A0A3Q0KN02_SCHMA Loading...

Leucine-rich repeat-containing protein 56

AlphaFold DB , UniProt , Accession A0A3Q0KN02, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 697 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	41.2	Very low	41.8	Very low	230 Å²	230	150 Å²	150	100%	1.133	81%	0.812	S	S	*	*				0	105.1	0	-71.5	-68.7	-134	0	0	108.6
2	T	37.8	Very low	42.2	Very low	110 Å²	110	147.7 Å²	147.7	68%	0.675	81%	0.81	S	S	*	*			cis	-167.9	109.8	-25.1	-7.4	0	0	0	0	102
3	E	36.1	Very low	42.8	Very low	161 Å²	161	149.8 Å²	149.8	75%	0.752	81%	0.807	S	S	*	*				45.8	110.7	89	-175.1	175.3	-130.7	0	0	113
4	L	41.4	Very low	43.6	Very low	167 Å²	167	146.7 Å²	146.7	87%	0.874	80%	0.802	S	S	*	*			trans	-164.5	162.7	138.1	-104.9	167.3	0	0	0	109.5
5	Q	41.2	Very low	44	Very low	160 Å²	160	143.3 Å²	143.3	75%	0.748	80%	0.801	S	S	*	*			trans	-120.6	-170.4	-152.6	-58.2	153.1	-62.6	0	0	113.6
6	A	42.4	Very low	44.3	Very low	95 Å²	95	143 Å²	143	79%	0.785	80%	0.796	S	S	*	*			trans	83.6	137.2	164.8	0	0	0	0	0	116.9
7	S	38.5	Very low	44.7	Very low	122 Å²	122	142.1 Å²	142.1	85%	0.853	80%	0.795	S	S	*	*			cis	-158.1	138.8	-12.3	48.1	0	0	0	0	110.2
8	S	42.8	Very low	45.4	Very low	109 Å²	109	143.9 Å²	143.9	76%	0.762	80%	0.796	S	S	*	*			trans	-117.8	148.4	-177.1	53.4	0	0	0	0	112.9	I10	S8-I10 PolarHBondContact O-N 3.46Å
9	D	42.2	Very low	46.2	Very low	164 Å²	164	144.3 Å²	144.3	88%	0.877	80%	0.795	S	S	*	*			trans	-61.8	127.9	-173.6	-67.1	-76.2	0	0	0	114.6	R11	D9-R11 PolarHBondContact O-N 3.15Å; D9-R11 VanDerWaalsContact O-N 3.15Å
10	I	48.4	Very low	47	Very low	159 Å²	159	142.9 Å²	142.9	82%	0.815	79%	0.791	S	S	*	*			trans	-84.2	89.1	171.2	-56.6	178.7	0	0	0	109	S8	S8-I10 PolarHBondContact O-N 3.46Å
11	R	47.4	Very low	47.4	Very low	173 Å²	173	144.5 Å²	144.5	65%	0.653	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-60.7	130.1	162.6	-155	179.5	-161.8	-170.8	6.9	107.6	D9 K13	D9-R11 PolarHBondContact O-N 3.15Å; D9-R11 VanDerWaalsContact O-N 3.15Å; R11-K13 PolarHBondContact O-N 3.49Å; R11-K13 VanDerWaalsContact O-N 3.09Å
12	P	47	Very low	48.3	Very low	122 Å²	122	140.9 Å²	140.9	79%	0.792	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-60.5	119.6	-178	23.8	-33.5	0	0	0	109.4	S14	P12-S14 PolarHBondContact O-N 3.09Å
13	K	49.7	Very low	49	Very low	176 Å²	176	144.5 Å²	144.5	77%	0.765	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-63.2	137.1	-178.2	-70.3	-176.7	178	179.4	0	109.6	R11 L16	R11-K13 PolarHBondContact O-N 3.49Å; R11-K13 VanDerWaalsContact O-N 3.09Å; K13-L16 HydrophobicContact CD-CD1 4.35Å
14	S	54.1	Low	49.8	Very low	106 Å²	106	145.8 Å²	145.8	74%	0.741	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-48.4	145.3	164.1	45.1	0	0	0	0	110.4	P12 L16	P12-S14 PolarHBondContact O-N 3.09Å; S14-L16 PolarHBondContact O-N 3.38Å
15	A	50.1	Low	50.2	Low	96 Å²	96	147.3 Å²	147.3	79%	0.793	79%	0.791	S	S	*	*			trans	-47.9	111.7	-175.4	0	0	0	0	0	111.5	V17	A15-V17 PolarHBondContact O-N 3.19Å
16	L	49.2	Very low	50.8	Low	138 Å²	138	146 Å²	146	72%	0.723	79%	0.794	S	S	*	*			trans	-74.6	96.5	175.5	-85	162.2	0	0	0	107.9	K13 S14 Q18	K13-L16 HydrophobicContact CD-CD1 4.35Å; S14-L16 PolarHBondContact O-N 3.38Å; L16-Q18 PolarHBondContact O-N 2.98Å
17	V	51.2	Low	51.7	Low	127 Å²	127	147.6 Å²	147.6	77%	0.77	79%	0.794	S	S	*	*			trans	-64.1	99.5	166.4	179.7	0	0	0	0	107.2	A15 I19	A15-V17 PolarHBondContact O-N 3.19Å; V17-I19 HydrophobicContact CG1-CG1 4.39Å; V17-I19 PolarHBondContact O-N 3.28Å; V17-I19 VanDerWaalsContact O-N 3.1Å
18	Q	55.7	Low	52.5	Low	175 Å²	175	148.7 Å²	148.7	82%	0.818	79%	0.79	S	S	*	*			trans	-71.9	102.1	168.9	-71.3	-171.5	-72.6	0	0	108.2	L16 T20	L16-Q18 PolarHBondContact O-N 2.98Å; Q18-T20 PolarHBondContact O-N 3.24Å
19	I	61.3	Low	53.7	Low	151 Å²	151	148.4 Å²	148.4	77%	0.774	79%	0.786	S	S	*	*			trans	-70.5	99	165.4	-57.4	175.1	0	0	0	106.3	V17 E21	V17-I19 HydrophobicContact CG1-CG1 4.39Å; V17-I19 PolarHBondContact O-N 3.28Å; V17-I19 VanDerWaalsContact O-N 3.1Å; I19-E21 PolarHBondContact O-N 3.03Å
20	T	62.4	Low	54.9	Low	116 Å²	116	146.6 Å²	146.6	71%	0.712	78%	0.781	S	S	*	*			trans	-70.8	111.8	168	46.9	0	0	0	0	108.6	Q18 I22	Q18-T20 PolarHBondContact O-N 3.24Å; T20-I22 PolarHBondContact O-N 3.17Å
21	E	55.3	Low	55.1	Low	178 Å²	178	144.4 Å²	144.4	83%	0.832	78%	0.777	S	S	*	*			trans	-57.7	127.2	167.9	-69.3	-178.3	128.7	0	0	109.6	I19 Q23	I19-E21 PolarHBondContact O-N 3.03Å; E21-Q23 PolarHBondContact O-N 3.05Å; E21-Q23 VanDerWaalsContact O-N 3.14Å
22	I	60.7	Low	55.7	Low	153 Å²	153	144.2 Å²	144.2	79%	0.785	79%	0.788	S	S	*	*			trans	-75	104.9	176.8	-60.1	174.7	0	0	0	107	T20 E24	T20-I22 PolarHBondContact O-N 3.17Å; I22-E24 PolarHBondContact O-N 2.97Å
23	Q	51	Low	56	Low	187 Å²	187	150 Å²	150	87%	0.874	79%	0.794	S	S	*	*			trans	-60.2	126.3	-177.4	-67.6	-173.6	-4.5	0	0	111.1	E21	E21-Q23 PolarHBondContact O-N 3.05Å; E21-Q23 VanDerWaalsContact O-N 3.14Å
24	E	53.3	Low	55.9	Low	188 Å²	188	149.1 Å²	149.1	88%	0.879	79%	0.79	S	S	*	*	S	Bend	trans	-74.4	134	-162	-58.4	-176.4	123.2	0	0	113.8	I22	I22-E24 PolarHBondContact O-N 2.97Å
25	K	50.4	Low	55.2	Low	199 Å²	199	154 Å²	154	87%	0.865	79%	0.792	S	S	*	*			trans	-159.4	-12.8	147.9	-119.3	166.3	-171.6	173.2	0	115.5	V27	K25-V27 PolarHBondContact O-N 3.42Å
26	T	53.8	Low	55.1	Low	131 Å²	131	156.1 Å²	156.1	80%	0.804	80%	0.798	S	S	*	*	S	Bend	trans	-76.5	102.4	162.3	48.4	0	0	0	0	109.2	N28	T26-N28 PolarHBondContact O-N 3.18Å; T26-N28 VanDerWaalsContact O-N 3.08Å
27	V	60.9	Low	54.6	Low	130 Å²	130	154 Å²	154	79%	0.788	80%	0.795	S	S	*	*			trans	-56	115.4	173.6	177.4	0	0	0	0	108.8	K25 P29	K25-V27 PolarHBondContact O-N 3.42Å; V27-P29 WeakPolarHBondContact O-CD 3.23Å; V27-P29 VanDerWaalsContact O-N 3.17Å
28	N	56.6	Low	54.1	Low	144 Å²	144	155.1 Å²	155.1	77%	0.77	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-59.8	117.1	174.8	-171.5	9.2	0	0	0	108.1	T26 T30	T26-N28 PolarHBondContact O-N 3.18Å; T26-N28 VanDerWaalsContact O-N 3.08Å; N28-T30 PolarHBondContact O-N 3.4Å; N28-T30 VanDerWaalsContact O-N 3.1Å
29	P	67.6	Low	53.4	Low	104 Å²	104	152.3 Å²	152.3	68%	0.675	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-61.5	119.3	-170.4	22.8	-33.9	0	0	0	110.3	V27	V27-P29 WeakPolarHBondContact O-CD 3.23Å; V27-P29 VanDerWaalsContact O-N 3.17Å
30	T	66.6	Low	52.9	Low	125 Å²	125	149.4 Å²	149.4	77%	0.767	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-53.4	124.4	-178.9	-16.8	0	0	0	0	109.1	N28 L32	N28-T30 PolarHBondContact O-N 3.4Å; N28-T30 VanDerWaalsContact O-N 3.1Å; T30-L32 PolarHBondContact O-N 2.82Å
31	P	53.5	Low	52.4	Low	113 Å²	113	146.6 Å²	146.6	73%	0.734	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-57.7	127.7	-175.3	21.3	-32.7	0	0	0	109.5	R33	P31-R33 PolarHBondContact O-N 3.29Å
32	L	59.6	Low	52.4	Low	170 Å²	170	144.1 Å²	144.1	89%	0.89	76%	0.755	S	S	*	*			trans	-58.9	103	-179.4	-79	168.7	0	0	0	109.1	T30 K34	T30-L32 PolarHBondContact O-N 2.82Å; L32-K34 VanDerWaalsContact C-N 3.27Å; L32-K34 PolarHBondContact O-N 2.8Å
33	R	52.7	Low	52.9	Low	244 Å²	244	142 Å²	142	92%	0.921	74%	0.742	S	S	*	*			trans	-61.9	90.5	169	-78.8	-177.5	166.8	175.3	-4.4	108.4	P31 R35	P31-R33 PolarHBondContact O-N 3.29Å; R33-R35 PolarHBondContact O-N 2.7Å
34	K	48.3	Very low	54.1	Low	157 Å²	157	137.6 Å²	137.6	68%	0.683	72%	0.72	S	S	*	*			trans	-47.5	131.8	160.4	-78.6	-166.6	175.1	-167.5	0	106.9	L32	L32-K34 VanDerWaalsContact C-N 3.27Å; L32-K34 PolarHBondContact O-N 2.8Å
35	R	39.8	Very low	55.4	Low	207 Å²	207	129 Å²	129	78%	0.781	68%	0.68	S	S	*	*			trans	-66.3	145	175	-76	-175.9	-75.5	-169.4	-3.8	108.6	R33 S37	R33-R35 PolarHBondContact O-N 2.7Å; R35-S37 PolarHBondContact O-N 3.1Å
36	P	46.6	Very low	57	Low	142 Å²	142	121.7 Å²	121.7	92%	0.922	65%	0.652	S	S	*	*	S	Bend	trans	-71.1	40.7	178.2	-18.8	33.8	0	0	0	114.3
37	S	39.3	Very low	58.5	Low	93 Å²	93	118.7 Å²	118.7	65%	0.65	63%	0.629	S	S	*	*			trans	-119.2	14.6	-167.9	61.5	0	0	0	0	113.8	R35	R35-S37 PolarHBondContact O-N 3.1Å
38	E	41.2	Very low	59.6	Low	150 Å²	150	120 Å²	120	70%	0.701	63%	0.627	S	S	*	*	S	Bend	trans	-126.4	118.8	166.6	-70.3	169.7	169.5	0	0	105.4	P40	E38-P40 WeakPolarHBondContact O-CD 3.27Å
39	T	40.2	Very low	60.9	Low	117 Å²	117	117.3 Å²	117.3	72%	0.718	61%	0.606	S	S	*	*			trans	-74.5	118.5	175.3	41.7	0	0	0	0	108.6	S41	T39-S41 PolarHBondContact O-N 3.04Å; T39-S41 PolarHBondContact O-OG 2.69Å
40	P	51.4	Low	61.8	Low	89 Å²	89	112.3 Å²	112.3	58%	0.578	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	29.8	-176.4	35	-37.4	0	0	0	112.6	E38 D42	E38-P40 WeakPolarHBondContact O-CD 3.27Å; P40-D42 VanDerWaalsContact C-N 3.27Å; P40-D42 PolarHBondContact O-N 2.69Å
41	S	51	Low	62.8	Low	57 Å²	57	111.7 Å²	111.7	40%	0.399	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.8	-23.5	-177.5	44.1	0	0	0	0	113.6	T39 T46	T39-S41 PolarHBondContact O-N 3.04Å; T39-S41 PolarHBondContact O-OG 2.69Å; S41-T46 WeakPolarHBondContact O-CG2 3.38Å
42	D	56.7	Low	64.3	Low	127 Å²	127	112.2 Å²	112.2	68%	0.679	55%	0.55	S	S	*	.	S	Bend	trans	-105.9	-13.3	-166.3	-65.9	40.4	0	0	0	112.8	P40 F44	P40-D42 VanDerWaalsContact C-N 3.27Å; P40-D42 PolarHBondContact O-N 2.69Å; D42-F44 VanDerWaalsContact C-N 3.34Å
43	E	70.2	Confident	65.4	Low	109 Å²	109	104.5 Å²	104.5	51%	0.509	51%	0.509	S	S	.	.	S	Bend	trans	-79.4	-14.3	179.8	-68.3	-173.2	157	0	0	113	S75	E43-S75 PolarHBondContact O-N 3.32Å
44	F	75.5	Confident	66.9	Low	93 Å²	93	93.4 Å²	93.4	41%	0.408	47%	0.469	S	S	.	.	B	Isolated β-bridge	trans	-130.3	150	-175.1	-62.9	-88.5	0	0	0	111.8	D42 T46	D42-F44 VanDerWaalsContact C-N 3.34Å; F44-T46 PolarHBondContact O-N 2.99Å
45	L	81.6	Confident	68.5	Low	7 Å²	7	89 Å²	89	4%	0.037	47%	0.468	C	S	.	.			trans	-73.7	94.9	172.5	-173	51.6	0	0	0	110.8	R49 L50 L53 L67 I74 S75 V76 F79 F652	L45-R49 HydrophobicContact CD1-CB 4.16Å; L45-R49 HydrophobicContact CD1-CG 3.84Å; L45-L50 HydrophobicContact CD1-CD2 4.3Å; L45-L50 HydrophobicContact CD1-CG 4.39Å; L45-L50 HydrophobicContact CD2-CD2 3.77Å; L45-L50 HydrophobicContact CD2-CG 4.44Å; L45-L50 HydrophobicContact CG-CD2 3.91Å; L45-L50 HydrophobicContact CG-CG 4.03Å; L45-L53 HydrophobicContact CD1-CD1 3.9Å; L45-L67 HydrophobicContact CD2-CD1 4.19Å; L45-I74 HydrophobicContact CB-CG2 4.36Å; L45-S75 PolarHBondContact N-O 3.29Å; L45-S75 VanDerWaalsContact N-O 3.11Å; L45-V76 HydrophobicContact CB-CG1 4.35Å; L45-V76 HydrophobicContact CD2-CG1 4.11Å; L45-F79 HydrophobicContact CD2-CB 4.04Å; L45-F79 HydrophobicContact CD2-CD1 4.36Å; L45-F79 HydrophobicContact CD2-CG 4.47Å; L45-F79 HydrophobicContact CG-CB 4.47Å; L45-F652 HydrophobicContact CD1-CE2 4.47Å; L45-F652 HydrophobicContact CD1-CZ 3.88Å
46	T	84	Confident	70.6	Confident	46 Å²	46	81.9 Å²	81.9	28%	0.282	44%	0.443	S	S	.	.			trans	-72.2	157.7	-176.9	64.2	0	0	0	0	113.3	S41 F44 E48 R49 L50	S41-T46 WeakPolarHBondContact O-CG2 3.38Å; F44-T46 PolarHBondContact O-N 2.99Å; T46-E48 PolarHBondContact O-N 3.1Å; T46-R49 WeakPolarHBondContact O-CB 3.44Å; T46-R49 PolarHBondContact O-N 3.39Å; T46-R49 VanDerWaalsContact O-N 3.16Å; T46-R49 WeakPolarHBondContact OG1-CB 3.28Å; T46-R49 PolarHBondContact OG1-N 3.35Å; T46-L50 PolarHBondContact O-N 3.2Å
47	E	85.7	Confident	72.3	Confident	69 Å²	69	79.7 Å²	79.7	32%	0.322	43%	0.431	S	S	.	.	H	α-helix	trans	-61.6	-42.4	177.9	-161.5	-165.4	150.9	0	0	112.5	R49 L50 R51 L59 Y82	E47-R49 VanDerWaalsContact C-N 3.26Å; E47-R49 PolarHBondContact O-N 3.46Å; E47-L50 WeakPolarHBondContact O-CB 3.46Å; E47-L50 PolarHBondContact O-N 3.16Å; E47-L50 VanDerWaalsContact O-N 3.13Å; E47-R51 WeakPolarHBondContact O-CG 3.45Å; E47-R51 PolarHBondContact O-N 3.39Å; E47-R51 IonicContact OE1-CZ 2.84Å; E47-R51 IonicContact OE1-NE 2.7Å; E47-R51 PolarHBondContact OE1-NE 3.29Å; E47-R51 IonicContact OE1-NH2 2.69Å; E47-R51 PolarHBondContact OE1-NH2 3.17Å; E47-L59 HydrophobicContact CG-CD1 3.53Å; E47-Y82 HydrophobicContact CB-CD1 3.82Å; E47-Y82 HydrophobicContact CB-CE1 3.81Å; E47-Y82 HydrophobicContact CB-CG 4.22Å; E47-Y82 HydrophobicContact CG-CD1 3.61Å; E47-Y82 HydrophobicContact CG-CE1 4.1Å; E47-Y82 HydrophobicContact CG-CG 3.98Å
48	E	84.1	Confident	74.6	Confident	157 Å²	157	78.9 Å²	78.9	73%	0.734	42%	0.419	S	S	*	.	H	α-helix	trans	-56.6	-43.4	174.1	-62.7	-175.1	157.5	0	0	110.9	T46 L50 R51 E52	T46-E48 PolarHBondContact O-N 3.1Å; E48-L50 PolarHBondContact O-N 2.97Å; E48-R51 PolarHBondContact O-N 2.63Å; E48-E52 PolarHBondContact O-N 3.43Å
49	R	82.9	Confident	76.7	Confident	87 Å²	87	72 Å²	72	33%	0.328	39%	0.387	S	S	.	.	H	α-helix	trans	-67.4	-34.8	178.1	-170.4	56.6	174.1	-178.3	2.5	112.3	L45 T46 E47 E52 L53 F652	L45-R49 HydrophobicContact CD1-CB 4.16Å; L45-R49 HydrophobicContact CD1-CG 3.84Å; T46-R49 WeakPolarHBondContact O-CB 3.44Å; T46-R49 PolarHBondContact O-N 3.39Å; T46-R49 VanDerWaalsContact O-N 3.16Å; T46-R49 WeakPolarHBondContact OG1-CB 3.28Å; T46-R49 PolarHBondContact OG1-N 3.35Å; E47-R49 VanDerWaalsContact C-N 3.26Å; E47-R49 PolarHBondContact O-N 3.46Å; R49-E52 WeakPolarHBondContact CD-OE2 3.35Å; R49-E52 IonicContact CZ-OE2 3.6Å; R49-E52 IonicContact NE-OE2 2.63Å; R49-E52 IonicContact NH1-OE2 3.83Å; R49-E52 PolarHBondContact NH1-OE2 3.4Å; R49-E52 PolarHBondContact O-N 3.35Å; R49-L53 HydrophobicContact CG-CD1 4.03Å; R49-L53 HydrophobicContact CG-CG 4.42Å; R49-L53 WeakPolarHBondContact O-CB 3.33Å; R49-L53 WeakPolarHBondContact O-CD1 3.48Å; R49-L53 WeakPolarHBondContact O-CG 3.41Å; R49-L53 PolarHBondContact O-N 3.16Å; R49-F652 HydrophobicContact CG-CE1 4.47Å; R49-F652 HydrophobicContact CG-CZ 4.18Å
50	L	86.4	Confident	79	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-66.3	-38.4	171.7	-71.8	168.9	0	0	0	112.2	L45 T46 E47 E48 E52 L53 T54 L59 F79 Y82 L83	L45-L50 HydrophobicContact CD1-CD2 4.3Å; L45-L50 HydrophobicContact CD1-CG 4.39Å; L45-L50 HydrophobicContact CD2-CD2 3.77Å; L45-L50 HydrophobicContact CD2-CG 4.44Å; L45-L50 HydrophobicContact CG-CD2 3.91Å; L45-L50 HydrophobicContact CG-CG 4.03Å; T46-L50 PolarHBondContact O-N 3.2Å; E47-L50 WeakPolarHBondContact O-CB 3.46Å; E47-L50 PolarHBondContact O-N 3.16Å; E47-L50 VanDerWaalsContact O-N 3.13Å; E48-L50 PolarHBondContact O-N 2.97Å; L50-E52 VanDerWaalsContact C-N 3.35Å; L50-L53 PolarHBondContact O-N 3.02Å; L50-T54 WeakPolarHBondContact O-CB 3.36Å; L50-T54 VanDerWaalsContact O-CG2 3.3Å; L50-T54 WeakPolarHBondContact O-CG2 3.21Å; L50-T54 PolarHBondContact O-N 3.27Å; L50-T54 PolarHBondContact O-OG1 3.12Å; L50-L59 HydrophobicContact CB-CD1 3.86Å; L50-L59 HydrophobicContact CB-CD2 4.17Å; L50-L59 HydrophobicContact CD1-CD1 4.49Å; L50-F79 HydrophobicContact CD1-CB 3.99Å; L50-F79 HydrophobicContact CD2-CB 4.44Å; L50-Y82 HydrophobicContact CD1-CD2 3.5Å; L50-Y82 VanDerWaalsContact CD1-CD2 3.5Å; L50-Y82 HydrophobicContact CD1-CE2 4.4Å; L50-Y82 HydrophobicContact CD1-CG 4.05Å; L50-L83 HydrophobicContact CD2-CD1 4.33Å
