å; S441-D443 VanDerWaalsContact C-N 3.35Å; S441-I444 PolarHBondContact O-N 2.73Å; S441-E445 PolarHBondContact O-N 3.38Å
442	N	42.7	Very low	45.3	Very low	82 Å²	82	106.9 Å²	106.9	44%	0.439	57%	0.565	S	S	.	*	H	α-helix	trans	-66	-35.7	176.1	-72.3	-30.8	0	0	0	112.2	T438 D439 E445 A446	T438-N442 WeakPolarHBondContact O-CB 3.4Å; T438-N442 PolarHBondContact O-N 3.41Å; T438-N442 PolarHBondContact O-ND2 3.26Å; T438-N442 VanDerWaalsContact O-ND2 3.08Å; D439-N442 PolarHBondContact O-N 2.95Å; N442-E445 PolarHBondContact O-N 3.45Å; N442-A446 WeakPolarHBondContact O-CB 3.18Å; N442-A446 PolarHBondContact O-N 3.03Å
443	D	47.7	Very low	45.1	Very low	109 Å²	109	108.1 Å²	108.1	58%	0.583	57%	0.571	S	S	*	*	H	α-helix	trans	-68.2	-35.2	174.4	-81.3	-13.6	0	0	0	112.1	D439 I440 S441 A446 L447	D439-D443 PolarHBondContact O-N 2.72Å; I440-D443 PolarHBondContact O-N 3.29Å; S441-D443 VanDerWaalsContact C-N 3.35Å; D443-A446 PolarHBondContact O-N 2.75Å; D443-L447 VanDerWaalsContact O-CG 3.26Å; D443-L447 WeakPolarHBondContact O-CG 3.43Å; D443-L447 PolarHBondContact O-N 2.98Å
444	I	45.8	Very low	45.1	Very low	112 Å²	112	109.3 Å²	109.3	57%	0.574	58%	0.584	S	S	*	*	H	α-helix	trans	-66.8	-41.9	173.3	-68.4	164.8	0	0	0	111	I440 S441 L447 G448	I440-I444 HydrophobicContact CG2-CD1 4.07Å; I440-I444 WeakPolarHBondContact O-CD1 3.21Å; I440-I444 VanDerWaalsContact O-CG1 3.25Å; I440-I444 WeakPolarHBondContact O-CG1 3.23Å; I440-I444 PolarHBondContact O-N 3.06Å; I440-I444 VanDerWaalsContact O-N 3.14Å; S441-I444 PolarHBondContact O-N 2.73Å; I444-L447 PolarHBondContact O-N 3.36Å; I444-G448 PolarHBondContact O-N 2.82Å; I444-G448 VanDerWaalsContact O-N 3.1Å
445	E	48.7	Very low	45.2	Very low	136 Å²	136	108.2 Å²	108.2	64%	0.636	59%	0.589	S	S	*	*	H	α-helix	trans	-67.8	-35.6	174.9	-73.9	-170.5	170.6	0	0	112.6	S441 N442 L447 G448 C449	S441-E445 PolarHBondContact O-N 3.38Å; N442-E445 PolarHBondContact O-N 3.45Å; E445-L447 VanDerWaalsContact C-N 3.33Å; E445-L447 PolarHBondContact O-N 3.5Å; E445-G448 PolarHBondContact O-N 2.86Å; E445-C449 PolarHBondContact O-N 3.07Å; E445-C449 PolarHBondContact O-SG 2.8Å
446	A	44.4	Very low	45.5	Very low	59 Å²	59	106 Å²	106	49%	0.488	60%	0.595	S	S	.	*	H	α-helix	trans	-66.4	-34.1	175	0	0	0	0	0	112.5	N442 D443 C449 S450	N442-A446 WeakPolarHBondContact O-CB 3.18Å; N442-A446 PolarHBondContact O-N 3.03Å; D443-A446 PolarHBondContact O-N 2.75Å; A446-C449 PolarHBondContact O-N 3.08Å; A446-S450 PolarHBondContact O-N 3.43Å