51	R	87.8	Confident	80.7	Confident	111 Å²	111	69 Å²	69	42%	0.419	36%	0.363	S	S	.	.	H	α-helix	trans	-64.1	-39.3	174.2	-67.7	170.4	-179	-131.4	17.1	111	E47 E48 G55 S57 L59	E47-R51 WeakPolarHBondContact O-CG 3.45Å; E47-R51 PolarHBondContact O-N 3.39Å; E47-R51 IonicContact OE1-CZ 2.84Å; E47-R51 IonicContact OE1-NE 2.7Å; E47-R51 PolarHBondContact OE1-NE 3.29Å; E47-R51 IonicContact OE1-NH2 2.69Å; E47-R51 PolarHBondContact OE1-NH2 3.17Å; E48-R51 PolarHBondContact O-N 2.63Å; R51-G55 WeakPolarHBondContact O-CA 3.44Å; R51-G55 PolarHBondContact O-N 3.08Å; R51-S57 VanDerWaalsContact CZ-O 3.3Å; R51-S57 PolarHBondContact NH1-O 3.34Å; R51-L59 HydrophobicContact CB-CD2 4.42Å; R51-L59 HydrophobicContact CG-CD1 3.98Å; R51-L59 HydrophobicContact CG-CD2 3.73Å; R51-L59 HydrophobicContact CG-CG 3.7Å
52	E	84.8	Confident	82.5	Confident	124 Å²	124	66.3 Å²	66.3	58%	0.579	34%	0.344	S	S	*	.	H	α-helix	trans	-64.3	-44.9	171.1	-70	-171.8	136.1	0	0	113.5	E48 R49 L50	E48-E52 PolarHBondContact O-N 3.43Å; R49-E52 WeakPolarHBondContact CD-OE2 3.35Å; R49-E52 IonicContact CZ-OE2 3.6Å; R49-E52 IonicContact NE-OE2 2.63Å; R49-E52 IonicContact NH1-OE2 3.83Å; R49-E52 PolarHBondContact NH1-OE2 3.4Å; R49-E52 PolarHBondContact O-N 3.35Å; L50-E52 VanDerWaalsContact C-N 3.35Å
53	L	82.8	Confident	84.2	Confident	8 Å²	8	64 Å²	64	4%	0.042	33%	0.328	C	S	.	.	H	α-helix	trans	-71.3	-37.8	-175.7	-72.1	165.9	0	0	0	112.9	L45 R49 L50 L67 V649 S650 F652	L45-L53 HydrophobicContact CD1-CD1 3.9Å; R49-L53 HydrophobicContact CG-CD1 4.03Å; R49-L53 HydrophobicContact CG-CG 4.42Å; R49-L53 WeakPolarHBondContact O-CB 3.33Å; R49-L53 WeakPolarHBondContact O-CD1 3.48Å; R49-L53 WeakPolarHBondContact O-CG 3.41Å; R49-L53 PolarHBondContact O-N 3.16Å; L50-L53 PolarHBondContact O-N 3.02Å; L53-L67 HydrophobicContact CD1-CD2 4Å; L53-V649 WeakPolarHBondContact CD2-O 3.22Å; L53-S650 WeakPolarHBondContact CD2-OG 3.38Å; L53-F652 HydrophobicContact CD1-CE2 4.06Å; L53-F652 HydrophobicContact CD1-CZ 3.93Å
54	T	85.1	Confident	85.2	Confident	11 Å²	11	59.7 Å²	59.7	7%	0.067	31%	0.309	C	S	.	.	H	α-helix	trans	-85.9	-25.8	-179.6	60.8	0	0	0	0	112.4	L50 F56 L59 V62 L65 S647	L50-T54 WeakPolarHBondContact O-CB 3.36Å; L50-T54 VanDerWaalsContact O-CG2 3.3Å; L50-T54 WeakPolarHBondContact O-CG2 3.21Å; L50-T54 PolarHBondContact O-N 3.27Å; L50-T54 PolarHBondContact O-OG1 3.12Å; T54-F56 WeakPolarHBondContact O-CD2 3.46Å; T54-F56 PolarHBondContact O-N 3.14Å; T54-F56 PolarHBondContact OG1-N 2.97Å; T54-L59 HydrophobicContact CG2-CD2 4.5Å; T54-L59 WeakPolarHBondContact OG1-CD2 3.48Å; T54-V62 HydrophobicContact CG2-CG1 3.92Å; T54-V62 HydrophobicContact CG2-CG2 3.95Å; T54-L65 HydrophobicContact CG2-CD1 3.83Å; T54-S647 WeakPolarHBondContact O-CB 3.39Å
55	G	82.2	Confident	86	Confident	66 Å²	66	55.6 Å²	55.6	68%	0.68	29%	0.292	S	S	*	.			trans	75.8	1.4	-172.8	0	0	0	0	0	114.2	R51	R51-G55 WeakPolarHBondContact O-CA 3.44Å; R51-G55 PolarHBondContact O-N 3.08Å
56	F	82.3	Confident	86.4	Confident	56 Å²	56	57 Å²	57	25%	0.246	30%	0.3	C	S	.	.			trans	-92	132.9	177.6	-76.2	-90.4	0	0	0	111	T54 M61 V62	T54-F56 WeakPolarHBondContact O-CD2 3.46Å; T54-F56 PolarHBondContact O-N 3.14Å; T54-F56 PolarHBondContact OG1-N 2.97Å; F56-M61 HydrophobicContact CD1-CB 3.76Å; F56-M61 HydrophobicContact CD1-SD 4.28Å; F56-M61 HydrophobicContact CE1-CB 3.97Å; F56-V62 HydrophobicContact CB-CG2 3.97Å; F56-V62 HydrophobicContact CD2-CG2 3.76Å; F56-V62 HydrophobicContact CG-CG2 3.98Å
57	S	83.3	Confident	86.6	Confident	96 Å²	96	55.1 Å²	55.1	67%	0.671	29%	0.288	S	S	*	.	S	Bend	trans	-69.7	-36.7	168.9	50.4	0	0	0	0	111.7	R51	R51-S57 VanDerWaalsContact CZ-O 3.3Å; R51-S57 PolarHBondContact NH1-O 3.34Å
58	D	86.7	Confident	86.8	Confident	76 Å²	76	54.5 Å²	54.5	41%	0.406	29%	0.285	S	S	.	.	S	Bend	trans	-106.3	108.2	174.1	-177.2	-7.8	0	0	0	110	S60 M61	D58-S60 PolarHBondContact O-N 3.11Å; D58-S60 WeakPolarHBondContact OD1-CB 3.45Å; D58-S60 PolarHBondContact OD1-N 3.04Å; D58-S60 PolarHBondContact OD1-OG 3.46Å; D58-S60 PolarHBondContact OD2-OG 2.86Å; D58-S60 VanDerWaalsContact OD2-OG 3.1Å; D58-M61 HydrophobicContact CB-CG 4.2Å; D58-M61 HydrophobicContact CB-SD 4.45Å; D58-M61 WeakPolarHBondContact O-CB 3.44Å; D58-M61 PolarHBondContact O-N 3.26Å; D58-M61 VanDerWaalsContact O-N 3.16Å
59	L	87.1	Confident	87	Confident	6 Å²	6	47.3 Å²	47.3	3%	0.031	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-66.7	-17.6	-179.7	-67	-175.8	0	0	0	113.4	E47 L50 R51 T54 M61 V62 Y82 L83	E47-L59 HydrophobicContact CG-CD1 3.53Å; L50-L59 HydrophobicContact CB-CD1 3.86Å; L50-L59 HydrophobicContact CB-CD2 4.17Å; L50-L59 HydrophobicContact CD1-CD1 4.49Å; R51-L59 HydrophobicContact CB-CD2 4.42Å; R51-L59 HydrophobicContact CG-CD1 3.98Å; R51-L59 HydrophobicContact CG-CD2 3.73Å; R51-L59 HydrophobicContact CG-CG 3.7Å; T54-L59 HydrophobicContact CG2-CD2 4.5Å; T54-L59 WeakPolarHBondContact OG1-CD2 3.48Å; L59-M61 PolarHBondContact O-N 2.82Å; L59-V62 HydrophobicContact CD2-CG2 4.37Å; L59-V62 WeakPolarHBondContact O-CB 3.46Å; L59-V62 PolarHBondContact O-N 2.69Å; L59-V62 VanDerWaalsContact O-N 3.16Å; L59-Y82 WeakPolarHBondContact CB-O 3.39Å; L59-L83 HydrophobicContact CB-CD2 3.97Å; L59-L83 HydrophobicContact CD2-CD2 4.21Å; L59-L83 HydrophobicContact CG-CD2 4.48Å
60	S	88.1	Confident	87.2	Confident	40 Å²	40	44.9 Å²	44.9	28%	0.28	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-67.6	-15	173.7	78.6	0	0	0	0	113	D58 V62 N85	D58-S60 PolarHBondContact O-N 3.11Å; D58-S60 WeakPolarHBondContact OD1-CB 3.45Å; D58-S60 PolarHBondContact OD1-N 3.04Å; D58-S60 PolarHBondContact OD1-OG 3.46Å; D58-S60 PolarHBondContact OD2-OG 2.86Å; D58-S60 VanDerWaalsContact OD2-OG 3.1Å; S60-V62 VanDerWaalsContact C-N 3.32Å; S60-N85 WeakPolarHBondContact O-CB 3.43Å; S60-N85 PolarHBondContact O-ND2 2.95Å
61	M	86.8	Confident	87.2	Confident	102 Å²	102	46.9 Å²	46.9	50%	0.502	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-81.5	-7.6	174.6	-59	-170.1	72.3	0	0	113.8	F56 D58 L59 F63	F56-M61 HydrophobicContact CD1-CB 3.76Å; F56-M61 HydrophobicContact CD1-SD 4.28Å; F56-M61 HydrophobicContact CE1-CB 3.97Å; D58-M61 HydrophobicContact CB-CG 4.2Å; D58-M61 HydrophobicContact CB-SD 4.45Å; D58-M61 WeakPolarHBondContact O-CB 3.44Å; D58-M61 PolarHBondContact O-N 3.26Å; D58-M61 VanDerWaalsContact O-N 3.16Å; L59-M61 PolarHBondContact O-N 2.82Å; M61-F63 VanDerWaalsContact O-CD2 3.26Å; M61-F63 WeakPolarHBondContact O-CD2 3.26Å; M61-F63 PolarHBondContact O-N 2.7Å
62	V	89.1	Confident	87.2	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	27%	0.272	C	S	.	.			trans	-87.7	100.4	-171.8	-178.6	0	0	0	0	111.2	T54 F56 L59 S60 T64 L83	T54-V62 HydrophobicContact CG2-CG1 3.92Å; T54-V62 HydrophobicContact CG2-CG2 3.95Å; F56-V62 HydrophobicContact CB-CG2 3.97Å; F56-V62 HydrophobicContact CD2-CG2 3.76Å; F56-V62 HydrophobicContact CG-CG2 3.98Å; L59-V62 HydrophobicContact CD2-CG2 4.37Å; L59-V62 WeakPolarHBondContact O-CB 3.46Å; L59-V62 PolarHBondContact O-N 2.69Å; L59-V62 VanDerWaalsContact O-N 3.16Å; S60-V62 VanDerWaalsContact C-N 3.32Å; V62-T64 WeakPolarHBondContact CG1-O 3.35Å; V62-L83 HydrophobicContact CB-CD2 3.8Å; V62-L83 HydrophobicContact CG1-CD2 4.01Å; V62-L83 HydrophobicContact CG2-CD2 4.2Å
63	F	91.7	Very high	87.1	Confident	79 Å²	79	49.1 Å²	49.1	35%	0.346	27%	0.269	S	S	.	.			trans	-88.2	-19	174.7	-62.5	-79.3	0	0	0	113.7	M61 N85 R87 H88	M61-F63 VanDerWaalsContact O-CD2 3.26Å; M61-F63 WeakPolarHBondContact O-CD2 3.26Å; M61-F63 PolarHBondContact O-N 2.7Å; F63-N85 HydrophobicContact CD1-CB 4.22Å; F63-N85 VanDerWaalsContact CD1-O 3.26Å; F63-N85 WeakPolarHBondContact CD1-O 3.28Å; F63-N85 HydrophobicContact CE1-CB 3.9Å; F63-R87 HydrophobicContact CD1-CG 4.34Å; F63-R87 PolarHBondContact O-N 3.49Å; F63-H88 PolarHBondContact O-N 3.41Å
64	T	91.7	Very high	87.2	Confident	18 Å²	18	50 Å²	50	11%	0.11	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	128.5	-174.7	65.6	0	0	0	0	111.1	V62 H88 S647	V62-T64 WeakPolarHBondContact CG1-O 3.35Å; T64-H88 WeakPolarHBondContact CA-O 3.47Å; T64-H88 HydrophobicContact CG2-CB 4.01Å; T64-S647 PolarHBondContact O-OG 2.89Å
65	L	91.3	Very high	87.3	Confident	7 Å²	7	51.5 Å²	51.5	4%	0.037	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.5	178.7	-172.5	70.7	0	0	0	110.3	T54 L67 F79 L83 L86 H88 L89 R90	T54-L65 HydrophobicContact CG2-CD1 3.83Å; L65-L67 HydrophobicContact CD1-CD1 4.48Å; L65-L67 HydrophobicContact CD1-CD2 4.46Å; L65-L67 HydrophobicContact CD1-CG 4.33Å; L65-L67 HydrophobicContact CD2-CD1 3.68Å; L65-L67 HydrophobicContact CD2-CG 4.22Å; L65-L67 HydrophobicContact CG-CD1 4.02Å; L65-L67 HydrophobicContact CG-CG 3.99Å; L65-F79 HydrophobicContact CD2-CD2 4.11Å; L65-F79 HydrophobicContact CD2-CE2 3.94Å; L65-L83 HydrophobicContact CD1-CD1 4.23Å; L65-L83 HydrophobicContact CD2-CD1 3.61Å; L65-L83 HydrophobicContact CG-CD1 4.42Å; L65-L86 HydrophobicContact CB-CD1 3.57Å; L65-L86 HydrophobicContact CB-CD2 4.28Å; L65-L86 HydrophobicContact CD2-CD2 4.23Å; L65-H88 PolarHBondContact N-O 3.09Å; L65-L89 HydrophobicContact CB-CD1 4.34Å; L65-L89 HydrophobicContact CD2-CD1 3.97Å; L65-L89 HydrophobicContact CG-CD1 4.45Å; L65-R90 PolarHBondContact O-N 3.06Å
66	D	91	Very high	87.5	Confident	38 Å²	38	48.5 Å²	48.5	20%	0.203	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	116.5	179.8	-167	-5.1	0	0	0	109.2	R90 K648	D66-R90 WeakPolarHBondContact CA-O 3.17Å; D66-R90 HydrophobicContact CB-CB 4.3Å; D66-R90 WeakPolarHBondContact OD1-CD 3.34Å; D66-R90 VanDerWaalsContact OD1-CG 3.26Å; D66-R90 WeakPolarHBondContact OD1-CG 3.4Å; D66-R90 VanDerWaalsContact OD2-CD 3.27Å; D66-R90 WeakPolarHBondContact OD2-CD 3.48Å; D66-R90 IonicContact OD2-NH1 3.87Å; D66-K648 HydrophobicContact CB-CB 4.18Å
67	L	88.6	Confident	87.8	Confident	6 Å²	6	47.4 Å²	47.4	3%	0.031	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	151.1	-172.2	-65.3	174.9	0	0	0	113.3	L45 L53 L65 V69 R90 L91 S92	L45-L67 HydrophobicContact CD2-CD1 4.19Å; L53-L67 HydrophobicContact CD1-CD2 4Å; L65-L67 HydrophobicContact CD1-CD1 4.48Å; L65-L67 HydrophobicContact CD1-CD2 4.46Å; L65-L67 HydrophobicContact CD1-CG 4.33Å; L65-L67 HydrophobicContact CD2-CD1 3.68Å; L65-L67 HydrophobicContact CD2-CG 4.22Å; L65-L67 HydrophobicContact CG-CD1 4.02Å; L65-L67 HydrophobicContact CG-CG 3.99Å; L67-V69 HydrophobicContact CB-CG2 3.95Å; L67-V69 HydrophobicContact CD1-CG2 4.34Å; L67-R90 PolarHBondContact N-O 3.32Å; L67-L91 HydrophobicContact CB-CD2 3.99Å; L67-L91 WeakPolarHBondContact O-CA 3.49Å; L67-S92 PolarHBondContact O-N 3.3Å
68	E	89.7	Confident	87.9	Confident	55 Å²	55	46.7 Å²	46.7	26%	0.257	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-117.2	102.9	165.2	-176.2	-173.4	139.1	0	0	107.9	I651 K653	E68-I651 VanDerWaalsContact OE1-CG2 3.3Å; E68-I651 WeakPolarHBondContact OE1-CG2 3.41Å; E68-I651 WeakPolarHBondContact OE2-CG1 3.44Å; E68-K653 IonicContact OE1-NZ 3.61Å; E68-K653 PolarHBondContact OE1-NZ 3.05Å
69	V	86.6	Confident	88	Confident	6 Å²	6	43.1 Å²	43.1	4%	0.036	22%	0.224	C	C	.	.			trans	-108.7	143	-171.7	-179.4	0	0	0	0	111.2	L67 I71 V76 L91 S94 N95	L67-V69 HydrophobicContact CB-CG2 3.95Å; L67-V69 HydrophobicContact CD1-CG2 4.34Å; V69-I71 HydrophobicContact CG1-CG1 3.97Å; V69-V76 HydrophobicContact CG1-CB 4.44Å; V69-V76 HydrophobicContact CG1-CG1 3.57Å; V69-V76 HydrophobicContact CG1-CG2 4.01Å; V69-V76 HydrophobicContact CG2-CG1 4.09Å; V69-L91 HydrophobicContact CG2-CD2 3.91Å; V69-S94 PolarHBondContact N-OG 3.28Å; V69-S94 CarbonylContact O-C 3.57Å; V69-S94 WeakPolarHBondContact O-CA 3.49Å; V69-S94 VanDerWaalsContact O-CB 3.22Å; V69-S94 WeakPolarHBondContact O-CB 3.37Å; V69-N95 PolarHBondContact O-N 3.22Å
70	D	88.6	Confident	88	Confident	36 Å²	36	43 Å²	43	19%	0.193	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-124.7	102.5	169.8	-168.1	0.3	0	0	0	108.8	D72 R73 I74 N95	D70-D72 PolarHBondContact O-N 3.41Å; D70-R73 HydrophobicContact CB-CG 4.18Å; D70-R73 WeakPolarHBondContact O-CB 3.4Å; D70-R73 PolarHBondContact O-N 3.16Å; D70-R73 IonicContact OD2-CZ 2.93Å; D70-R73 VanDerWaalsContact OD2-CZ 3.23Å; D70-R73 IonicContact OD2-NE 2.58Å; D70-R73 PolarHBondContact OD2-NE 3.42Å; D70-R73 IonicContact OD2-NH2 2.63Å; D70-R73 PolarHBondContact OD2-NH2 3.43Å; D70-I74 PolarHBondContact O-N 3.07Å; D70-N95 WeakPolarHBondContact OD1-CB 3.3Å; D70-N95 PolarHBondContact OD1-ND2 3.2Å
71	I	86.8	Confident	88	Confident	43 Å²	43	44.5 Å²	44.5	22%	0.221	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-23.1	-171	-67.6	-168.7	0	0	0	112.4	V69 R73 V76 N95 I96 D101	V69-I71 HydrophobicContact CG1-CG1 3.97Å; I71-R73 PolarHBondContact O-N 3.3Å; I71-V76 HydrophobicContact CD1-CG2 3.9Å; I71-V76 HydrophobicContact CG1-CG2 4.12Å; I71-N95 WeakPolarHBondContact CB-O 3.4Å; I71-N95 WeakPolarHBondContact CG1-O 3.46Å; I71-N95 PolarHBondContact N-O 3Å; I71-I96 HydrophobicContact CD1-CB 4.12Å; I71-I96 HydrophobicContact CD1-CG1 3.88Å; I71-I96 HydrophobicContact CD1-CG2 3.87Å; I71-I96 HydrophobicContact CG1-CG1 4.21Å; I71-D101 HydrophobicContact CD1-CB 3.46Å; I71-D101 VanDerWaalsContact CD1-CB 3.46Å
72	D	86	Confident	88.1	Confident	143 Å²	143	43.2 Å²	43.2	77%	0.765	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-1.7	168.9	-69.4	-44	0	0	0	113.5	D70 N95	D70-D72 PolarHBondContact O-N 3.41Å; D72-N95 PolarHBondContact OD2-ND2 3.17Å
73	R	84.1	Confident	88.2	Confident	139 Å²	139	43.2 Å²	43.2	53%	0.525	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.5	-42.6	178.7	-50.7	-177.1	-156.9	-114.9	-14.1	114.8	D70 I71	D70-R73 HydrophobicContact CB-CG 4.18Å; D70-R73 WeakPolarHBondContact O-CB 3.4Å; D70-R73 PolarHBondContact O-N 3.16Å; D70-R73 IonicContact OD2-CZ 2.93Å; D70-R73 VanDerWaalsContact OD2-CZ 3.23Å; D70-R73 IonicContact OD2-NE 2.58Å; D70-R73 PolarHBondContact OD2-NE 3.42Å; D70-R73 IonicContact OD2-NH2 2.63Å; D70-R73 PolarHBondContact OD2-NH2 3.43Å; I71-R73 PolarHBondContact O-N 3.3Å
74	I	85	Confident	88.1	Confident	26 Å²	26	42.8 Å²	42.8	13%	0.133	23%	0.23	C	C	.	.			trans	-137.3	122.3	-169.7	-58.6	176.6	0	0	0	108.9	L45 D70 F652	L45-I74 HydrophobicContact CB-CG2 4.36Å; D70-I74 PolarHBondContact O-N 3.07Å; I74-F652 HydrophobicContact CD1-CB 4.42Å; I74-F652 HydrophobicContact CD1-CD1 3.27Å; I74-F652 HydrophobicContact CD1-CE1 3.5Å; I74-F652 VanDerWaalsContact CD1-CE1 3.5Å; I74-F652 HydrophobicContact CD1-CG 3.89Å; I74-F652 HydrophobicContact CD1-CZ 4.28Å
75	S	86.3	Confident	88.1	Confident	43 Å²	43	45.3 Å²	45.3	30%	0.301	24%	0.242	S	C	.	.	B	Isolated β-bridge	trans	-73.5	128	172.1	-174	0	0	0	0	110.9	E43 L45	E43-S75 PolarHBondContact O-N 3.32Å; L45-S75 PolarHBondContact N-O 3.29Å; L45-S75 VanDerWaalsContact N-O 3.11Å
76	V	87.5	Confident	88.2	Confident	3 Å²	3	45 Å²	45	2%	0.018	24%	0.241	C	C	.	.			trans	-108.9	0.3	-179.2	-75	0	0	0	0	113.5	L45 V69 I71 N78 F79 L102	L45-V76 HydrophobicContact CB-CG1 4.35Å; L45-V76 HydrophobicContact CD2-CG1 4.11Å; V69-V76 HydrophobicContact CG1-CB 4.44Å; V69-V76 HydrophobicContact CG1-CG1 3.57Å; V69-V76 HydrophobicContact CG1-CG2 4.01Å; V69-V76 HydrophobicContact CG2-CG1 4.09Å; I71-V76 HydrophobicContact CD1-CG2 3.9Å; I71-V76 HydrophobicContact CG1-CG2 4.12Å; V76-N78 PolarHBondContact O-N 3.34Å; V76-F79 HydrophobicContact CB-CD1 3.83Å; V76-F79 HydrophobicContact CB-CE1 4.07Å; V76-F79 HydrophobicContact CG1-CD1 4.41Å; V76-F79 WeakPolarHBondContact O-CD1 3.33Å; V76-F79 PolarHBondContact O-N 3.42Å; V76-L102 HydrophobicContact CG2-CD2 4.18Å
77	A	87.6	Confident	88.3	Confident	32 Å²	32	48.2 Å²	48.2	26%	0.264	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-19.8	-176.4	0	0	0	0	0	115.2	D101 G103	A77-D101 WeakPolarHBondContact CA-O 3.35Å; A77-D101 PolarHBondContact N-O 2.81Å; A77-G103 WeakPolarHBondContact O-CA 3.46Å
78	N	85.8	Confident	88.6	Confident	82 Å²	82	50.2 Å²	50.2	44%	0.439	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-5.1	-174.7	-66.1	6.5	0	0	0	114.5	V76 G80 S81	V76-N78 PolarHBondContact O-N 3.34Å; N78-G80 VanDerWaalsContact C-N 3.26Å; N78-G80 PolarHBondContact O-N 2.76Å; N78-S81 PolarHBondContact O-N 2.97Å; N78-S81 PolarHBondContact O-OG 3.22Å
79	F	88.6	Confident	88.8	Confident	1 Å²	1	47.6 Å²	47.6	0%	0.004	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-67.6	-26.5	-170.7	74.9	-107.8	0	0	0	114	L45 L50 L65 V76 S81 Y82 L83 L86 L89 L102 L106	L45-F79 HydrophobicContact CD2-CB 4.04Å; L45-F79 HydrophobicContact CD2-CD1 4.36Å; L45-F79 HydrophobicContact CD2-CG 4.47Å; L45-F79 HydrophobicContact CG-CB 4.47Å; L50-F79 HydrophobicContact CD1-CB 3.99Å; L50-F79 HydrophobicContact CD2-CB 4.44Å; L65-F79 HydrophobicContact CD2-CD2 4.11Å; L65-F79 HydrophobicContact CD2-CE2 3.94Å; V76-F79 HydrophobicContact CB-CD1 3.83Å; V76-F79 HydrophobicContact CB-CE1 4.07Å; V76-F79 HydrophobicContact CG1-CD1 4.41Å; V76-F79 WeakPolarHBondContact O-CD1 3.33Å; V76-F79 PolarHBondContact O-N 3.42Å; F79-S81 VanDerWaalsContact C-N 3.3Å; F79-S81 PolarHBondContact O-N 3.16Å; F79-Y82 PolarHBondContact O-N 3.16Å; F79-L83 HydrophobicContact CD2-CD1 4.08Å; F79-L86 HydrophobicContact CE2-CD2 4.18Å; F79-L89 HydrophobicContact CE2-CD1 4.32Å; F79-L89 HydrophobicContact CZ-CD1 4.1Å; F79-L89 HydrophobicContact CZ-CD2 4.01Å; F79-L102 HydrophobicContact CE1-CD2 4Å; F79-L102 HydrophobicContact CZ-CD2 4.37Å; F79-L106 HydrophobicContact CD2-CD2 4.23Å; F79-L106 HydrophobicContact CE2-CD1 4.21Å; F79-L106 HydrophobicContact CE2-CD2 3.62Å; F79-L106 HydrophobicContact CZ-CD1 3.97Å; F79-L106 HydrophobicContact CZ-CD2 4.23Å
80	G	87.8	Confident	89.2	Confident	2 Å²	2	49.8 Å²	49.8	2%	0.021	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-61.8	-33	-177.2	0	0	0	0	0	114.1	N78 Y82 L83 C105	N78-G80 VanDerWaalsContact C-N 3.26Å; N78-G80 PolarHBondContact O-N 2.76Å; G80-Y82 PolarHBondContact O-N 3.27Å; G80-L83 PolarHBondContact O-N 3.29Å; G80-L83 VanDerWaalsContact O-N 3.12Å; G80-C105 CarbonylContact C-O 3.33Å; G80-C105 VanDerWaalsContact CA-O 3.28Å; G80-C105 WeakPolarHBondContact CA-O 3.42Å
81	S	88.7	Confident	89.3	Confident	73 Å²	73	48 Å²	48	51%	0.51	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-67.2	-22.4	178.6	56.6	0	0	0	0	113.4	N78 F79	N78-S81 PolarHBondContact O-N 2.97Å; N78-S81 PolarHBondContact O-OG 3.22Å; F79-S81 VanDerWaalsContact C-N 3.3Å; F79-S81 PolarHBondContact O-N 3.16Å
82	Y	87.8	Confident	89.2	Confident	75 Å²	75	47.5 Å²	47.5	29%	0.294	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-87.9	-12	175.5	-49.4	-64.5	0	0	0	113.4	E47 L50 L59 F79 G80 P84	E47-Y82 HydrophobicContact CB-CD1 3.82Å; E47-Y82 HydrophobicContact CB-CE1 3.81Å; E47-Y82 HydrophobicContact CB-CG 4.22Å; E47-Y82 HydrophobicContact CG-CD1 3.61Å; E47-Y82 HydrophobicContact CG-CE1 4.1Å; E47-Y82 HydrophobicContact CG-CG 3.98Å; L50-Y82 HydrophobicContact CD1-CD2 3.5Å; L50-Y82 VanDerWaalsContact CD1-CD2 3.5Å; L50-Y82 HydrophobicContact CD1-CE2 4.4Å; L50-Y82 HydrophobicContact CD1-CG 4.05Å; L59-Y82 WeakPolarHBondContact CB-O 3.39Å; F79-Y82 PolarHBondContact O-N 3.16Å; G80-Y82 PolarHBondContact O-N 3.27Å; Y82-P84 VanDerWaalsContact C-CD 3.41Å; Y82-P84 WeakPolarHBondContact O-CD 3.42Å
83	L	91.1	Very high	89.1	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	24%	0.235	C	C	.	.			trans	-124.6	59.8	-172.4	-64.3	174.7	0	0	0	112.3	L50 L59 V62 L65 F79 G80 N85 L86	L50-L83 HydrophobicContact CD2-CD1 4.33Å; L59-L83 HydrophobicContact CB-CD2 3.97Å; L59-L83 HydrophobicContact CD2-CD2 4.21Å; L59-L83 HydrophobicContact CG-CD2 4.48Å; V62-L83 HydrophobicContact CB-CD2 3.8Å; V62-L83 HydrophobicContact CG1-CD2 4.01Å; V62-L83 HydrophobicContact CG2-CD2 4.2Å; L65-L83 HydrophobicContact CD1-CD1 4.23Å; L65-L83 HydrophobicContact CD2-CD1 3.61Å; L65-L83 HydrophobicContact CG-CD1 4.42Å; F79-L83 HydrophobicContact CD2-CD1 4.08Å; G80-L83 PolarHBondContact O-N 3.29Å; G80-L83 VanDerWaalsContact O-N 3.12Å; L83-N85 PolarHBondContact O-N 3.29Å; L83-L86 HydrophobicContact CB-CB 4.13Å; L83-L86 HydrophobicContact CD1-CD2 4.38Å; L83-L86 WeakPolarHBondContact O-CB 3.26Å; L83-L86 PolarHBondContact O-N 3.18Å; L83-L86 VanDerWaalsContact O-N 3.11Å
84	P	89.2	Confident	89.4	Confident	70 Å²	70	39.1 Å²	39.1	46%	0.455	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-12.6	-169.4	28.6	-37.9	0	0	0	115.2	Y82 T108	Y82-P84 VanDerWaalsContact C-CD 3.41Å; Y82-P84 WeakPolarHBondContact O-CD 3.42Å; P84-T108 VanDerWaalsContact O-CG2 3.23Å; P84-T108 WeakPolarHBondContact O-CG2 3.36Å; P84-T108 PolarHBondContact O-OG1 3.3Å
85	N	91.5	Very high	89.7	Confident	71 Å²	71	39.8 Å²	39.8	38%	0.38	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	10.2	179.7	-73.4	-41.4	0	0	0	113.2	S60 F63 L83 R87	S60-N85 WeakPolarHBondContact O-CB 3.43Å; S60-N85 PolarHBondContact O-ND2 2.95Å; F63-N85 HydrophobicContact CD1-CB 4.22Å; F63-N85 VanDerWaalsContact CD1-O 3.26Å; F63-N85 WeakPolarHBondContact CD1-O 3.28Å; F63-N85 HydrophobicContact CE1-CB 3.9Å; L83-N85 PolarHBondContact O-N 3.29Å; N85-R87 PolarHBondContact O-N 2.82Å
86	L	93.5	Very high	90	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.201	C	C	.	.			trans	-64.4	122.9	-178	-174.9	63.9	0	0	0	111.1	L65 F79 L83 L89 L106 T108 V109	L65-L86 HydrophobicContact CB-CD1 3.57Å; L65-L86 HydrophobicContact CB-CD2 4.28Å; L65-L86 HydrophobicContact CD2-CD2 4.23Å; F79-L86 HydrophobicContact CE2-CD2 4.18Å; L83-L86 HydrophobicContact CB-CB 4.13Å; L83-L86 HydrophobicContact CD1-CD2 4.38Å; L83-L86 WeakPolarHBondContact O-CB 3.26Å; L83-L86 PolarHBondContact O-N 3.18Å; L83-L86 VanDerWaalsContact O-N 3.11Å; L86-L89 HydrophobicContact CD2-CB 4.41Å; L86-L89 HydrophobicContact CD2-CD1 4.42Å; L86-L106 HydrophobicContact CD2-CD2 4.32Å; L86-T108 CarbonylContact O-C 3.57Å; L86-T108 WeakPolarHBondContact O-CB 3.38Å; L86-T108 PolarHBondContact O-OG1 3.07Å; L86-V109 HydrophobicContact CB-CG2 4.48Å; L86-V109 HydrophobicContact CD2-CG2 4.17Å; L86-V109 HydrophobicContact CG-CG2 4.15Å; L86-V109 WeakPolarHBondContact O-CA 3.44Å; L86-V109 PolarHBondContact O-N 2.91Å
87	R	94.3	Very high	90.2	Very high	105 Å²	105	40.4 Å²	40.4	40%	0.396	22%	0.218	S	C	.	.			trans	-108.2	-34.7	177.4	-69.2	172.7	175.9	-95.8	-7.8	112.7	F63 N85 V109 E110 V111	F63-R87 HydrophobicContact CD1-CG 4.34Å; F63-R87 PolarHBondContact O-N 3.49Å; N85-R87 PolarHBondContact O-N 2.82Å; R87-V109 WeakPolarHBondContact O-CG1 3.48Å; R87-E110 WeakPolarHBondContact CD-OE2 3.37Å; R87-E110 WeakPolarHBondContact CG-OE2 3.41Å; R87-E110 IonicContact CZ-OE1 2.61Å; R87-E110 IonicContact CZ-OE2 3.57Å; R87-E110 IonicContact NE-OE2 3.23Å; R87-E110 IonicContact NH1-OE1 2.72Å; R87-E110 PolarHBondContact NH1-OE1 2.95Å; R87-E110 IonicContact NH1-OE2 2.69Å; R87-E110 PolarHBondContact NH1-OE2 3.16Å; R87-E110 PolarHBondContact O-N 3.11Å; R87-V111 PolarHBondContact O-N 3.33Å
88	H	95.1	Very high	90.4	Very high	49 Å²	49	39.8 Å²	39.8	23%	0.227	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	110.1	-169.7	-66.6	157.8	0	0	0	109.5	F63 T64 L65 W113	F63-H88 PolarHBondContact O-N 3.41Å; T64-H88 WeakPolarHBondContact CA-O 3.47Å; T64-H88 HydrophobicContact CG2-CB 4.01Å; L65-H88 PolarHBondContact N-O 3.09Å; H88-W113 HydrophobicContact CB-CH2 4.33Å; H88-W113 HydrophobicContact CB-CZ3 3.94Å
89	L	94.3	Very high	90.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	113.5	-179.8	176.4	58.9	0	0	0	110.3	L65 F79 L86 L91 L102 L106 V109 V111 I112 W113	L65-L89 HydrophobicContact CB-CD1 4.34Å; L65-L89 HydrophobicContact CD2-CD1 3.97Å; L65-L89 HydrophobicContact CG-CD1 4.45Å; F79-L89 HydrophobicContact CE2-CD1 4.32Å; F79-L89 HydrophobicContact CZ-CD1 4.1Å; F79-L89 HydrophobicContact CZ-CD2 4.01Å; L86-L89 HydrophobicContact CD2-CB 4.41Å; L86-L89 HydrophobicContact CD2-CD1 4.42Å; L89-L91 HydrophobicContact CD1-CD1 4.26Å; L89-L91 HydrophobicContact CD1-CG 4.11Å; L89-L91 HydrophobicContact CD2-CD1 4Å; L89-L91 HydrophobicContact CG-CD1 4.01Å; L89-L91 HydrophobicContact CG-CG 4.23Å; L89-L102 HydrophobicContact CD2-CD1 4.27Å; L89-L106 HydrophobicContact CD2-CD1 4.46Å; L89-V109 HydrophobicContact CB-CG1 3.99Å; L89-V111 PolarHBondContact N-O 3.01Å; L89-I112 WeakPolarHBondContact O-CA 3.23Å; L89-W113 PolarHBondContact O-N 3.38Å
90	R	94	Very high	91	Very high	51 Å²	51	42.9 Å²	42.9	19%	0.192	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.4	171.8	177.1	-178.7	-97.8	-162.6	-8.9	110.2	L65 D66 L67 S92 W113 S682	L65-R90 PolarHBondContact O-N 3.06Å; D66-R90 WeakPolarHBondContact CA-O 3.17Å; D66-R90 HydrophobicContact CB-CB 4.3Å; D66-R90 WeakPolarHBondContact OD1-CD 3.34Å; D66-R90 VanDerWaalsContact OD1-CG 3.26Å; D66-R90 WeakPolarHBondContact OD1-CG 3.4Å; D66-R90 VanDerWaalsContact OD2-CD 3.27Å; D66-R90 WeakPolarHBondContact OD2-CD 3.48Å; D66-R90 IonicContact OD2-NH1 3.87Å; L67-R90 PolarHBondContact N-O 3.32Å; R90-S92 WeakPolarHBondContact CG-OG 3.44Å; R90-W113 HydrophobicContact CB-CB 4.48Å; R90-W113 HydrophobicContact CB-CE3 3.98Å; R90-W113 HydrophobicContact CG-CB 4.33Å; R90-S682 PolarHBondContact NH1-O 3.33Å
91	L	91.2	Very high	91.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	97.9	176	-69.7	159.7	0	0	0	106.1	L67 V69 L89 I96 L102 W113 M114 C117	L67-L91 HydrophobicContact CB-CD2 3.99Å; L67-L91 WeakPolarHBondContact O-CA 3.49Å; V69-L91 HydrophobicContact CG2-CD2 3.91Å; L89-L91 HydrophobicContact CD1-CD1 4.26Å; L89-L91 HydrophobicContact CD1-CG 4.11Å; L89-L91 HydrophobicContact CD2-CD1 4Å; L89-L91 HydrophobicContact CG-CD1 4.01Å; L89-L91 HydrophobicContact CG-CG 4.23Å; L91-I96 HydrophobicContact CB-CD1 4.24Å; L91-I96 HydrophobicContact CD1-CD1 3.92Å; L91-I96 HydrophobicContact CD2-CD1 4.01Å; L91-I96 HydrophobicContact CG-CD1 4.29Å; L91-L102 HydrophobicContact CD1-CD1 3.73Å; L91-L102 HydrophobicContact CD1-CD2 3.65Å; L91-L102 HydrophobicContact CD1-CG 4.35Å; L91-W113 PolarHBondContact N-O 3.41Å; L91-M114 HydrophobicContact CB-CG 3.99Å; L91-M114 HydrophobicContact CD1-CE 4.41Å; L91-M114 HydrophobicContact CD1-CG 3.85Å; L91-M114 HydrophobicContact CD1-SD 4.18Å; L91-M114 WeakPolarHBondContact O-CA 3.39Å; L91-C117 PolarHBondContact O-SG 2.87Å
92	S	83.7	Confident	91.2	Very high	31 Å²	31	42 Å²	42	22%	0.217	21%	0.207	C	C	.	.			trans	-108.6	133.1	-174.7	-57.9	0	0	0	0	110.3	L67 R90 S94	L67-S92 PolarHBondContact O-N 3.3Å; R90-S92 WeakPolarHBondContact CG-OG 3.44Å; S92-S94 PolarHBondContact O-N 3.1Å; S92-S94 VanDerWaalsContact O-N 3.15Å
93	N	83.9	Confident	91.3	Very high	102 Å²	102	38.9 Å²	38.9	55%	0.545	20%	0.198	S	C	.	.	S	Bend	trans	52.3	32.8	-179.2	-56.2	-36.4	0	0	0	114	P115	N93-P115 PolarHBondContact N-O 3.12Å
94	S	90.6	Very high	91.2	Very high	5 Å²	5	43.9 Å²	43.9	4%	0.035	23%	0.229	C	C	.	.			trans	-82.3	171.3	177.8	-61.6	0	0	0	0	111.5	V69 S92 C117	V69-S94 PolarHBondContact N-OG 3.28Å; V69-S94 CarbonylContact O-C 3.57Å; V69-S94 WeakPolarHBondContact O-CA 3.49Å; V69-S94 VanDerWaalsContact O-CB 3.22Å; V69-S94 WeakPolarHBondContact O-CB 3.37Å; S92-S94 PolarHBondContact O-N 3.1Å; S92-S94 VanDerWaalsContact O-N 3.15Å; S94-C117 CarbonylContact O-C 3.5Å; S94-C117 WeakPolarHBondContact O-CA 3.36Å
95	N	91.6	Very high	91.1	Very high	39 Å²	39	43.4 Å²	43.4	21%	0.209	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-114.6	92.3	171.5	176.5	32.4	0	0	0	108.3	V69 D70 I71 D72	V69-N95 PolarHBondContact O-N 3.22Å; D70-N95 WeakPolarHBondContact OD1-CB 3.3Å; D70-N95 PolarHBondContact OD1-ND2 3.2Å; I71-N95 WeakPolarHBondContact CB-O 3.4Å; I71-N95 WeakPolarHBondContact CG1-O 3.46Å; I71-N95 PolarHBondContact N-O 3Å; D72-N95 PolarHBondContact OD2-ND2 3.17Å
96	I	92.8	Very high	91	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.209	C	C	.	.			trans	-135.5	90.9	-170.7	-55	173.8	0	0	0	108.1	I71 L91 A98 L102 M114 C117 L119	I71-I96 HydrophobicContact CD1-CB 4.12Å; I71-I96 HydrophobicContact CD1-CG1 3.88Å; I71-I96 HydrophobicContact CD1-CG2 3.87Å; I71-I96 HydrophobicContact CG1-CG1 4.21Å; L91-I96 HydrophobicContact CB-CD1 4.24Å; L91-I96 HydrophobicContact CD1-CD1 3.92Å; L91-I96 HydrophobicContact CD2-CD1 4.01Å; L91-I96 HydrophobicContact CG-CD1 4.29Å; I96-A98 WeakPolarHBondContact CG2-O 3.44Å; I96-A98 PolarHBondContact O-N 3.48Å; I96-L102 HydrophobicContact CD1-CD2 4.21Å; I96-M114 HydrophobicContact CB-CE 4.09Å; I96-M114 HydrophobicContact CD1-CE 4.12Å; I96-M114 HydrophobicContact CG2-CE 3.66Å; I96-C117 PolarHBondContact N-O 3.14Å; I96-L119 WeakPolarHBondContact O-CA 3.43Å; I96-L119 VanDerWaalsContact O-CD1 3.25Å; I96-L119 WeakPolarHBondContact O-CD1 3.46Å
97	P	91.4	Very high	90.9	Very high	60 Å²	60	44.1 Å²	44.1	39%	0.39	23%	0.23	S	C	.	.	S	Bend	trans	-67.2	-30.3	-174.5	-23.9	36	0	0	0	114.7	V120 S121	P97-V120 PolarHBondContact O-N 3.34Å; P97-S121 PolarHBondContact O-N 3.17Å