447	L	48.8	Very low	45.2	Very low	126 Å²	126	107.2 Å²	107.2	66%	0.66	61%	0.609	S	S	*	*	H	α-helix	trans	-71.3	-31.8	172.3	-71.2	167.3	0	0	0	112.4	D443 I444 E445	D443-L447 VanDerWaalsContact O-CG 3.26Å; D443-L447 WeakPolarHBondContact O-CG 3.43Å; D443-L447 PolarHBondContact O-N 2.98Å; I444-L447 PolarHBondContact O-N 3.36Å; E445-L447 VanDerWaalsContact C-N 3.33Å; E445-L447 PolarHBondContact O-N 3.5Å
448	G	44.8	Very low	45.4	Very low	38 Å²	38	112.9 Å²	112.9	39%	0.392	65%	0.65	S	S	.	*	H	α-helix	trans	-67.7	-40	170.4	0	0	0	0	0	113.1	I444 E445 S450 M451	I444-G448 PolarHBondContact O-N 2.82Å; I444-G448 VanDerWaalsContact O-N 3.1Å; E445-G448 PolarHBondContact O-N 2.86Å; G448-S450 VanDerWaalsContact C-N 3.29Å; G448-S450 PolarHBondContact O-N 2.71Å; G448-M451 PolarHBondContact O-N 3.49Å
449	C	41	Very low	45.3	Very low	86 Å²	86	114.8 Å²	114.8	58%	0.581	66%	0.66	S	S	*	*	H	α-helix	trans	-71.1	-20.8	179.4	-67.3	0	0	0	0	113.8	E445 A446 M451	E445-C449 PolarHBondContact O-N 3.07Å; E445-C449 PolarHBondContact O-SG 2.8Å; A446-C449 PolarHBondContact O-N 3.08Å; C449-M451 VanDerWaalsContact C-N 3.27Å; C449-M451 PolarHBondContact O-N 3.28Å
450	S	39.3	Very low	45.3	Very low	94 Å²	94	115.3 Å²	115.3	66%	0.657	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-15.9	175.2	-175.5	0	0	0	0	113.4	A446 G448	A446-S450 PolarHBondContact O-N 3.43Å; G448-S450 VanDerWaalsContact C-N 3.29Å; G448-S450 PolarHBondContact O-N 2.71Å
451	M	48.6	Very low	45.3	Very low	157 Å²	157	116.9 Å²	116.9	77%	0.773	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-15.5	179.9	-75.3	-178.3	57.8	0	0	113.8	G448 C449	G448-M451 PolarHBondContact O-N 3.49Å; C449-M451 VanDerWaalsContact C-N 3.27Å; C449-M451 PolarHBondContact O-N 3.28Å
452	D	47	Very low	45.3	Very low	132 Å²	132	120.4 Å²	120.4	71%	0.706	69%	0.694	S	S	*	*	S	Bend	trans	-93.8	-3.3	-178	-74.8	-29.7	0	0	0	114.3
453	Q	42.8	Very low	45.5	Very low	179 Å²	179	122.8 Å²	122.8	84%	0.836	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-3.2	-178.1	-136.7	165.1	87.3	0	0	114.7
454	E	43.6	Very low	45.3	Very low	194 Å²	194	123.7 Å²	123.7	91%	0.907	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	7.7	177.6	-135	176	176.8	0	0	113.8
455	A	46.3	Very low	45.3	Very low	81 Å²	81	124.5 Å²	124.5	67%	0.669	73%	0.728	S	S	*	*	S	Bend	trans	-117.7	25.5	-176.6	0	0	0	0	0	114.6
456	V	56.2	Low	45	Very low	128 Å²	128	123.6 Å²	123.6	78%	0.776	74%	0.735	S	S	*	*			trans	-147.4	104.8	161	-173.6	0	0	0	0	110.4
457	T	34.5	Very low	45.1	Very low	135 Å²	135	129 Å²	129	83%	0.828	76%	0.756	S	S	*	*			trans	-151.7	144.6	137.6	14.3	0	0	0	0	109
458	P	48.3	Very low	44.8	Very low	198 Å²	198	129.3 Å²	129.3	100%	1.286	77%	0.765	S	S	*	*			trans	-77.1	0	-152.6	31.2	-37.2	0	0	0	116.3

Retrieved 458 of 458 residues in 78.8 ms (Link to these results)

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