98	A	92.6	Very high	90.8	Very high	18 Å²	18	40.2 Å²	40.2	15%	0.149	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-136.1	146.5	175	0	0	0	0	0	112.2	I96 R100 D101 S121	I96-A98 WeakPolarHBondContact CG2-O 3.44Å; I96-A98 PolarHBondContact O-N 3.48Å; A98-R100 PolarHBondContact O-N 3.18Å; A98-D101 PolarHBondContact N-OD2 3.05Å; A98-D101 PolarHBondContact O-N 3.28Å; A98-S121 WeakPolarHBondContact CA-O 3.45Å
99	V	92.7	Very high	90.8	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.006	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-61.7	-32.3	178.6	-177.3	0	0	0	0	111.4	D101 L102 M114 L119 S121 L122 D123 L125 F128	V99-D101 PolarHBondContact O-N 3.05Å; V99-D101 VanDerWaalsContact O-N 3.08Å; V99-L102 HydrophobicContact CG1-CD1 4.29Å; V99-L102 VanDerWaalsContact O-CB 3.31Å; V99-L102 WeakPolarHBondContact O-CB 3.5Å; V99-L102 WeakPolarHBondContact O-CG 3.39Å; V99-L102 PolarHBondContact O-N 3.19Å; V99-M114 HydrophobicContact CG2-SD 4.46Å; V99-L119 HydrophobicContact CG2-CD1 3.85Å; V99-L119 HydrophobicContact CG2-CD2 3.92Å; V99-L119 HydrophobicContact CG2-CG 4.43Å; V99-S121 PolarHBondContact N-O 3.22Å; V99-L122 HydrophobicContact CG2-CD2 4.13Å; V99-D123 CarbonylContact C-O 3.35Å; V99-D123 WeakPolarHBondContact CB-O 3.42Å; V99-D123 PolarHBondContact N-O 2.86Å; V99-L125 HydrophobicContact CG1-CD2 4.1Å; V99-L125 HydrophobicContact CG1-CG 4.36Å; V99-L125 HydrophobicContact CG2-CG 4.42Å; V99-F128 HydrophobicContact CG1-CD2 4.46Å; V99-F128 HydrophobicContact CG1-CE2 3.63Å; V99-F128 HydrophobicContact CG1-CZ 4.24Å
100	R	92.4	Very high	90.9	Very high	148 Å²	148	40.5 Å²	40.5	56%	0.558	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-51.9	-28.7	176.5	-165	-176.6	-62.1	179.3	1.3	113.7	A98 L102 G103 D123	A98-R100 PolarHBondContact O-N 3.18Å; R100-L102 PolarHBondContact O-N 2.99Å; R100-G103 PolarHBondContact O-N 2.91Å; R100-D123 WeakPolarHBondContact CB-O 3.5Å; R100-D123 PolarHBondContact N-O 3.19Å; R100-D123 VanDerWaalsContact NH2-CG 3.27Å; R100-D123 IonicContact NH2-OD1 3.4Å; R100-D123 PolarHBondContact NH2-OD1 2.93Å; R100-D123 IonicContact NH2-OD2 2.65Å
101	D	90.9	Very high	91	Very high	55 Å²	55	38.5 Å²	38.5	29%	0.294	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-71.4	-13.3	-177.3	-50.1	-35	0	0	0	112.5	I71 A77 A98 V99 G103	I71-D101 HydrophobicContact CD1-CB 3.46Å; I71-D101 VanDerWaalsContact CD1-CB 3.46Å; A77-D101 WeakPolarHBondContact CA-O 3.35Å; A77-D101 PolarHBondContact N-O 2.81Å; A98-D101 PolarHBondContact N-OD2 3.05Å; A98-D101 PolarHBondContact O-N 3.28Å; V99-D101 PolarHBondContact O-N 3.05Å; V99-D101 VanDerWaalsContact O-N 3.08Å; D101-G103 VanDerWaalsContact C-N 3.29Å
102	L	91	Very high	91.2	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-76.6	-11.8	168.3	-58.9	176.2	0	0	0	113.5	V76 F79 L89 L91 I96 V99 R100 L106 M114 F128	V76-L102 HydrophobicContact CG2-CD2 4.18Å; F79-L102 HydrophobicContact CE1-CD2 4Å; F79-L102 HydrophobicContact CZ-CD2 4.37Å; L89-L102 HydrophobicContact CD2-CD1 4.27Å; L91-L102 HydrophobicContact CD1-CD1 3.73Å; L91-L102 HydrophobicContact CD1-CD2 3.65Å; L91-L102 HydrophobicContact CD1-CG 4.35Å; I96-L102 HydrophobicContact CD1-CD2 4.21Å; V99-L102 HydrophobicContact CG1-CD1 4.29Å; V99-L102 VanDerWaalsContact O-CB 3.31Å; V99-L102 WeakPolarHBondContact O-CB 3.5Å; V99-L102 WeakPolarHBondContact O-CG 3.39Å; V99-L102 PolarHBondContact O-N 3.19Å; R100-L102 PolarHBondContact O-N 2.99Å; L102-L106 HydrophobicContact CB-CD1 3.9Å; L102-M114 HydrophobicContact CD1-CE 4.21Å; L102-M114 HydrophobicContact CD1-SD 3.98Å; L102-F128 HydrophobicContact CD1-CZ 4.15Å
103	G	89.1	Confident	91.8	Very high	9 Å²	9	40.2 Å²	40.2	9%	0.093	22%	0.215	C	C	.	.			trans	89.7	-166	177.8	0	0	0	0	0	115.7	A77 R100 D101 S127	A77-G103 WeakPolarHBondContact O-CA 3.46Å; R100-G103 PolarHBondContact O-N 2.91Å; D101-G103 VanDerWaalsContact C-N 3.29Å; G103-S127 PolarHBondContact O-OG 2.99Å
104	T	89.1	Confident	92.3	Very high	107 Å²	107	35.3 Å²	35.3	66%	0.656	19%	0.189	S	C	*	.	S	Bend	trans	-105.7	-24.1	-171.6	50	0	0	0	0	114	L106 S127	T104-L106 PolarHBondContact O-N 3.42Å; T104-S127 WeakPolarHBondContact CA-OG 3.49Å
105	C	87.4	Confident	92.4	Very high	60 Å²	60	37 Å²	37	41%	0.405	20%	0.199	S	C	.	.			trans	-82.6	41.2	-170.3	-60.7	0	0	0	0	114.3	G80	G80-C105 CarbonylContact C-O 3.33Å; G80-C105 VanDerWaalsContact CA-O 3.28Å; G80-C105 WeakPolarHBondContact CA-O 3.42Å
106	L	90.3	Very high	92.4	Very high	1 Å²	1	39 Å²	39	1%	0.005	20%	0.204	C	C	.	.			trans	-124	30.4	-172.2	-64.2	173.2	0	0	0	113.8	F79 L86 L89 L102 T104 T108 V109 F128	F79-L106 HydrophobicContact CD2-CD2 4.23Å; F79-L106 HydrophobicContact CE2-CD1 4.21Å; F79-L106 HydrophobicContact CE2-CD2 3.62Å; F79-L106 HydrophobicContact CZ-CD1 3.97Å; F79-L106 HydrophobicContact CZ-CD2 4.23Å; L86-L106 HydrophobicContact CD2-CD2 4.32Å; L89-L106 HydrophobicContact CD2-CD1 4.46Å; L102-L106 HydrophobicContact CB-CD1 3.9Å; T104-L106 PolarHBondContact O-N 3.42Å; L106-T108 PolarHBondContact O-N 3.2Å; L106-T108 VanDerWaalsContact O-N 3.14Å; L106-V109 HydrophobicContact CB-CG2 4.2Å; L106-V109 HydrophobicContact CD2-CG2 4.37Å; L106-V109 PolarHBondContact O-N 3.25Å; L106-F128 HydrophobicContact CB-CD1 3.75Å; L106-F128 HydrophobicContact CB-CE1 3.37Å; L106-F128 HydrophobicContact CB-CZ 3.97Å; L106-F128 HydrophobicContact CD1-CE1 3.58Å; L106-F128 HydrophobicContact CD1-CZ 3.58Å; L106-F128 HydrophobicContact CG-CE1 4.08Å; L106-F128 HydrophobicContact CG-CZ 4.41Å; L106-F128 WeakPolarHBondContact O-CD1 3.44Å
107	N	90.6	Very high	92.4	Very high	84 Å²	84	39 Å²	39	45%	0.449	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-6.4	-175.4	66.9	35.4	0	0	0	115.7	S127 T129 K130	N107-S127 WeakPolarHBondContact CA-O 3.32Å; N107-S127 PolarHBondContact N-O 2.73Å; N107-T129 PolarHBondContact O-OG1 2.93Å; N107-K130 WeakPolarHBondContact O-CG 3.07Å
108	T	92.9	Very high	92.3	Very high	24 Å²	24	40 Å²	40	15%	0.147	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-10.3	177.4	51.8	0	0	0	0	115	P84 L86 L106 E110	P84-T108 VanDerWaalsContact O-CG2 3.23Å; P84-T108 WeakPolarHBondContact O-CG2 3.36Å; P84-T108 PolarHBondContact O-OG1 3.3Å; L86-T108 CarbonylContact O-C 3.57Å; L86-T108 WeakPolarHBondContact O-CB 3.38Å; L86-T108 PolarHBondContact O-OG1 3.07Å; L106-T108 PolarHBondContact O-N 3.2Å; L106-T108 VanDerWaalsContact O-N 3.14Å; T108-E110 PolarHBondContact O-N 3.02Å
109	V	95.1	Very high	92.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.204	C	C	.	.			trans	-72.8	126.6	-174.1	-174.7	0	0	0	0	110.3	L86 R87 L89 L106 V111 I112 F128 K130 L131	L86-V109 HydrophobicContact CB-CG2 4.48Å; L86-V109 HydrophobicContact CD2-CG2 4.17Å; L86-V109 HydrophobicContact CG-CG2 4.15Å; L86-V109 WeakPolarHBondContact O-CA 3.44Å; L86-V109 PolarHBondContact O-N 2.91Å; R87-V109 WeakPolarHBondContact O-CG1 3.48Å; L89-V109 HydrophobicContact CB-CG1 3.99Å; L106-V109 HydrophobicContact CB-CG2 4.2Å; L106-V109 HydrophobicContact CD2-CG2 4.37Å; L106-V109 PolarHBondContact O-N 3.25Å; V109-V111 VanDerWaalsContact CG1-O 3.3Å; V109-V111 WeakPolarHBondContact CG1-O 3.27Å; V109-I112 HydrophobicContact CG1-CG1 3.75Å; V109-F128 HydrophobicContact CB-CD1 4.02Å; V109-F128 HydrophobicContact CB-CE1 4.47Å; V109-F128 HydrophobicContact CG2-CD1 4.32Å; V109-F128 HydrophobicContact CG2-CE1 4.39Å; V109-K130 CarbonylContact O-C 3.48Å; V109-L131 PolarHBondContact O-N 2.96Å
110	E	95.9	Very high	92.4	Very high	54 Å²	54	43.3 Å²	43.3	25%	0.252	23%	0.23	S	C	.	.			trans	-99.2	-30.7	-178.8	-67.4	168.1	162	0	0	111	R87 T108 V132 E133	R87-E110 WeakPolarHBondContact CD-OE2 3.37Å; R87-E110 WeakPolarHBondContact CG-OE2 3.41Å; R87-E110 IonicContact CZ-OE1 2.61Å; R87-E110 IonicContact CZ-OE2 3.57Å; R87-E110 IonicContact NE-OE2 3.23Å; R87-E110 IonicContact NH1-OE1 2.72Å; R87-E110 PolarHBondContact NH1-OE1 2.95Å; R87-E110 IonicContact NH1-OE2 2.69Å; R87-E110 PolarHBondContact NH1-OE2 3.16Å; R87-E110 PolarHBondContact O-N 3.11Å; T108-E110 PolarHBondContact O-N 3.02Å; E110-V132 PolarHBondContact O-N 3.24Å; E110-E133 PolarHBondContact O-N 3.33Å
111	V	96.5	Very high	92.4	Very high	10 Å²	10	37.9 Å²	37.9	6%	0.061	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	134	177.9	-176.4	0	0	0	0	112.3	R87 L89 V109 W113 E133 Y135	R87-V111 PolarHBondContact O-N 3.33Å; L89-V111 PolarHBondContact N-O 3.01Å; V109-V111 VanDerWaalsContact CG1-O 3.3Å; V109-V111 WeakPolarHBondContact CG1-O 3.27Å; V111-W113 HydrophobicContact CB-CH2 3.95Å; V111-W113 HydrophobicContact CB-CZ2 4.3Å; V111-W113 HydrophobicContact CB-CZ3 4.23Å; V111-W113 HydrophobicContact CG1-CD2 3.98Å; V111-W113 HydrophobicContact CG1-CE3 4.06Å; V111-W113 HydrophobicContact CG1-CH2 3.44Å; V111-W113 VanDerWaalsContact CG1-CH2 3.44Å; V111-W113 HydrophobicContact CG1-CZ2 3.34Å; V111-W113 HydrophobicContact CG1-CZ3 3.8Å; V111-E133 WeakPolarHBondContact CA-O 3.4Å; V111-E133 HydrophobicContact CB-CB 4.35Å; V111-E133 HydrophobicContact CG1-CB 3.9Å; V111-E133 HydrophobicContact CG2-CB 3.98Å; V111-E133 HydrophobicContact CG2-CG 4.04Å; V111-Y135 HydrophobicContact CG1-CD2 4.19Å; V111-Y135 HydrophobicContact CG1-CE2 4Å
112	I	95.7	Very high	92.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	128.1	174	-64	169.7	0	0	0	110.6	L89 V109 M114 F128 L131 E133 L134 Y135	L89-I112 WeakPolarHBondContact O-CA 3.23Å; V109-I112 HydrophobicContact CG1-CG1 3.75Å; I112-M114 HydrophobicContact CG2-CB 4.47Å; I112-M114 HydrophobicContact CG2-CG 3.65Å; I112-M114 HydrophobicContact CG2-SD 3.83Å; I112-F128 HydrophobicContact CD1-CD1 3.56Å; I112-F128 HydrophobicContact CD1-CD2 4.29Å; I112-F128 HydrophobicContact CD1-CE1 3.57Å; I112-F128 HydrophobicContact CD1-CE2 4.35Å; I112-F128 HydrophobicContact CD1-CG 3.89Å; I112-F128 HydrophobicContact CD1-CZ 3.99Å; I112-F128 HydrophobicContact CG1-CD1 4.49Å; I112-F128 HydrophobicContact CG1-CE1 4.43Å; I112-L131 HydrophobicContact CB-CD1 4.15Å; I112-L131 HydrophobicContact CD1-CD1 3.65Å; I112-L131 HydrophobicContact CD1-CD2 3.89Å; I112-L131 HydrophobicContact CD1-CG 4.44Å; I112-L131 HydrophobicContact CG1-CD1 3.63Å; I112-E133 PolarHBondContact N-O 2.91Å; I112-L134 HydrophobicContact CB-CD1 3.99Å; I112-L134 HydrophobicContact CG2-CD1 4.02Å; I112-Y135 PolarHBondContact O-N 3.04Å
113	W	95.5	Very high	92.6	Very high	66 Å²	66	38.4 Å²	38.4	25%	0.25	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	113.8	163.3	-56.9	-87.6	0	0	0	109.9	H88 L89 R90 L91 V111 Y135	H88-W113 HydrophobicContact CB-CH2 4.33Å; H88-W113 HydrophobicContact CB-CZ3 3.94Å; L89-W113 PolarHBondContact O-N 3.38Å; R90-W113 HydrophobicContact CB-CB 4.48Å; R90-W113 HydrophobicContact CB-CE3 3.98Å; R90-W113 HydrophobicContact CG-CB 4.33Å; L91-W113 PolarHBondContact N-O 3.41Å; V111-W113 HydrophobicContact CB-CH2 3.95Å; V111-W113 HydrophobicContact CB-CZ2 4.3Å; V111-W113 HydrophobicContact CB-CZ3 4.23Å; V111-W113 HydrophobicContact CG1-CD2 3.98Å; V111-W113 HydrophobicContact CG1-CE3 4.06Å; V111-W113 HydrophobicContact CG1-CH2 3.44Å; V111-W113 VanDerWaalsContact CG1-CH2 3.44Å; V111-W113 HydrophobicContact CG1-CZ2 3.34Å; V111-W113 HydrophobicContact CG1-CZ3 3.8Å; W113-Y135 AromaticContact CD1-CD2 3.3Å; W113-Y135 AromaticContact CD1-CG 3.51Å; W113-Y135 HydrophobicContact CG-CD2 4.12Å; W113-Y135 HydrophobicContact CG-CG 4.48Å; W113-Y135 AromaticContact NE1-CD2 3.23Å; W113-Y135 AromaticContact NE1-CE2 3.44Å; W113-Y135 AromaticContact NE1-CG 3.81Å
114	M	94.5	Very high	92.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.218	C	C	.	.			trans	-123.1	48.3	171.6	-71.4	174.9	75.9	0	0	112.5	L91 I96 V99 L102 I112 C117 L119 Y135 V136 N139	L91-M114 HydrophobicContact CB-CG 3.99Å; L91-M114 HydrophobicContact CD1-CE 4.41Å; L91-M114 HydrophobicContact CD1-CG 3.85Å; L91-M114 HydrophobicContact CD1-SD 4.18Å; L91-M114 WeakPolarHBondContact O-CA 3.39Å; I96-M114 HydrophobicContact CB-CE 4.09Å; I96-M114 HydrophobicContact CD1-CE 4.12Å; I96-M114 HydrophobicContact CG2-CE 3.66Å; V99-M114 HydrophobicContact CG2-SD 4.46Å; L102-M114 HydrophobicContact CD1-CE 4.21Å; L102-M114 HydrophobicContact CD1-SD 3.98Å; I112-M114 HydrophobicContact CG2-CB 4.47Å; I112-M114 HydrophobicContact CG2-CG 3.65Å; I112-M114 HydrophobicContact CG2-SD 3.83Å; M114-C117 VanDerWaalsContact C-SG 3.55Å; M114-C117 HydrophobicContact CB-CB 4.28Å; M114-L119 HydrophobicContact CE-CD1 3.98Å; M114-L119 HydrophobicContact CE-CD2 4.12Å; M114-Y135 PolarHBondContact N-O 3.03Å; M114-V136 HydrophobicContact CB-CG1 4.25Å; M114-N139 PolarHBondContact O-ND2 3.29Å
115	P	92.1	Very high	92.9	Very high	39 Å²	39	33.4 Å²	33.4	25%	0.253	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	140.5	177.7	30.7	-36	0	0	0	111.1	N93 C117 A137	N93-P115 PolarHBondContact N-O 3.12Å; P115-C117 VanDerWaalsContact C-N 3.27Å; P115-C117 PolarHBondContact O-N 3.13Å; P115-C117 PolarHBondContact O-SG 2.99Å; P115-A137 WeakPolarHBondContact CA-O 3.38Å
116	R	91.5	Very high	93	Very high	82 Å²	82	33.3 Å²	33.3	31%	0.309	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	41.4	175.2	-59.7	175.3	169.3	-132.9	-4.6	113.6	A137 F138 E419	R116-A137 PolarHBondContact N-O 3.36Å; R116-F138 HydrophobicContact CG-CB 3.76Å; R116-E419 IonicContact CZ-OE1 2.68Å; R116-E419 IonicContact CZ-OE2 3.8Å; R116-E419 IonicContact NH1-OE1 2.68Å; R116-E419 PolarHBondContact NH1-OE1 2.81Å; R116-E419 IonicContact NH1-OE2 2.77Å; R116-E419 PolarHBondContact NH1-OE2 2.99Å; R116-E419 VanDerWaalsContact NH1-OE2 3.17Å; R116-E419 IonicContact NH2-OE1 3.11Å; R116-E419 IonicContact NH2-OE2 3.74Å; R116-E419 PolarHBondContact NH2-OE2 3Å
117	C	92.3	Very high	93	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	-94.3	8.2	-175.3	-77.7	0	0	0	0	114.9	L91 S94 I96 M114 P115 L119 N139	L91-C117 PolarHBondContact O-SG 2.87Å; S94-C117 CarbonylContact O-C 3.5Å; S94-C117 WeakPolarHBondContact O-CA 3.36Å; I96-C117 PolarHBondContact N-O 3.14Å; M114-C117 VanDerWaalsContact C-SG 3.55Å; M114-C117 HydrophobicContact CB-CB 4.28Å; P115-C117 VanDerWaalsContact C-N 3.27Å; P115-C117 PolarHBondContact O-N 3.13Å; P115-C117 PolarHBondContact O-SG 2.99Å; C117-L119 HydrophobicContact CB-CB 4.49Å; C117-L119 PolarHBondContact O-N 3.07Å; C117-N139 WeakPolarHBondContact CA-OD1 3.37Å; C117-N139 PolarHBondContact N-OD1 3.2Å
118	C	91.2	Very high	93.1	Very high	81 Å²	81	30.1 Å²	30.1	55%	0.547	17%	0.171	S	C	.	.			trans	57.4	23.4	-169	-63.9	0	0	0	0	113.9	V120 N139	C118-V120 PolarHBondContact O-N 3.19Å; C118-N139 PolarHBondContact N-OD1 3.25Å
119	L	93.7	Very high	93	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.187	C	C	.	.			trans	-69.2	122.1	-173.3	-170	65.4	0	0	0	110.9	I96 V99 M114 C117 S121 L122 V136 N139 G140 V141	I96-L119 WeakPolarHBondContact O-CA 3.43Å; I96-L119 VanDerWaalsContact O-CD1 3.25Å; I96-L119 WeakPolarHBondContact O-CD1 3.46Å; V99-L119 HydrophobicContact CG2-CD1 3.85Å; V99-L119 HydrophobicContact CG2-CD2 3.92Å; V99-L119 HydrophobicContact CG2-CG 4.43Å; M114-L119 HydrophobicContact CE-CD1 3.98Å; M114-L119 HydrophobicContact CE-CD2 4.12Å; C117-L119 HydrophobicContact CB-CB 4.49Å; C117-L119 PolarHBondContact O-N 3.07Å; L119-S121 WeakPolarHBondContact CD1-O 3.31Å; L119-L122 HydrophobicContact CD2-CD2 3.7Å; L119-L122 HydrophobicContact CG-CD2 4.42Å; L119-V136 HydrophobicContact CD2-CB 4.47Å; L119-V136 HydrophobicContact CD2-CG1 3.9Å; L119-N139 HydrophobicContact CB-CB 3.97Å; L119-N139 WeakPolarHBondContact CB-OD1 3.36Å; L119-N139 PolarHBondContact N-OD1 3.05Å; L119-G140 CarbonylContact O-C 3.45Å; L119-G140 VanDerWaalsContact O-CA 3.32Å; L119-G140 WeakPolarHBondContact O-CA 3.17Å; L119-G140 PolarHBondContact O-N 3.41Å; L119-V141 HydrophobicContact CD2-CG2 4.4Å; L119-V141 HydrophobicContact CG-CG2 4.35Å; L119-V141 PolarHBondContact O-N 3.36Å
120	V	93.1	Very high	93	Very high	89 Å²	89	37.4 Å²	37.4	54%	0.539	21%	0.208	S	C	.	.			trans	-106.6	-39.3	-179.3	-177.7	0	0	0	0	111.3	P97 C118	P97-V120 PolarHBondContact O-N 3.34Å; C118-V120 PolarHBondContact O-N 3.19Å
121	S	92.8	Very high	93	Very high	34 Å²	34	34.9 Å²	34.9	24%	0.238	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-117.5	141.1	176	-169.7	0	0	0	0	112.8	P97 A98 V99 L119 D123	P97-S121 PolarHBondContact O-N 3.17Å; A98-S121 WeakPolarHBondContact CA-O 3.45Å; V99-S121 PolarHBondContact N-O 3.22Å; L119-S121 WeakPolarHBondContact CD1-O 3.31Å; S121-D123 VanDerWaalsContact C-N 3.26Å; S121-D123 WeakPolarHBondContact OG-CB 3.49Å; S121-D123 PolarHBondContact OG-N 2.97Å; S121-D123 VanDerWaalsContact OG-N 3.09Å; S121-D123 PolarHBondContact OG-OD2 3.4Å
122	L	93.9	Very high	93	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	21%	0.205	C	C	.	.			trans	-86.4	5.7	169.5	-65.5	-173.5	0	0	0	113.1	V99 L119 G124 L125 V136 V141 L144 P146 C147	V99-L122 HydrophobicContact CG2-CD2 4.13Å; L119-L122 HydrophobicContact CD2-CD2 3.7Å; L119-L122 HydrophobicContact CG-CD2 4.42Å; L122-G124 PolarHBondContact O-N 3.49Å; L122-L125 HydrophobicContact CB-CD1 3.75Å; L122-L125 HydrophobicContact CB-CG 4.45Å; L122-L125 HydrophobicContact CD1-CD1 4.15Å; L122-L125 HydrophobicContact CD2-CD1 4.34Å; L122-L125 HydrophobicContact CG-CD1 4.3Å; L122-L125 WeakPolarHBondContact O-CG 3.02Å; L122-L125 PolarHBondContact O-N 3.41Å; L122-V136 HydrophobicContact CD2-CG1 4.44Å; L122-V141 HydrophobicContact CD1-CG1 3.79Å; L122-V141 HydrophobicContact CD2-CG1 4.41Å; L122-V141 HydrophobicContact CD2-CG2 3.9Å; L122-V141 HydrophobicContact CG-CG1 3.75Å; L122-V141 HydrophobicContact CG-CG2 4.11Å; L122-L144 HydrophobicContact CD1-CD2 3.9Å; L122-P146 HydrophobicContact CB-CB 4.01Å; L122-P146 HydrophobicContact CB-CG 3.97Å; L122-P146 VanDerWaalsContact O-CB 3.23Å; L122-P146 WeakPolarHBondContact O-CB 3.44Å; L122-C147 VanDerWaalsContact CD1-SG 3.56Å
123	D	92.6	Very high	93	Very high	66 Å²	66	39.2 Å²	39.2	35%	0.353	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46	131	169.9	-86.1	-59.4	0	0	0	111.8	V99 R100 S121	V99-D123 CarbonylContact C-O 3.35Å; V99-D123 WeakPolarHBondContact CB-O 3.42Å; V99-D123 PolarHBondContact N-O 2.86Å; R100-D123 WeakPolarHBondContact CB-O 3.5Å; R100-D123 PolarHBondContact N-O 3.19Å; R100-D123 VanDerWaalsContact NH2-CG 3.27Å; R100-D123 IonicContact NH2-OD1 3.4Å; R100-D123 PolarHBondContact NH2-OD1 2.93Å; R100-D123 IonicContact NH2-OD2 2.65Å; S121-D123 VanDerWaalsContact C-N 3.26Å; S121-D123 WeakPolarHBondContact OG-CB 3.49Å; S121-D123 PolarHBondContact OG-N 2.97Å; S121-D123 VanDerWaalsContact OG-N 3.09Å; S121-D123 PolarHBondContact OG-OD2 3.4Å
124	G	90.1	Very high	93.1	Very high	10 Å²	10	36.1 Å²	36.1	10%	0.103	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.4	-2.4	-179.7	0	0	0	0	0	115.4	L122 S126 S127	L122-G124 PolarHBondContact O-N 3.49Å; G124-S126 PolarHBondContact O-N 2.8Å; G124-S126 VanDerWaalsContact O-N 3.1Å; G124-S127 PolarHBondContact O-N 2.96Å; G124-S127 PolarHBondContact O-OG 3.34Å
125	L	93	Very high	93.1	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-57.3	-21.3	170.3	-80.9	174	0	0	0	113.7	V99 L122 S127 F128 L131 L134 L150	V99-L125 HydrophobicContact CG1-CD2 4.1Å; V99-L125 HydrophobicContact CG1-CG 4.36Å; V99-L125 HydrophobicContact CG2-CG 4.42Å; L122-L125 HydrophobicContact CB-CD1 3.75Å; L122-L125 HydrophobicContact CB-CG 4.45Å; L122-L125 HydrophobicContact CD1-CD1 4.15Å; L122-L125 HydrophobicContact CD2-CD1 4.34Å; L122-L125 HydrophobicContact CG-CD1 4.3Å; L122-L125 WeakPolarHBondContact O-CG 3.02Å; L122-L125 PolarHBondContact O-N 3.41Å; L125-S127 PolarHBondContact O-N 2.9Å; L125-S127 VanDerWaalsContact O-N 3.14Å; L125-F128 HydrophobicContact CD2-CD2 4.46Å; L125-F128 PolarHBondContact O-N 3.49Å; L125-F128 VanDerWaalsContact O-N 3.08Å; L125-L131 HydrophobicContact CD2-CD2 3.96Å; L125-L134 HydrophobicContact CD1-CD2 3.9Å; L125-L134 HydrophobicContact CD2-CD1 4.3Å; L125-L134 HydrophobicContact CD2-CD2 4.04Å; L125-L150 HydrophobicContact CB-CD1 4.31Å; L125-L150 HydrophobicContact CB-CD2 4.38Å; L125-L150 HydrophobicContact CD1-CD1 4.04Å; L125-L150 HydrophobicContact CD2-CD1 4.4Å; L125-L150 HydrophobicContact CG-CD1 4.5Å; L125-L150 WeakPolarHBondContact O-CD2 3.39Å
126	S	89.9	Confident	93.3	Very high	58 Å²	58	36.9 Å²	36.9	41%	0.406	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-56.4	-23.7	174.5	51.9	0	0	0	0	114.9	G124 F128	G124-S126 PolarHBondContact O-N 2.8Å; G124-S126 VanDerWaalsContact O-N 3.1Å; S126-F128 PolarHBondContact O-N 2.82Å
127	S	90.2	Very high	93.4	Very high	17 Å²	17	33.3 Å²	33.3	12%	0.119	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-65	-24.3	175.4	-54.7	0	0	0	0	113.4	G103 T104 N107 G124 L125 T129	G103-S127 PolarHBondContact O-OG 2.99Å; T104-S127 WeakPolarHBondContact CA-OG 3.49Å; N107-S127 WeakPolarHBondContact CA-O 3.32Å; N107-S127 PolarHBondContact N-O 2.73Å; G124-S127 PolarHBondContact O-N 2.96Å; G124-S127 PolarHBondContact O-OG 3.34Å; L125-S127 PolarHBondContact O-N 2.9Å; L125-S127 VanDerWaalsContact O-N 3.14Å; S127-T129 PolarHBondContact O-N 3.16Å
128	F	93.4	Very high	93.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.212	C	C	.	.			trans	-102.1	62.7	-165.3	-57.8	-90.7	0	0	0	111.9	V99 L102 L106 V109 I112 L125 S126 K130 L131	V99-F128 HydrophobicContact CG1-CD2 4.46Å; V99-F128 HydrophobicContact CG1-CE2 3.63Å; V99-F128 HydrophobicContact CG1-CZ 4.24Å; L102-F128 HydrophobicContact CD1-CZ 4.15Å; L106-F128 HydrophobicContact CB-CD1 3.75Å; L106-F128 HydrophobicContact CB-CE1 3.37Å; L106-F128 HydrophobicContact CB-CZ 3.97Å; L106-F128 HydrophobicContact CD1-CE1 3.58Å; L106-F128 HydrophobicContact CD1-CZ 3.58Å; L106-F128 HydrophobicContact CG-CE1 4.08Å; L106-F128 HydrophobicContact CG-CZ 4.41Å; L106-F128 WeakPolarHBondContact O-CD1 3.44Å; V109-F128 HydrophobicContact CB-CD1 4.02Å; V109-F128 HydrophobicContact CB-CE1 4.47Å; V109-F128 HydrophobicContact CG2-CD1 4.32Å; V109-F128 HydrophobicContact CG2-CE1 4.39Å; I112-F128 HydrophobicContact CD1-CD1 3.56Å; I112-F128 HydrophobicContact CD1-CD2 4.29Å; I112-F128 HydrophobicContact CD1-CE1 3.57Å; I112-F128 HydrophobicContact CD1-CE2 4.35Å; I112-F128 HydrophobicContact CD1-CG 3.89Å; I112-F128 HydrophobicContact CD1-CZ 3.99Å; I112-F128 HydrophobicContact CG1-CD1 4.49Å; I112-F128 HydrophobicContact CG1-CE1 4.43Å; L125-F128 HydrophobicContact CD2-CD2 4.46Å; L125-F128 PolarHBondContact O-N 3.49Å; L125-F128 VanDerWaalsContact O-N 3.08Å; S126-F128 PolarHBondContact O-N 2.82Å; F128-K130 PolarHBondContact O-N 3.14Å; F128-L131 HydrophobicContact CB-CB 3.99Å; F128-L131 HydrophobicContact CB-CD2 4.25Å; F128-L131 WeakPolarHBondContact O-CB 3.38Å; F128-L131 PolarHBondContact O-N 3.29Å
129	T	90.8	Very high	93.6	Very high	80 Å²	80	34.7 Å²	34.7	49%	0.491	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-16.1	-171.1	62.9	0	0	0	0	115.3	N107 S127 N152	N107-T129 PolarHBondContact O-OG1 2.93Å; S127-T129 PolarHBondContact O-N 3.16Å; T129-N152 PolarHBondContact O-ND2 2.59Å
130	K	93.7	Very high	93.5	Very high	98 Å²	98	35.5 Å²	35.5	43%	0.426	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	9.5	178.1	-65.1	-177.1	-168	163.8	0	114.7	N107 V109 F128 V132	N107-K130 WeakPolarHBondContact O-CG 3.07Å; V109-K130 CarbonylContact O-C 3.48Å; F128-K130 PolarHBondContact O-N 3.14Å; K130-V132 WeakPolarHBondContact O-CG2 3.3Å; K130-V132 PolarHBondContact O-N 2.92Å
131	L	96.1	Very high	93.6	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	17%	0.173	C	C	.	.			trans	-63.3	123.5	-176.1	-168	60.8	0	0	0	111.9	V109 I112 L125 F128 E133 L134 L150 N152 I153	V109-L131 PolarHBondContact O-N 2.96Å; I112-L131 HydrophobicContact CB-CD1 4.15Å; I112-L131 HydrophobicContact CD1-CD1 3.65Å; I112-L131 HydrophobicContact CD1-CD2 3.89Å; I112-L131 HydrophobicContact CD1-CG 4.44Å; I112-L131 HydrophobicContact CG1-CD1 3.63Å; L125-L131 HydrophobicContact CD2-CD2 3.96Å; F128-L131 HydrophobicContact CB-CB 3.99Å; F128-L131 HydrophobicContact CB-CD2 4.25Å; F128-L131 WeakPolarHBondContact O-CB 3.38Å; F128-L131 PolarHBondContact O-N 3.29Å; L131-E133 WeakPolarHBondContact CD1-O 3.36Å; L131-L134 HydrophobicContact CD2-CB 4.27Å; L131-L134 HydrophobicContact CD2-CD1 4.34Å; L131-L150 HydrophobicContact CB-CD2 4.3Å; L131-L150 HydrophobicContact CD2-CD1 4.01Å; L131-L150 HydrophobicContact CD2-CD2 4.27Å; L131-N152 CarbonylContact O-C 3.56Å; L131-N152 WeakPolarHBondContact O-CB 3.33Å; L131-I153 HydrophobicContact CD2-CD1 4.4Å; L131-I153 HydrophobicContact CG-CD1 4.46Å; L131-I153 WeakPolarHBondContact O-CA 3.25Å; L131-I153 PolarHBondContact O-N 3.4Å
132	V	96.3	Very high	93.6	Very high	42 Å²	42	32.4 Å²	32.4	26%	0.255	18%	0.181	S	C	.	.			trans	-108.2	-38	179	-174.8	0	0	0	0	111.1	E110 K130 I153 E154 V155	E110-V132 PolarHBondContact O-N 3.24Å; K130-V132 WeakPolarHBondContact O-CG2 3.3Å; K130-V132 PolarHBondContact O-N 2.92Å; V132-I153 WeakPolarHBondContact O-CG1 3.34Å; V132-E154 HydrophobicContact CG1-CB 3.93Å; V132-E154 HydrophobicContact CG1-CG 4.01Å; V132-E154 PolarHBondContact O-N 2.95Å; V132-V155 PolarHBondContact O-N 2.9Å; V132-V155 VanDerWaalsContact O-N 3.07Å
133	E	96.9	Very high	93.5	Very high	59 Å²	59	35.5 Å²	35.5	28%	0.276	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	128.9	-178.8	-48.3	-177.9	158.5	0	0	111.6	E110 V111 I112 L131 Y135 V155	E110-E133 PolarHBondContact O-N 3.33Å; V111-E133 WeakPolarHBondContact CA-O 3.4Å; V111-E133 HydrophobicContact CB-CB 4.35Å; V111-E133 HydrophobicContact CG1-CB 3.9Å; V111-E133 HydrophobicContact CG2-CB 3.98Å; V111-E133 HydrophobicContact CG2-CG 4.04Å; I112-E133 PolarHBondContact N-O 2.91Å; L131-E133 WeakPolarHBondContact CD1-O 3.36Å; E133-Y135 HydrophobicContact CB-CD2 4.4Å; E133-Y135 HydrophobicContact CB-CE2 3.7Å; E133-Y135 PolarHBondContact OE2-OH 2.58Å; E133-V155 WeakPolarHBondContact CA-O 3.33Å; E133-V155 HydrophobicContact CB-CB 4.13Å; E133-V155 HydrophobicContact CG-CB 3.99Å; E133-V155 HydrophobicContact CG-CG2 4.08Å
134	L	96.3	Very high	93.6	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	113.4	178.1	179.4	61.9	0	0	0	110.9	I112 L125 L131 V136 I153 V155 D157	I112-L134 HydrophobicContact CB-CD1 3.99Å; I112-L134 HydrophobicContact CG2-CD1 4.02Å; L125-L134 HydrophobicContact CD1-CD2 3.9Å; L125-L134 HydrophobicContact CD2-CD1 4.3Å; L125-L134 HydrophobicContact CD2-CD2 4.04Å; L131-L134 HydrophobicContact CD2-CB 4.27Å; L131-L134 HydrophobicContact CD2-CD1 4.34Å; L134-V136 HydrophobicContact CD1-CG1 3.69Å; L134-V136 HydrophobicContact CD2-CG1 4.48Å; L134-V136 HydrophobicContact CG-CG1 3.94Å; L134-V136 HydrophobicContact CG-CG2 4.41Å; L134-I153 HydrophobicContact CB-CD1 3.69Å; L134-I153 HydrophobicContact CD2-CD1 4.42Å; L134-V155 PolarHBondContact N-O 2.82Å; L134-D157 PolarHBondContact O-N 3Å
135	Y	96	Very high	93.7	Very high	55 Å²	55	34 Å²	34	22%	0.216	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	103.7	177.9	-59.6	-92.7	0	0	0	110.8	V111 I112 W113 M114 E133 V155 D157	V111-Y135 HydrophobicContact CG1-CD2 4.19Å; V111-Y135 HydrophobicContact CG1-CE2 4Å; I112-Y135 PolarHBondContact O-N 3.04Å; W113-Y135 AromaticContact CD1-CD2 3.3Å; W113-Y135 AromaticContact CD1-CG 3.51Å; W113-Y135 HydrophobicContact CG-CD2 4.12Å; W113-Y135 HydrophobicContact CG-CG 4.48Å; W113-Y135 AromaticContact NE1-CD2 3.23Å; W113-Y135 AromaticContact NE1-CE2 3.44Å; W113-Y135 AromaticContact NE1-CG 3.81Å; M114-Y135 PolarHBondContact N-O 3.03Å; E133-Y135 HydrophobicContact CB-CD2 4.4Å; E133-Y135 HydrophobicContact CB-CE2 3.7Å; E133-Y135 PolarHBondContact OE2-OH 2.58Å; Y135-V155 HydrophobicContact CE1-CG1 4.48Å; Y135-D157 HydrophobicContact CD1-CB 3.55Å; Y135-D157 HydrophobicContact CE1-CB 4.2Å; Y135-D157 HydrophobicContact CG-CB 4.3Å
136	V	95.1	Very high	93.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.196	C	C	.	.			trans	-123.4	33.2	-175.9	-71.4	0	0	0	0	112.1	M114 L119 L122 L134 N139 D157 L158 N161	M114-V136 HydrophobicContact CB-CG1 4.25Å; L119-V136 HydrophobicContact CD2-CB 4.47Å; L119-V136 HydrophobicContact CD2-CG1 3.9Å; L122-V136 HydrophobicContact CD2-CG1 4.44Å; L134-V136 HydrophobicContact CD1-CG1 3.69Å; L134-V136 HydrophobicContact CD2-CG1 4.48Å; L134-V136 HydrophobicContact CG-CG1 3.94Å; L134-V136 HydrophobicContact CG-CG2 4.41Å; V136-N139 VanDerWaalsContact C-ND2 3.3Å; V136-N139 PolarHBondContact O-ND2 2.76Å; V136-D157 VanDerWaalsContact CG2-O 3.22Å; V136-D157 WeakPolarHBondContact CG2-O 3.12Å; V136-D157 PolarHBondContact N-O 3.38Å; V136-L158 HydrophobicContact CG2-CD2 3.51Å; V136-L158 HydrophobicContact CG2-CG 4.09Å; V136-N161 PolarHBondContact O-ND2 2.87Å
137	A	93.5	Very high	93.7	Very high	6 Å²	6	32 Å²	32	5%	0.05	18%	0.177	C	C	.	.			trans	-59.9	147.5	179.3	0	0	0	0	0	114.6	P115 R116 N139 D157 E159	P115-A137 WeakPolarHBondContact CA-O 3.38Å; R116-A137 PolarHBondContact N-O 3.36Å; A137-N139 PolarHBondContact O-ND2 3.08Å; A137-D157 WeakPolarHBondContact CB-OD2 3.47Å; A137-E159 CarbonylContact C-O 3.59Å; A137-E159 VanDerWaalsContact CA-O 3.26Å; A137-E159 WeakPolarHBondContact CA-O 3.47Å; A137-E159 HydrophobicContact CB-CB 4.06Å
138	F	93.6	Very high	93.7	Very high	96 Å²	96	33.6 Å²	33.6	42%	0.421	19%	0.185	S	C	.	.	S	Bend	trans	56.3	46.9	177.9	-55.2	-79.5	0	0	0	113.9	R116 E159	R116-F138 HydrophobicContact CG-CB 3.76Å; F138-E159 HydrophobicContact CE2-CG 4.48Å; F138-E159 HydrophobicContact CZ-CG 4.1Å; F138-E159 WeakPolarHBondContact CZ-OE1 2.97Å; F138-E159 PolarHBondContact N-O 3.09Å
139	N	94.7	Very high	93.4	Very high	14 Å²	14	39.3 Å²	39.3	8%	0.075	21%	0.213	C	C	.	.	S	Bend	trans	-116.6	-176.2	175.9	-76.9	-60	0	0	0	111.8	M114 C117 C118 L119 V136 A137 V141 N161	M114-N139 PolarHBondContact O-ND2 3.29Å; C117-N139 WeakPolarHBondContact CA-OD1 3.37Å; C117-N139 PolarHBondContact N-OD1 3.2Å; C118-N139 PolarHBondContact N-OD1 3.25Å; L119-N139 HydrophobicContact CB-CB 3.97Å; L119-N139 WeakPolarHBondContact CB-OD1 3.36Å; L119-N139 PolarHBondContact N-OD1 3.05Å; V136-N139 VanDerWaalsContact C-ND2 3.3Å; V136-N139 PolarHBondContact O-ND2 2.76Å; A137-N139 PolarHBondContact O-ND2 3.08Å; N139-V141 HydrophobicContact CB-CG2 4.27Å; N139-N161 WeakPolarHBondContact CA-OD1 3.15Å; N139-N161 WeakPolarHBondContact CB-OD1 3.15Å; N139-N161 PolarHBondContact O-OD1 3.21Å
140	G	92.6	Very high	93.4	Very high	18 Å²	18	35.7 Å²	35.7	19%	0.186	19%	0.191	C	C	.	.			trans	-97.2	15.3	179.7	0	0	0	0	0	114.8	L119 S142	L119-G140 CarbonylContact O-C 3.45Å; L119-G140 VanDerWaalsContact O-CA 3.32Å; L119-G140 WeakPolarHBondContact O-CA 3.17Å; L119-G140 PolarHBondContact O-N 3.41Å; G140-S142 PolarHBondContact O-N 2.93Å
141	V	94.4	Very high	93.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.203	C	C	.	.			trans	-65.5	132.9	-172.4	-179.6	0	0	0	0	110.9	L119 L122 N139 D143 L144 L158 N161 L162 I163	L119-V141 HydrophobicContact CD2-CG2 4.4Å; L119-V141 HydrophobicContact CG-CG2 4.35Å; L119-V141 PolarHBondContact O-N 3.36Å; L122-V141 HydrophobicContact CD1-CG1 3.79Å; L122-V141 HydrophobicContact CD2-CG1 4.41Å; L122-V141 HydrophobicContact CD2-CG2 3.9Å; L122-V141 HydrophobicContact CG-CG1 3.75Å; L122-V141 HydrophobicContact CG-CG2 4.11Å; N139-V141 HydrophobicContact CB-CG2 4.27Å; V141-D143 WeakPolarHBondContact CG1-O 3.47Å; V141-L144 HydrophobicContact CG1-CD2 3.96Å; V141-L158 HydrophobicContact CG1-CD2 4.41Å; V141-N161 HydrophobicContact CB-CB 4.38Å; V141-N161 VanDerWaalsContact CB-OD1 3.28Å; V141-N161 WeakPolarHBondContact CB-OD1 3.4Å; V141-N161 WeakPolarHBondContact CG2-OD1 3.29Å; V141-N161 PolarHBondContact N-OD1 3.34Å; V141-N161 VanDerWaalsContact N-OD1 3.13Å; V141-L162 CarbonylContact O-C 3.21Å; V141-L162 VanDerWaalsContact O-C 3.29Å; V141-L162 VanDerWaalsContact O-CA 3.3Å; V141-L162 WeakPolarHBondContact O-CA 3.28Å; V141-L162 PolarHBondContact O-N 3.16Å; V141-I163 PolarHBondContact O-N 3.47Å
142	S	92.4	Very high	93	Very high	58 Å²	58	39.6 Å²	39.6	41%	0.406	22%	0.217	S	C	.	.			trans	-131.1	-31.6	-179.5	50.4	0	0	0	0	114.1	G140 S168	G140-S142 PolarHBondContact O-N 2.93Å; S142-S168 PolarHBondContact O-OG 2.71Å
143	D	92.3	Very high	93	Very high	66 Å²	66	37.7 Å²	37.7	35%	0.353	21%	0.205	S	C	.	.			trans	-100.6	146.7	167.8	-172.4	25.7	0	0	0	111.5	V141 S145 Y171	V141-D143 WeakPolarHBondContact CG1-O 3.47Å; D143-S145 PolarHBondContact OD1-N 3.13Å; D143-S145 VanDerWaalsContact OD2-CB 3.27Å; D143-S145 WeakPolarHBondContact OD2-CB 3.37Å; D143-S145 PolarHBondContact OD2-OG 2.98Å; D143-Y171 WeakPolarHBondContact OD1-CE2 3.42Å
144	L	93.6	Very high	92.9	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.211	C	C	.	.			trans	-122.1	7.5	178.9	-57.6	178	0	0	0	112.2	L122 V141 P146 C147 L158 I163 L169 L172	L122-L144 HydrophobicContact CD1-CD2 3.9Å; V141-L144 HydrophobicContact CG1-CD2 3.96Å; L144-P146 VanDerWaalsContact C-N 3.28Å; L144-C147 WeakPolarHBondContact O-CB 3.31Å; L144-C147 PolarHBondContact O-N 3Å; L144-C147 VanDerWaalsContact O-N 3.07Å; L144-L158 HydrophobicContact CD1-CD1 4.14Å; L144-L158 HydrophobicContact CD2-CD1 3.84Å; L144-L158 HydrophobicContact CD2-CD2 3.94Å; L144-I163 HydrophobicContact CD1-CD1 4Å; L144-I163 HydrophobicContact CD1-CG1 4.46Å; L144-I163 HydrophobicContact CD2-CD1 4.3Å; L144-I163 HydrophobicContact CG-CD1 4.5Å; L144-L169 HydrophobicContact CD1-CD2 4.15Å; L144-L172 HydrophobicContact CD1-CD1 3.96Å; L144-L172 HydrophobicContact CD1-CD2 4.34Å; L144-L172 HydrophobicContact CD1-CG 4.06Å
145	S	92.5	Very high	92.9	Very high	45 Å²	45	40.1 Å²	40.1	32%	0.315	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-54.5	-32.3	176.9	73.5	0	0	0	0	114.8	D143 C147 V148	D143-S145 PolarHBondContact OD1-N 3.13Å; D143-S145 VanDerWaalsContact OD2-CB 3.27Å; D143-S145 WeakPolarHBondContact OD2-CB 3.37Å; D143-S145 PolarHBondContact OD2-OG 2.98Å; S145-C147 VanDerWaalsContact C-N 3.27Å; S145-C147 PolarHBondContact O-N 2.66Å; S145-V148 WeakPolarHBondContact O-CB 3.31Å; S145-V148 VanDerWaalsContact O-CG2 3.28Å; S145-V148 WeakPolarHBondContact O-CG2 3.25Å; S145-V148 PolarHBondContact O-N 3.26Å
146	P	91.5	Very high	92.8	Very high	17 Å²	17	37.6 Å²	37.6	11%	0.11	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-67.5	-22.6	176.2	-23.3	37.2	0	0	0	114.3	L122 L144 V148 M149	L122-P146 HydrophobicContact CB-CB 4.01Å; L122-P146 HydrophobicContact CB-CG 3.97Å; L122-P146 VanDerWaalsContact O-CB 3.23Å; L122-P146 WeakPolarHBondContact O-CB 3.44Å; L144-P146 VanDerWaalsContact C-N 3.28Å; P146-V148 PolarHBondContact O-N 3.23Å; P146-M149 PolarHBondContact O-N 3.34Å
147	C	91.7	Very high	92.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-66.6	-17.5	179	-60.4	0	0	0	0	113.1	L122 L144 S145 M149 L150 L172 C175	L122-C147 VanDerWaalsContact CD1-SG 3.56Å; L144-C147 WeakPolarHBondContact O-CB 3.31Å; L144-C147 PolarHBondContact O-N 3Å; L144-C147 VanDerWaalsContact O-N 3.07Å; S145-C147 VanDerWaalsContact C-N 3.27Å; S145-C147 PolarHBondContact O-N 2.66Å; C147-M149 PolarHBondContact O-N 2.92Å; C147-L150 WeakPolarHBondContact O-CB 3.43Å; C147-L150 PolarHBondContact O-N 3.2Å; C147-L150 VanDerWaalsContact O-N 3.16Å; C147-L172 HydrophobicContact CB-CD2 3.94Å; C147-C175 PolarHBondContact O-SG 3.31Å
148	V	89.9	Confident	92.9	Very high	50 Å²	50	38.6 Å²	38.6	30%	0.303	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-60.1	-25.2	179.5	176	0	0	0	0	112.5	S145 P146 L150 Y171 L174	S145-V148 WeakPolarHBondContact O-CB 3.31Å; S145-V148 VanDerWaalsContact O-CG2 3.28Å; S145-V148 WeakPolarHBondContact O-CG2 3.25Å; S145-V148 PolarHBondContact O-N 3.26Å; P146-V148 PolarHBondContact O-N 3.23Å; V148-L150 VanDerWaalsContact C-N 3.27Å; V148-L150 PolarHBondContact O-N 3.38Å; V148-Y171 HydrophobicContact CG2-CD1 4.02Å; V148-Y171 HydrophobicContact CG2-CG 4.19Å; V148-L174 HydrophobicContact CB-CD1 4.37Å; V148-L174 HydrophobicContact CG1-CB 4.13Å; V148-L174 HydrophobicContact CG1-CD1 3.49Å; V148-L174 VanDerWaalsContact CG1-CD1 3.49Å; V148-L174 HydrophobicContact CG1-CG 4.44Å; V148-L174 HydrophobicContact CG2-CD1 3.92Å
149	M	87.4	Confident	92.9	Very high	119 Å²	119	37.7 Å²	37.7	59%	0.586	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-84	4.9	-178.9	-58.5	-174.8	71.5	0	0	114	P146 C147	P146-M149 PolarHBondContact O-N 3.34Å; C147-M149 PolarHBondContact O-N 2.92Å
150	L	91.7	Very high	92.8	Very high	5 Å²	5	38.1 Å²	38.1	3%	0.026	22%	0.218	C	C	.	.			trans	-103.1	78.7	-175	-60.5	177.8	0	0	0	112.1	L125 L131 C147 V148 N152 I153	L125-L150 HydrophobicContact CB-CD1 4.31Å; L125-L150 HydrophobicContact CB-CD2 4.38Å; L125-L150 HydrophobicContact CD1-CD1 4.04Å; L125-L150 HydrophobicContact CD2-CD1 4.4Å; L125-L150 HydrophobicContact CG-CD1 4.5Å; L125-L150 WeakPolarHBondContact O-CD2 3.39Å; L131-L150 HydrophobicContact CB-CD2 4.3Å; L131-L150 HydrophobicContact CD2-CD1 4.01Å; L131-L150 HydrophobicContact CD2-CD2 4.27Å; C147-L150 WeakPolarHBondContact O-CB 3.43Å; C147-L150 PolarHBondContact O-N 3.2Å; C147-L150 VanDerWaalsContact O-N 3.16Å; V148-L150 VanDerWaalsContact C-N 3.27Å; V148-L150 PolarHBondContact O-N 3.38Å; L150-N152 PolarHBondContact O-N 2.92Å; L150-N152 VanDerWaalsContact O-N 3.07Å; L150-I153 HydrophobicContact CB-CB 4.07Å; L150-I153 HydrophobicContact CB-CG2 3.9Å; L150-I153 HydrophobicContact CD1-CD1 3.79Å; L150-I153 WeakPolarHBondContact O-CG2 3.39Å; L150-I153 PolarHBondContact O-N 2.73Å
151	D	88.1	Confident	92.9	Very high	128 Å²	128	37.4 Å²	37.4	68%	0.684	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-21	178.7	-69.4	-35.7	0	0	0	114.5	K177	D151-K177 WeakPolarHBondContact O-CD 3.48Å; D151-K177 VanDerWaalsContact O-CE 3.27Å; D151-K177 WeakPolarHBondContact O-CE 3.37Å
152	N	93	Very high	92.8	Very high	53 Å²	53	41.8 Å²	41.8	28%	0.283	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-3.5	-170.3	-72.9	-51	0	0	0	115.1	T129 L131 L150 E154 K177	T129-N152 PolarHBondContact O-ND2 2.59Å; L131-N152 CarbonylContact O-C 3.56Å; L131-N152 WeakPolarHBondContact O-CB 3.33Å; L150-N152 PolarHBondContact O-N 2.92Å; L150-N152 VanDerWaalsContact O-N 3.07Å; N152-E154 PolarHBondContact O-N 2.63Å; N152-K177 PolarHBondContact OD1-NZ 3.47Å
153	I	95.2	Very high	92.8	Very high	1 Å²	1	39 Å²	39	1%	0.005	21%	0.213	C	C	.	.			trans	-78.3	126.2	-168.8	-160.7	156.4	0	0	0	113.4	L131 V132 L134 L150 I156 C175 K177 L178	L131-I153 HydrophobicContact CD2-CD1 4.4Å; L131-I153 HydrophobicContact CG-CD1 4.46Å; L131-I153 WeakPolarHBondContact O-CA 3.25Å; L131-I153 PolarHBondContact O-N 3.4Å; V132-I153 WeakPolarHBondContact O-CG1 3.34Å; L134-I153 HydrophobicContact CB-CD1 3.69Å; L134-I153 HydrophobicContact CD2-CD1 4.42Å; L150-I153 HydrophobicContact CB-CB 4.07Å; L150-I153 HydrophobicContact CB-CG2 3.9Å; L150-I153 HydrophobicContact CD1-CD1 3.79Å; L150-I153 WeakPolarHBondContact O-CG2 3.39Å; L150-I153 PolarHBondContact O-N 2.73Å; I153-I156 HydrophobicContact CD1-CD1 3.89Å; I153-I156 HydrophobicContact CD1-CG1 3.49Å; I153-I156 VanDerWaalsContact CD1-CG1 3.49Å; I153-I156 HydrophobicContact CG1-CD1 4.27Å; I153-I156 HydrophobicContact CG1-CG1 3.82Å; I153-I156 HydrophobicContact CG2-CD1 4.22Å; I153-C175 HydrophobicContact CG2-CB 3.97Å; I153-K177 CarbonylContact O-C 3.55Å; I153-K177 VanDerWaalsContact O-C 3.22Å; I153-K177 WeakPolarHBondContact O-CB 3.26Å; I153-L178 WeakPolarHBondContact O-CA 3.26Å; I153-L178 PolarHBondContact O-N 2.83Å
154	E	95.2	Very high	92.6	Very high	86 Å²	86	40.2 Å²	40.2	40%	0.402	22%	0.217	S	C	.	.			trans	-110.8	-29.3	-177.9	-66.4	-174.4	-170.3	0	0	112.6	V132 N152 K177 T179 S180	V132-E154 HydrophobicContact CG1-CB 3.93Å; V132-E154 HydrophobicContact CG1-CG 4.01Å; V132-E154 PolarHBondContact O-N 2.95Å; N152-E154 PolarHBondContact O-N 2.63Å; E154-K177 HydrophobicContact CG-CB 4.05Å; E154-T179 PolarHBondContact O-N 3.39Å; E154-T179 PolarHBondContact O-OG1 3.39Å; E154-T179 VanDerWaalsContact O-OG1 3.13Å; E154-S180 PolarHBondContact O-N 2.88Å
155	V	95.7	Very high	92.3	Very high	26 Å²	26	44 Å²	44	16%	0.158	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	127.7	-179	-175.9	0	0	0	0	110.8	V132 E133 L134 Y135 S180	V132-V155 PolarHBondContact O-N 2.9Å; V132-V155 VanDerWaalsContact O-N 3.07Å; E133-V155 WeakPolarHBondContact CA-O 3.33Å; E133-V155 HydrophobicContact CB-CB 4.13Å; E133-V155 HydrophobicContact CG-CB 3.99Å; E133-V155 HydrophobicContact CG-CG2 4.08Å; L134-V155 PolarHBondContact N-O 2.82Å; Y135-V155 HydrophobicContact CE1-CG1 4.48Å; V155-S180 WeakPolarHBondContact CA-O 3.39Å
156	I	95.6	Very high	92	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	122.4	170.8	-65	174	0	0	0	109.7	I153 L158 L172 L178 S180 L181 T182	I153-I156 HydrophobicContact CD1-CD1 3.89Å; I153-I156 HydrophobicContact CD1-CG1 3.49Å; I153-I156 VanDerWaalsContact CD1-CG1 3.49Å; I153-I156 HydrophobicContact CG1-CD1 4.27Å; I153-I156 HydrophobicContact CG1-CG1 3.82Å; I153-I156 HydrophobicContact CG2-CD1 4.22Å; I156-L158 HydrophobicContact CG2-CD1 3.38Å; I156-L158 HydrophobicContact CG2-CG 3.62Å; I156-L172 HydrophobicContact CD1-CD2 3.86Å; I156-L178 HydrophobicContact CB-CD1 4.03Å; I156-L178 HydrophobicContact CD1-CD1 3.69Å; I156-L178 HydrophobicContact CD1-CD2 4.1Å; I156-L178 HydrophobicContact CG1-CD1 3.65Å; I156-S180 PolarHBondContact N-O 3.44Å; I156-L181 HydrophobicContact CB-CD1 3.94Å; I156-L181 HydrophobicContact CG2-CD1 3.92Å; I156-L181 VanDerWaalsContact O-CA 3.31Å; I156-L181 WeakPolarHBondContact O-CA 3.28Å; I156-T182 PolarHBondContact O-N 3.25Å
157	D	95.4	Very high	91.8	Very high	26 Å²	26	48 Å²	48	14%	0.139	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	113.6	169.5	165.6	37.5	0	0	0	110.7	L134 Y135 V136 A137 E159 T182	L134-D157 PolarHBondContact O-N 3Å; Y135-D157 HydrophobicContact CD1-CB 3.55Å; Y135-D157 HydrophobicContact CE1-CB 4.2Å; Y135-D157 HydrophobicContact CG-CB 4.3Å; V136-D157 VanDerWaalsContact CG2-O 3.22Å; V136-D157 WeakPolarHBondContact CG2-O 3.12Å; V136-D157 PolarHBondContact N-O 3.38Å; A137-D157 WeakPolarHBondContact CB-OD2 3.47Å; D157-E159 PolarHBondContact OD1-N 3.31Å; D157-E159 VanDerWaalsContact OD1-N 3.1Å; D157-T182 VanDerWaalsContact CA-OG1 3.25Å; D157-T182 WeakPolarHBondContact CA-OG1 3.28Å; D157-T182 HydrophobicContact CB-CG2 4.28Å; D157-T182 PolarHBondContact OD1-OG1 3.48Å
158	L	94.6	Very high	91.6	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	26%	0.261	C	S	.	.			trans	-118.6	22.5	-179.3	-77.6	156.7	0	0	0	111.6	V136 V141 L144 I156 G160 N161 I163 L181 T182 L183 N186	V136-L158 HydrophobicContact CG2-CD2 3.51Å; V136-L158 HydrophobicContact CG2-CG 4.09Å; V141-L158 HydrophobicContact CG1-CD2 4.41Å; L144-L158 HydrophobicContact CD1-CD1 4.14Å; L144-L158 HydrophobicContact CD2-CD1 3.84Å; L144-L158 HydrophobicContact CD2-CD2 3.94Å; I156-L158 HydrophobicContact CG2-CD1 3.38Å; I156-L158 HydrophobicContact CG2-CG 3.62Å; L158-G160 PolarHBondContact O-N 3.25Å; L158-N161 WeakPolarHBondContact O-CB 3.14Å; L158-N161 PolarHBondContact O-N 2.8Å; L158-N161 PolarHBondContact O-ND2 3.47Å; L158-I163 HydrophobicContact CB-CD1 3.99Å; L158-I163 HydrophobicContact CD1-CD1 3.88Å; L158-I163 HydrophobicContact CD2-CD1 4.17Å; L158-I163 HydrophobicContact CG-CD1 4.24Å; L158-L181 HydrophobicContact CD1-CD1 4.16Å; L158-T182 PolarHBondContact N-OG1 2.68Å; L158-L183 HydrophobicContact CB-CD2 4.48Å; L158-N186 PolarHBondContact O-ND2 3.03Å
159	E	94	Very high	91.6	Very high	76 Å²	76	46.5 Å²	46.5	36%	0.355	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	136	-178.9	-171.5	-173.3	176.9	0	0	111.6	A137 F138 D157 N161 T182 E184	A137-E159 CarbonylContact C-O 3.59Å; A137-E159 VanDerWaalsContact CA-O 3.26Å; A137-E159 WeakPolarHBondContact CA-O 3.47Å; A137-E159 HydrophobicContact CB-CB 4.06Å; F138-E159 HydrophobicContact CE2-CG 4.48Å; F138-E159 HydrophobicContact CZ-CG 4.1Å; F138-E159 WeakPolarHBondContact CZ-OE1 2.97Å; F138-E159 PolarHBondContact N-O 3.09Å; D157-E159 PolarHBondContact OD1-N 3.31Å; D157-E159 VanDerWaalsContact OD1-N 3.1Å; E159-N161 VanDerWaalsContact C-N 3.27Å; E159-N161 PolarHBondContact O-N 3.04Å; E159-N161 PolarHBondContact O-ND2 2.58Å; E159-T182 PolarHBondContact N-OG1 2.88Å; E159-E184 CarbonylContact C-O 3.11Å; E159-E184 WeakPolarHBondContact CA-O 3.3Å; E159-E184 HydrophobicContact CG-CB 4.06Å
160	G	91.5	Very high	91.6	Very high	24 Å²	24	43.1 Å²	43.1	25%	0.247	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	18.9	168.8	0	0	0	0	0	115.6	L158 E184	L158-G160 PolarHBondContact O-N 3.25Å; G160-E184 PolarHBondContact N-O 2.9Å
161	N	94.8	Very high	91.6	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.011	25%	0.25	C	S	.	.			trans	-85.4	-176.1	174.5	-81	-82.7	0	0	0	112.8	V136 N139 V141 L158 E159 N186 P187	V136-N161 PolarHBondContact O-ND2 2.87Å; N139-N161 WeakPolarHBondContact CA-OD1 3.15Å; N139-N161 WeakPolarHBondContact CB-OD1 3.15Å; N139-N161 PolarHBondContact O-OD1 3.21Å; V141-N161 HydrophobicContact CB-CB 4.38Å; V141-N161 VanDerWaalsContact CB-OD1 3.28Å; V141-N161 WeakPolarHBondContact CB-OD1 3.4Å; V141-N161 WeakPolarHBondContact CG2-OD1 3.29Å; V141-N161 PolarHBondContact N-OD1 3.34Å; V141-N161 VanDerWaalsContact N-OD1 3.13Å; L158-N161 WeakPolarHBondContact O-CB 3.14Å; L158-N161 PolarHBondContact O-N 2.8Å; L158-N161 PolarHBondContact O-ND2 3.47Å; E159-N161 VanDerWaalsContact C-N 3.27Å; E159-N161 PolarHBondContact O-N 3.04Å; E159-N161 PolarHBondContact O-ND2 2.58Å; N161-N186 WeakPolarHBondContact CA-OD1 3.36Å; N161-N186 VanDerWaalsContact CB-OD1 3.26Å; N161-N186 WeakPolarHBondContact CB-OD1 3.45Å; N161-N186 PolarHBondContact O-OD1 3.23Å; N161-N186 VanDerWaalsContact O-OD1 3.09Å; N161-P187 WeakPolarHBondContact O-CD 3.14Å
162	L	92.9	Very high	91.7	Very high	93 Å²	93	41 Å²	41	49%	0.487	22%	0.218	S	C	.	.			trans	-103.3	29.9	-176.7	-60.7	-179.6	0	0	0	112.9	V141 E164	V141-L162 CarbonylContact O-C 3.21Å; V141-L162 VanDerWaalsContact O-C 3.29Å; V141-L162 VanDerWaalsContact O-CA 3.3Å; V141-L162 WeakPolarHBondContact O-CA 3.28Å; V141-L162 PolarHBondContact O-N 3.16Å; L162-E164 PolarHBondContact O-N 3.43Å
163	I	92.5	Very high	91.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.23	C	C	.	.			trans	-67.5	110.1	177	-57.2	162.6	0	0	0	108.9	V141 L144 L158 L169 L183 N186 P187 F188	V141-I163 PolarHBondContact O-N 3.47Å; L144-I163 HydrophobicContact CD1-CD1 4Å; L144-I163 HydrophobicContact CD1-CG1 4.46Å; L144-I163 HydrophobicContact CD2-CD1 4.3Å; L144-I163 HydrophobicContact CG-CD1 4.5Å; L158-I163 HydrophobicContact CB-CD1 3.99Å; L158-I163 HydrophobicContact CD1-CD1 3.88Å; L158-I163 HydrophobicContact CD2-CD1 4.17Å; L158-I163 HydrophobicContact CG-CD1 4.24Å; I163-L169 HydrophobicContact CG2-CD2 4.32Å; I163-L183 HydrophobicContact CD1-CD2 3.76Å; I163-N186 HydrophobicContact CB-CB 4.24Å; I163-N186 VanDerWaalsContact CB-OD1 3.29Å; I163-N186 WeakPolarHBondContact CB-OD1 3.25Å; I163-N186 WeakPolarHBondContact CD1-OD1 3.3Å; I163-N186 VanDerWaalsContact CG1-OD1 3.3Å; I163-N186 WeakPolarHBondContact CG1-OD1 3.46Å; I163-N186 PolarHBondContact N-OD1 2.95Å; I163-N186 VanDerWaalsContact N-OD1 3.1Å; I163-P187 WeakPolarHBondContact O-CD 3.47Å; I163-F188 HydrophobicContact CG2-CB 4.47Å; I163-F188 VanDerWaalsContact O-CB 3.26Å; I163-F188 WeakPolarHBondContact O-CB 3.42Å; I163-F188 PolarHBondContact O-N 2.62Å
164	E	88.7	Confident	91.3	Very high	90 Å²	90	49.6 Å²	49.6	42%	0.421	25%	0.253	S	S	.	.			trans	-93	-41.9	-173.4	-84.8	-94	118.6	0	0	112.9	L162 P187 K191	L162-E164 PolarHBondContact O-N 3.43Å; E164-P187 HydrophobicContact CG-CB 4.25Å; E164-P187 HydrophobicContact CG-CG 4.46Å; E164-P187 WeakPolarHBondContact OE1-CB 3.29Å; E164-K191 VanDerWaalsContact CD-CE 3.45Å; E164-K191 VanDerWaalsContact CD-NZ 3.28Å; E164-K191 WeakPolarHBondContact O-CD 3.22Å; E164-K191 WeakPolarHBondContact O-CE 3.17Å; E164-K191 PolarHBondContact O-NZ 3.08Å; E164-K191 WeakPolarHBondContact OE1-CE 3.34Å; E164-K191 IonicContact OE1-NZ 3.92Å; E164-K191 WeakPolarHBondContact OE2-CE 3.26Å; E164-K191 IonicContact OE2-NZ 2.91Å; E164-K191 PolarHBondContact OE2-NZ 3.14Å
165	D	85.9	Confident	91	Very high	80 Å²	80	45.7 Å²	45.7	43%	0.428	24%	0.235	S	C	.	.			trans	-130	152.3	-158.9	-71.1	-24.1	0	0	0	114.3	S167 S168 K191	D165-S167 PolarHBondContact O-N 3.11Å; D165-S168 PolarHBondContact O-N 2.89Å; D165-K191 IonicContact OD1-NZ 3.17Å; D165-K191 PolarHBondContact OD1-NZ 3.36Å
166	K	86	Confident	90.6	Very high	77 Å²	77	52 Å²	52	34%	0.335	26%	0.262	S	S	.	.	H	α-helix	trans	-60.8	-28	-179.2	-169.3	-176.6	174.5	-167.2	0	113.1	L169 S170 F188 V201 E205	K166-L169 PolarHBondContact O-N 3.28Å; K166-S170 PolarHBondContact O-N 3.47Å; K166-F188 HydrophobicContact CB-CE2 4.14Å; K166-V201 HydrophobicContact CD-CG1 3.95Å; K166-V201 HydrophobicContact CG-CG1 4.29Å; K166-E205 HydrophobicContact CD-CG 4.39Å; K166-E205 WeakPolarHBondContact CE-OE1 3.29Å; K166-E205 HydrophobicContact CG-CG 4.28Å; K166-E205 VanDerWaalsContact NZ-CD 3.35Å; K166-E205 IonicContact NZ-OE1 3.75Å; K166-E205 PolarHBondContact NZ-OE1 2.77Å
167	S	87.4	Confident	90.4	Very high	70 Å²	70	56.2 Å²	56.2	49%	0.49	28%	0.281	S	S	.	.	H	α-helix	trans	-61.7	-43.2	177	37.7	0	0	0	0	112.6	D165 L169 S170	D165-S167 PolarHBondContact O-N 3.11Å; S167-L169 VanDerWaalsContact C-N 3.26Å; S167-L169 PolarHBondContact O-N 3Å; S167-S170 WeakPolarHBondContact O-CB 3.41Å; S167-S170 PolarHBondContact O-N 2.88Å; S167-S170 PolarHBondContact O-OG 2.82Å
168	S	87.8	Confident	90.3	Very high	15 Å²	15	55 Å²	55	11%	0.105	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-37.8	178.8	-50.9	0	0	0	0	111.7	S142 D165 S170 Y171	S142-S168 PolarHBondContact O-OG 2.71Å; D165-S168 PolarHBondContact O-N 2.89Å; S168-S170 VanDerWaalsContact C-N 3.28Å; S168-S170 PolarHBondContact O-N 2.79Å; S168-Y171 WeakPolarHBondContact O-CD2 3.4Å; S168-Y171 PolarHBondContact O-N 2.94Å
169	L	89.8	Confident	90.2	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-67.5	-26.1	176	-62.3	-178.1	0	0	0	113.1	L144 I163 K166 S167 Y171 L172 L183 F188 V202 L206	L144-L169 HydrophobicContact CD1-CD2 4.15Å; I163-L169 HydrophobicContact CG2-CD2 4.32Å; K166-L169 PolarHBondContact O-N 3.28Å; S167-L169 VanDerWaalsContact C-N 3.26Å; S167-L169 PolarHBondContact O-N 3Å; L169-Y171 PolarHBondContact O-N 3.17Å; L169-L172 HydrophobicContact CD2-CD1 4.25Å; L169-L172 WeakPolarHBondContact O-CB 3.39Å; L169-L172 PolarHBondContact O-N 3.08Å; L169-L172 VanDerWaalsContact O-N 3.11Å; L169-L183 HydrophobicContact CD1-CD1 4.05Å; L169-L183 HydrophobicContact CD2-CD1 3.87Å; L169-L183 HydrophobicContact CD2-CD2 3.9Å; L169-F188 HydrophobicContact CD1-CD1 4.04Å; L169-F188 HydrophobicContact CD1-CD2 4.14Å; L169-F188 HydrophobicContact CD1-CE1 3.58Å; L169-F188 HydrophobicContact CD1-CE2 3.69Å; L169-F188 HydrophobicContact CD1-CG 4.31Å; L169-F188 HydrophobicContact CD1-CZ 3.4Å; L169-V202 HydrophobicContact CD1-CG2 4.22Å; L169-L206 HydrophobicContact CB-CD1 4.49Å
170	S	88.8	Confident	90.2	Very high	48 Å²	48	54.8 Å²	54.8	34%	0.336	28%	0.279	S	S	.	.	H	α-helix	trans	-66.2	-22.2	-179.8	74.8	0	0	0	0	113.3	K166 S167 S168 R173	K166-S170 PolarHBondContact O-N 3.47Å; S167-S170 WeakPolarHBondContact O-CB 3.41Å; S167-S170 PolarHBondContact O-N 2.88Å; S167-S170 PolarHBondContact O-OG 2.82Å; S168-S170 VanDerWaalsContact C-N 3.28Å; S168-S170 PolarHBondContact O-N 2.79Å; S170-R173 WeakPolarHBondContact O-CB 3.22Å; S170-R173 PolarHBondContact O-N 3.09Å
171	Y	90.1	Very high	90.3	Very high	89 Å²	89	53.7 Å²	53.7	35%	0.349	27%	0.267	S	S	.	.	H	α-helix	trans	-65.6	-38.7	171.7	-63.2	-52.6	0	0	0	112.4	D143 V148 S168 L169 R173 L174	D143-Y171 WeakPolarHBondContact OD1-CE2 3.42Å; V148-Y171 HydrophobicContact CG2-CD1 4.02Å; V148-Y171 HydrophobicContact CG2-CG 4.19Å; S168-Y171 WeakPolarHBondContact O-CD2 3.4Å; S168-Y171 PolarHBondContact O-N 2.94Å; L169-Y171 PolarHBondContact O-N 3.17Å; Y171-R173 PolarHBondContact O-N 3.18Å; Y171-L174 WeakPolarHBondContact O-CB 3.32Å; Y171-L174 PolarHBondContact O-N 3.2Å
172	L	91.3	Very high	90.3	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-13	176.7	-59.2	-176.1	0	0	0	113.2	L144 C147 I156 L169 L174 C175 L178 L181 L206 Q208	L144-L172 HydrophobicContact CD1-CD1 3.96Å; L144-L172 HydrophobicContact CD1-CD2 4.34Å; L144-L172 HydrophobicContact CD1-CG 4.06Å; C147-L172 HydrophobicContact CB-CD2 3.94Å; I156-L172 HydrophobicContact CD1-CD2 3.86Å; L169-L172 HydrophobicContact CD2-CD1 4.25Å; L169-L172 WeakPolarHBondContact O-CB 3.39Å; L169-L172 PolarHBondContact O-N 3.08Å; L169-L172 VanDerWaalsContact O-N 3.11Å; L172-L174 PolarHBondContact O-N 3.18Å; L172-C175 WeakPolarHBondContact O-CB 3.27Å; L172-C175 PolarHBondContact O-N 2.79Å; L172-L178 HydrophobicContact CB-CD2 3.97Å; L172-L178 HydrophobicContact CD1-CD2 4.24Å; L172-L178 HydrophobicContact CG-CD2 4.48Å; L172-L181 HydrophobicContact CD1-CD1 3.95Å; L172-L181 HydrophobicContact CD1-CD2 3.9Å; L172-L206 HydrophobicContact CB-CD1 3.96Å; L172-L206 HydrophobicContact CB-CD2 4.01Å; L172-L206 HydrophobicContact CD1-CD1 4.26Å; L172-Q208 PolarHBondContact O-NE2 3.1Å
173	R	89.4	Confident	90.2	Very high	141 Å²	141	50.1 Å²	50.1	53%	0.532	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-23	174.3	-166	178.2	169.1	170.8	-2.6	112.7	S170 Y171 E205 L206	S170-R173 WeakPolarHBondContact O-CB 3.22Å; S170-R173 PolarHBondContact O-N 3.09Å; Y171-R173 PolarHBondContact O-N 3.18Å; R173-E205 WeakPolarHBondContact CD-O 3.44Å; R173-L206 HydrophobicContact CB-CD2 3.71Å; R173-L206 HydrophobicContact CG-CD2 4.39Å; R173-L206 VanDerWaalsContact N-CD2 3.27Å
174	L	89.1	Confident	90.1	Very high	94 Å²	94	52.9 Å²	52.9	49%	0.492	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-23.6	176.6	-58.9	174.7	0	0	0	111.5	V148 Y171 L172 H176	V148-L174 HydrophobicContact CB-CD1 4.37Å; V148-L174 HydrophobicContact CG1-CB 4.13Å; V148-L174 HydrophobicContact CG1-CD1 3.49Å; V148-L174 VanDerWaalsContact CG1-CD1 3.49Å; V148-L174 HydrophobicContact CG1-CG 4.44Å; V148-L174 HydrophobicContact CG2-CD1 3.92Å; Y171-L174 WeakPolarHBondContact O-CB 3.32Å; Y171-L174 PolarHBondContact O-N 3.2Å; L172-L174 PolarHBondContact O-N 3.18Å; L174-H176 VanDerWaalsContact C-N 3.32Å; L174-H176 PolarHBondContact O-N 3.44Å; L174-H176 PolarHBondContact O-ND1 3.23Å
175	C	90.4	Very high	90	Very high	4 Å²	4	51.3 Å²	51.3	3%	0.027	27%	0.27	C	S	.	.			trans	-71.7	82.3	171.7	-50.3	0	0	0	0	110.4	C147 I153 L172 K177 L178 Q208	C147-C175 PolarHBondContact O-SG 3.31Å; I153-C175 HydrophobicContact CG2-CB 3.97Å; L172-C175 WeakPolarHBondContact O-CB 3.27Å; L172-C175 PolarHBondContact O-N 2.79Å; C175-K177 PolarHBondContact O-N 2.86Å; C175-K177 VanDerWaalsContact O-N 3.16Å; C175-L178 HydrophobicContact CB-CB 4.01Å; C175-L178 WeakPolarHBondContact O-CB 3.06Å; C175-L178 PolarHBondContact O-N 2.91Å; C175-L178 VanDerWaalsContact O-N 3.17Å; C175-Q208 PolarHBondContact O-NE2 3.41Å
176	H	87	Confident	90.2	Very high	158 Å²	158	47.5 Å²	47.5	73%	0.731	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-19.2	-171.9	-65.5	-25.2	0	0	0	115.3	L174	L174-H176 VanDerWaalsContact C-N 3.32Å; L174-H176 PolarHBondContact O-N 3.44Å; L174-H176 PolarHBondContact O-ND1 3.23Å
177	K	91.5	Very high	90.3	Very high	90 Å²	90	45 Å²	45	39%	0.391	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-4.6	177.8	-59.7	-169.7	-168.3	176	0	114.6	D151 N152 I153 E154 C175 T179	D151-K177 WeakPolarHBondContact O-CD 3.48Å; D151-K177 VanDerWaalsContact O-CE 3.27Å; D151-K177 WeakPolarHBondContact O-CE 3.37Å; N152-K177 PolarHBondContact OD1-NZ 3.47Å; I153-K177 CarbonylContact O-C 3.55Å; I153-K177 VanDerWaalsContact O-C 3.22Å; I153-K177 WeakPolarHBondContact O-CB 3.26Å; E154-K177 HydrophobicContact CG-CB 4.05Å; C175-K177 PolarHBondContact O-N 2.86Å; C175-K177 VanDerWaalsContact O-N 3.16Å; K177-T179 WeakPolarHBondContact O-CG2 3.49Å; K177-T179 PolarHBondContact O-N 3.11Å
178	L	93.4	Very high	90.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.218	C	C	.	.			trans	-65.2	103.1	-172.3	-177.6	63.4	0	0	0	111.5	I153 I156 L172 C175 S180 I209	I153-L178 WeakPolarHBondContact O-CA 3.26Å; I153-L178 PolarHBondContact O-N 2.83Å; I156-L178 HydrophobicContact CB-CD1 4.03Å; I156-L178 HydrophobicContact CD1-CD1 3.69Å; I156-L178 HydrophobicContact CD1-CD2 4.1Å; I156-L178 HydrophobicContact CG1-CD1 3.65Å; L172-L178 HydrophobicContact CB-CD2 3.97Å; L172-L178 HydrophobicContact CD1-CD2 4.24Å; L172-L178 HydrophobicContact CG-CD2 4.48Å; C175-L178 HydrophobicContact CB-CB 4.01Å; C175-L178 WeakPolarHBondContact O-CB 3.06Å; C175-L178 PolarHBondContact O-N 2.91Å; C175-L178 VanDerWaalsContact O-N 3.17Å; L178-S180 WeakPolarHBondContact CD1-O 3.39Å; L178-I209 HydrophobicContact CD2-CD1 4.22Å; L178-I209 HydrophobicContact CD2-CG1 4.47Å; L178-I209 HydrophobicContact CG-CG1 4.38Å
179	T	92.3	Very high	90.2	Very high	55 Å²	55	41.6 Å²	41.6	34%	0.337	22%	0.217	S	C	.	.			trans	-96.4	-34.9	-178.7	66.4	0	0	0	0	112.7	E154 K177 S210 I211	E154-T179 PolarHBondContact O-N 3.39Å; E154-T179 PolarHBondContact O-OG1 3.39Å; E154-T179 VanDerWaalsContact O-OG1 3.13Å; K177-T179 WeakPolarHBondContact O-CG2 3.49Å; K177-T179 PolarHBondContact O-N 3.11Å; T179-S210 PolarHBondContact O-N 3.04Å; T179-S210 PolarHBondContact O-OG 3.02Å; T179-I211 PolarHBondContact O-N 3.2Å
180	S	93.5	Very high	89.9	Confident	18 Å²	18	46.4 Å²	46.4	13%	0.126	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.7	-176.3	-166.9	0	0	0	0	112	E154 V155 I156 L178 I211	E154-S180 PolarHBondContact O-N 2.88Å; V155-S180 WeakPolarHBondContact CA-O 3.39Å; I156-S180 PolarHBondContact N-O 3.44Å; L178-S180 WeakPolarHBondContact CD1-O 3.39Å; S180-I211 WeakPolarHBondContact CA-O 3.25Å
181	L	94.5	Very high	89.5	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	132.6	179	-179.7	64.1	0	0	0	111.3	I156 L158 L172 L183 L206 I209 I211 L212 D213	I156-L181 HydrophobicContact CB-CD1 3.94Å; I156-L181 HydrophobicContact CG2-CD1 3.92Å; I156-L181 VanDerWaalsContact O-CA 3.31Å; I156-L181 WeakPolarHBondContact O-CA 3.28Å; L158-L181 HydrophobicContact CD1-CD1 4.16Å; L172-L181 HydrophobicContact CD1-CD1 3.95Å; L172-L181 HydrophobicContact CD1-CD2 3.9Å; L181-L183 HydrophobicContact CD1-CD2 4.45Å; L181-L183 HydrophobicContact CD2-CD1 3.94Å; L181-L183 HydrophobicContact CD2-CD2 4.43Å; L181-L183 HydrophobicContact CD2-CG 4.04Å; L181-L183 HydrophobicContact CG-CD1 4.49Å; L181-L183 HydrophobicContact CG-CD2 4.48Å; L181-L183 HydrophobicContact CG-CG 4.07Å; L181-L206 HydrophobicContact CD2-CD1 4.04Å; L181-I209 HydrophobicContact CB-CD1 3.81Å; L181-I209 HydrophobicContact CB-CG2 4.45Å; L181-I209 HydrophobicContact CD2-CD1 3.55Å; L181-I209 HydrophobicContact CG-CD1 4.33Å; L181-I211 PolarHBondContact N-O 2.85Å; L181-L212 HydrophobicContact CB-CD1 4.42Å; L181-L212 HydrophobicContact CD2-CD1 4.48Å; L181-L212 HydrophobicContact CG-CD1 4.46Å; L181-L212 CarbonylContact O-C 3.45Å; L181-L212 VanDerWaalsContact O-CA 3.31Å; L181-L212 WeakPolarHBondContact O-CA 3.38Å; L181-D213 PolarHBondContact O-N 2.88Å
182	T	93.8	Very high	88.8	Confident	19 Å²	19	47.3 Å²	47.3	12%	0.117	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	143.2	163.4	77.6	0	0	0	0	110.4	I156 D157 L158 E159	I156-T182 PolarHBondContact O-N 3.25Å; D157-T182 VanDerWaalsContact CA-OG1 3.25Å; D157-T182 WeakPolarHBondContact CA-OG1 3.28Å; D157-T182 HydrophobicContact CB-CG2 4.28Å; D157-T182 PolarHBondContact OD1-OG1 3.48Å; L158-T182 PolarHBondContact N-OG1 2.68Å; E159-T182 PolarHBondContact N-OG1 2.88Å
183	L	91.7	Very high	87.6	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	27%	0.269	C	S	.	.			trans	-139.2	0.3	174	-68.6	175.8	0	0	0	112.7	L158 I163 L169 L181 N186 V189 V202 L212 D213	L158-L183 HydrophobicContact CB-CD2 4.48Å; I163-L183 HydrophobicContact CD1-CD2 3.76Å; L169-L183 HydrophobicContact CD1-CD1 4.05Å; L169-L183 HydrophobicContact CD2-CD1 3.87Å; L169-L183 HydrophobicContact CD2-CD2 3.9Å; L181-L183 HydrophobicContact CD1-CD2 4.45Å; L181-L183 HydrophobicContact CD2-CD1 3.94Å; L181-L183 HydrophobicContact CD2-CD2 4.43Å; L181-L183 HydrophobicContact CD2-CG 4.04Å; L181-L183 HydrophobicContact CG-CD1 4.49Å; L181-L183 HydrophobicContact CG-CD2 4.48Å; L181-L183 HydrophobicContact CG-CG 4.07Å; L183-N186 WeakPolarHBondContact O-CB 3.3Å; L183-N186 PolarHBondContact O-N 3.13Å; L183-N186 PolarHBondContact O-ND2 3.05Å; L183-V189 HydrophobicContact CB-CG2 4.29Å; L183-V189 VanDerWaalsContact O-CG2 3.22Å; L183-V189 WeakPolarHBondContact O-CG2 3.18Å; L183-V202 HydrophobicContact CD1-CG2 3.84Å; L183-L212 HydrophobicContact CD1-CD1 4.45Å; L183-D213 PolarHBondContact N-OD1 3.24Å
184	E	89.6	Confident	86.6	Confident	59 Å²	59	44.3 Å²	44.3	28%	0.276	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.5	147.2	170.2	-75.4	-90.5	86.7	0	0	112.3	E159 G160 N186 K195 D213	E159-E184 CarbonylContact C-O 3.11Å; E159-E184 WeakPolarHBondContact CA-O 3.3Å; E159-E184 HydrophobicContact CG-CB 4.06Å; G160-E184 PolarHBondContact N-O 2.9Å; E184-N186 PolarHBondContact O-N 3.45Å; E184-N186 PolarHBondContact O-ND2 2.79Å; E184-K195 WeakPolarHBondContact OE1-CE 3.42Å; E184-K195 IonicContact OE1-NZ 2.76Å; E184-K195 PolarHBondContact OE1-NZ 2.79Å; E184-K195 IonicContact OE2-NZ 3.12Å; E184-K195 PolarHBondContact OE2-NZ 2.82Å; E184-D213 HydrophobicContact CG-CB 3.98Å; E184-D213 PolarHBondContact N-OD1 2.86Å
185	G	87	Confident	85.9	Confident	56 Å²	56	45.2 Å²	45.2	58%	0.577	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.7	-22.4	-177.9	0	0	0	0	0	116.5
186	N	90.9	Very high	85.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.297	C	S	.	.			trans	-69.5	146.4	-175.2	-75.2	-93.7	0	0	0	113.6	L158 N161 I163 L183 E184 F188 V189	L158-N186 PolarHBondContact O-ND2 3.03Å; N161-N186 WeakPolarHBondContact CA-OD1 3.36Å; N161-N186 VanDerWaalsContact CB-OD1 3.26Å; N161-N186 WeakPolarHBondContact CB-OD1 3.45Å; N161-N186 PolarHBondContact O-OD1 3.23Å; N161-N186 VanDerWaalsContact O-OD1 3.09Å; I163-N186 HydrophobicContact CB-CB 4.24Å; I163-N186 VanDerWaalsContact CB-OD1 3.29Å; I163-N186 WeakPolarHBondContact CB-OD1 3.25Å; I163-N186 WeakPolarHBondContact CD1-OD1 3.3Å; I163-N186 VanDerWaalsContact CG1-OD1 3.3Å; I163-N186 WeakPolarHBondContact CG1-OD1 3.46Å; I163-N186 PolarHBondContact N-OD1 2.95Å; I163-N186 VanDerWaalsContact N-OD1 3.1Å; L183-N186 WeakPolarHBondContact O-CB 3.3Å; L183-N186 PolarHBondContact O-N 3.13Å; L183-N186 PolarHBondContact O-ND2 3.05Å; E184-N186 PolarHBondContact O-N 3.45Å; E184-N186 PolarHBondContact O-ND2 2.79Å; N186-F188 PolarHBondContact O-N 3.1Å; N186-F188 VanDerWaalsContact O-N 3.16Å; N186-V189 WeakPolarHBondContact O-CB 3.45Å; N186-V189 PolarHBondContact O-N 3.37Å
187	P	88.2	Confident	84.9	Confident	24 Å²	24	52 Å²	52	16%	0.156	29%	0.293	C	S	.	.	H	α-helix	trans	-51.1	-38.3	175	-27.5	32.8	0	0	0	114	N161 I163 E164 V189 T190 K191	N161-P187 WeakPolarHBondContact O-CD 3.14Å; I163-P187 WeakPolarHBondContact O-CD 3.47Å; E164-P187 HydrophobicContact CG-CB 4.25Å; E164-P187 HydrophobicContact CG-CG 4.46Å; E164-P187 WeakPolarHBondContact OE1-CB 3.29Å; P187-V189 VanDerWaalsContact C-N 3.31Å; P187-V189 PolarHBondContact O-N 2.97Å; P187-T190 WeakPolarHBondContact O-CA 3.42Å; P187-T190 WeakPolarHBondContact O-CB 3.44Å; P187-T190 PolarHBondContact O-N 2.73Å; P187-T190 PolarHBondContact O-OG1 3.26Å; P187-K191 PolarHBondContact O-N 2.93Å
188	F	87.6	Confident	84.7	Confident	1 Å²	1	47.8 Å²	47.8	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-49.6	-45.4	174.5	176.3	-93.6	0	0	0	113.3	I163 K166 L169 N186 T190 K191 H192 Y198 V201 V202	I163-F188 HydrophobicContact CG2-CB 4.47Å; I163-F188 VanDerWaalsContact O-CB 3.26Å; I163-F188 WeakPolarHBondContact O-CB 3.42Å; I163-F188 PolarHBondContact O-N 2.62Å; K166-F188 HydrophobicContact CB-CE2 4.14Å; L169-F188 HydrophobicContact CD1-CD1 4.04Å; L169-F188 HydrophobicContact CD1-CD2 4.14Å; L169-F188 HydrophobicContact CD1-CE1 3.58Å; L169-F188 HydrophobicContact CD1-CE2 3.69Å; L169-F188 HydrophobicContact CD1-CG 4.31Å; L169-F188 HydrophobicContact CD1-CZ 3.4Å; N186-F188 PolarHBondContact O-N 3.1Å; N186-F188 VanDerWaalsContact O-N 3.16Å; F188-T190 VanDerWaalsContact C-N 3.26Å; F188-T190 PolarHBondContact O-N 3.34Å; F188-K191 PolarHBondContact O-N 2.82Å; F188-H192 AromaticContact CD2-CD2 3.46Å; F188-H192 VanDerWaalsContact CD2-CD2 3.46Å; F188-H192 WeakPolarHBondContact CD2-CD2 3.3Å; F188-H192 AromaticContact CD2-NE2 3.72Å; F188-H192 AromaticContact CE2-CD2 3.25Å; F188-H192 WeakPolarHBondContact CE2-CD2 3.32Å; F188-H192 AromaticContact CE2-NE2 3.28Å; F188-H192 VanDerWaalsContact CE2-NE2 3.28Å; F188-H192 WeakPolarHBondContact CE2-NE2 3.43Å; F188-H192 AromaticContact CZ-CD2 3.64Å; F188-H192 AromaticContact CZ-NE2 3.95Å; F188-H192 PolarHBondContact O-CD2 2.77Å; F188-H192 PolarHBondContact O-N 2.48Å; F188-Y198 HydrophobicContact CE1-CD2 4.36Å; F188-V201 HydrophobicContact CZ-CB 4.49Å; F188-V201 HydrophobicContact CZ-CG1 4.07Å; F188-V202 HydrophobicContact CE1-CG2 3.78Å; F188-V202 HydrophobicContact CZ-CG2 4.3Å
189	V	85.5	Confident	84.3	Confident	14 Å²	14	49.2 Å²	49.2	9%	0.085	28%	0.28	C	S	.	.	H	α-helix	trans	-62.7	-35.4	178.5	174.5	0	0	0	0	111.2	L183 N186 P187 Y198	L183-V189 HydrophobicContact CB-CG2 4.29Å; L183-V189 VanDerWaalsContact O-CG2 3.22Å; L183-V189 WeakPolarHBondContact O-CG2 3.18Å; N186-V189 WeakPolarHBondContact O-CB 3.45Å; N186-V189 PolarHBondContact O-N 3.37Å; P187-V189 VanDerWaalsContact C-N 3.31Å; P187-V189 PolarHBondContact O-N 2.97Å; V189-Y198 HydrophobicContact CB-CD1 4.35Å; V189-Y198 HydrophobicContact CB-CG 4.39Å; V189-Y198 HydrophobicContact CG1-CD1 3.7Å; V189-Y198 HydrophobicContact CG1-CE1 3.81Å; V189-Y198 HydrophobicContact CG1-CG 4.22Å; V189-Y198 HydrophobicContact CG2-CD1 4.25Å; V189-Y198 HydrophobicContact CG2-CD2 3.87Å; V189-Y198 HydrophobicContact CG2-CE1 4.37Å; V189-Y198 HydrophobicContact CG2-CE2 4.04Å; V189-Y198 HydrophobicContact CG2-CG 4Å
190	T	82.1	Confident	84	Confident	102 Å²	102	52.5 Å²	52.5	63%	0.626	29%	0.289	S	S	*	.	H	α-helix	trans	-74.8	-47.5	177.1	79	0	0	0	0	111.8	P187 F188 H192 G193	P187-T190 WeakPolarHBondContact O-CA 3.42Å; P187-T190 WeakPolarHBondContact O-CB 3.44Å; P187-T190 PolarHBondContact O-N 2.73Å; P187-T190 PolarHBondContact O-OG1 3.26Å; F188-T190 VanDerWaalsContact C-N 3.26Å; F188-T190 PolarHBondContact O-N 3.34Å; T190-H192 VanDerWaalsContact C-N 3.35Å; T190-H192 PolarHBondContact O-N 3.11Å; T190-G193 PolarHBondContact O-N 3.26Å; T190-G193 VanDerWaalsContact O-N 3.16Å
191	K	81.5	Confident	83.7	Confident	96 Å²	96	52.8 Å²	52.8	42%	0.417	29%	0.291	S	S	.	.	H	α-helix	trans	-58	-43.5	179.3	-72.2	-171.4	-170.3	175.6	0	112.1	E164 D165 P187 F188 G193	E164-K191 VanDerWaalsContact CD-CE 3.45Å; E164-K191 VanDerWaalsContact CD-NZ 3.28Å; E164-K191 WeakPolarHBondContact O-CD 3.22Å; E164-K191 WeakPolarHBondContact O-CE 3.17Å; E164-K191 PolarHBondContact O-NZ 3.08Å; E164-K191 WeakPolarHBondContact OE1-CE 3.34Å; E164-K191 IonicContact OE1-NZ 3.92Å; E164-K191 WeakPolarHBondContact OE2-CE 3.26Å; E164-K191 IonicContact OE2-NZ 2.91Å; E164-K191 PolarHBondContact OE2-NZ 3.14Å; D165-K191 IonicContact OD1-NZ 3.17Å; D165-K191 PolarHBondContact OD1-NZ 3.36Å; P187-K191 PolarHBondContact O-N 2.93Å; F188-K191 PolarHBondContact O-N 2.82Å; K191-G193 PolarHBondContact O-N 3.33Å
192	H	75.3	Confident	83.3	Confident	61 Å²	61	52.8 Å²	52.8	28%	0.282	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	0.9	-177.5	-79.1	-78.2	0	0	0	114.7	F188 T190 R197	F188-H192 AromaticContact CD2-CD2 3.46Å; F188-H192 VanDerWaalsContact CD2-CD2 3.46Å; F188-H192 WeakPolarHBondContact CD2-CD2 3.3Å; F188-H192 AromaticContact CD2-NE2 3.72Å; F188-H192 AromaticContact CE2-CD2 3.25Å; F188-H192 WeakPolarHBondContact CE2-CD2 3.32Å; F188-H192 AromaticContact CE2-NE2 3.28Å; F188-H192 VanDerWaalsContact CE2-NE2 3.28Å; F188-H192 WeakPolarHBondContact CE2-NE2 3.43Å; F188-H192 AromaticContact CZ-CD2 3.64Å; F188-H192 AromaticContact CZ-NE2 3.95Å; F188-H192 PolarHBondContact O-CD2 2.77Å; F188-H192 PolarHBondContact O-N 2.48Å; T190-H192 VanDerWaalsContact C-N 3.35Å; T190-H192 PolarHBondContact O-N 3.11Å; H192-R197 WeakPolarHBondContact O-CB 3.47Å; H192-R197 VanDerWaalsContact O-CD 3.29Å; H192-R197 WeakPolarHBondContact O-CD 3.44Å
193	G	65.1	Low	83	Confident	44 Å²	44	57 Å²	57	45%	0.454	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	42.6	165.6	0	0	0	0	0	114.9	T190 K191	T190-G193 PolarHBondContact O-N 3.26Å; T190-G193 VanDerWaalsContact O-N 3.16Å; K191-G193 PolarHBondContact O-N 3.33Å
194	G	69.5	Low	82.7	Confident	34 Å²	34	62 Å²	62	35%	0.351	33%	0.327	S	S	.	.	S	Bend	trans	87.6	171.1	168.5	0	0	0	0	0	115	V196 R197	G194-V196 VanDerWaalsContact C-N 3.29Å; G194-V196 PolarHBondContact O-N 3.33Å; G194-R197 PolarHBondContact O-N 3.01Å
195	K	73.8	Confident	82.5	Confident	112 Å²	112	61 Å²	61	49%	0.487	32%	0.323	S	S	.	.	H	α-helix	trans	-59	-30.1	-153.4	-66.8	-153.5	-176.5	-158.2	0	116.5	E184 Y198 R199	E184-K195 WeakPolarHBondContact OE1-CE 3.42Å; E184-K195 IonicContact OE1-NZ 2.76Å; E184-K195 PolarHBondContact OE1-NZ 2.79Å; E184-K195 IonicContact OE2-NZ 3.12Å; E184-K195 PolarHBondContact OE2-NZ 2.82Å; K195-Y198 HydrophobicContact CB-CE1 4.02Å; K195-Y198 HydrophobicContact CG-CE1 4.22Å; K195-Y198 WeakPolarHBondContact O-CD1 3.19Å; K195-Y198 VanDerWaalsContact O-CE1 3.25Å; K195-Y198 WeakPolarHBondContact O-CE1 3.33Å; K195-R199 WeakPolarHBondContact O-CD 3.26Å; K195-R199 VanDerWaalsContact O-CG 3.26Å; K195-R199 WeakPolarHBondContact O-CG 3.4Å
196	V	73	Confident	82.5	Confident	132 Å²	132	58.4 Å²	58.4	80%	0.8	30%	0.296	S	S	*	.	H	α-helix	trans	-74.6	-29.2	-179.4	-176.2	0	0	0	0	112.5	G194	G194-V196 VanDerWaalsContact C-N 3.29Å; G194-V196 PolarHBondContact O-N 3.33Å
197	R	82.2	Confident	82.2	Confident	173 Å²	173	63.3 Å²	63.3	65%	0.653	33%	0.33	S	S	*	.	H	α-helix	trans	-85	-48.8	-172.4	-74.1	-175.8	175.3	-175.3	0.2	113.2	H192 G194 R199 K200 V201	H192-R197 WeakPolarHBondContact O-CB 3.47Å; H192-R197 VanDerWaalsContact O-CD 3.29Å; H192-R197 WeakPolarHBondContact O-CD 3.44Å; G194-R197 PolarHBondContact O-N 3.01Å; R197-R199 VanDerWaalsContact C-N 3.29Å; R197-R199 PolarHBondContact O-N 2.75Å; R197-K200 WeakPolarHBondContact O-CB 3.49Å; R197-K200 PolarHBondContact O-N 3.17Å; R197-K200 VanDerWaalsContact O-N 3.08Å; R197-V201 PolarHBondContact O-N 3.29Å
198	Y	87.9	Confident	82.1	Confident	1 Å²	1	64.7 Å²	64.7	0%	0.004	33%	0.334	C	S	.	.	H	α-helix	trans	-60.2	-41.7	-179.2	86.1	-87.4	0	0	0	110.7	F188 V189 K195 K200 V201 V202 L212 D213	F188-Y198 HydrophobicContact CE1-CD2 4.36Å; V189-Y198 HydrophobicContact CB-CD1 4.35Å; V189-Y198 HydrophobicContact CB-CG 4.39Å; V189-Y198 HydrophobicContact CG1-CD1 3.7Å; V189-Y198 HydrophobicContact CG1-CE1 3.81Å; V189-Y198 HydrophobicContact CG1-CG 4.22Å; V189-Y198 HydrophobicContact CG2-CD1 4.25Å; V189-Y198 HydrophobicContact CG2-CD2 3.87Å; V189-Y198 HydrophobicContact CG2-CE1 4.37Å; V189-Y198 HydrophobicContact CG2-CE2 4.04Å; V189-Y198 HydrophobicContact CG2-CG 4Å; K195-Y198 HydrophobicContact CB-CE1 4.02Å; K195-Y198 HydrophobicContact CG-CE1 4.22Å; K195-Y198 WeakPolarHBondContact O-CD1 3.19Å; K195-Y198 VanDerWaalsContact O-CE1 3.25Å; K195-Y198 WeakPolarHBondContact O-CE1 3.33Å; Y198-K200 PolarHBondContact O-N 2.64Å; Y198-K200 VanDerWaalsContact O-N 3.14Å; Y198-V201 CarbonylContact O-C 3.29Å; Y198-V201 WeakPolarHBondContact O-CA 3.22Å; Y198-V201 PolarHBondContact O-N 3.33Å; Y198-V202 HydrophobicContact CD2-CG2 4Å; Y198-V202 WeakPolarHBondContact O-CG2 3.44Å; Y198-V202 PolarHBondContact O-N 2.76Å; Y198-L212 HydrophobicContact CE2-CD2 4.43Å; Y198-D213 VanDerWaalsContact CE2-OD2 3.28Å; Y198-D213 WeakPolarHBondContact CE2-OD2 3.26Å; Y198-D213 VanDerWaalsContact CZ-OD2 3.25Å; Y198-D213 VanDerWaalsContact OH-CG 3.29Å; Y198-D213 PolarHBondContact OH-OD2 3.22Å
199	R	85.8	Confident	82.2	Confident	31 Å²	31	65 Å²	65	12%	0.117	34%	0.336	C	S	.	.	H	α-helix	trans	-57.3	-29.7	176.2	-63.2	-178.2	74.9	80.2	3.7	114.1	K195 R197 R203 L212 D213 I215	K195-R199 WeakPolarHBondContact O-CD 3.26Å; K195-R199 VanDerWaalsContact O-CG 3.26Å; K195-R199 WeakPolarHBondContact O-CG 3.4Å; R197-R199 VanDerWaalsContact C-N 3.29Å; R197-R199 PolarHBondContact O-N 2.75Å; R199-R203 WeakPolarHBondContact O-CB 3.35Å; R199-R203 PolarHBondContact O-N 3.2Å; R199-L212 HydrophobicContact CB-CD2 4.15Å; R199-L212 HydrophobicContact CG-CD2 4Å; R199-L212 PolarHBondContact NH1-O 3.13Å; R199-L212 PolarHBondContact NH2-O 3.41Å; R199-D213 IonicContact NH1-OD2 3.17Å; R199-D213 PolarHBondContact NH1-OD2 2.83Å; R199-D213 VanDerWaalsContact NH1-OD2 3.11Å; R199-I215 PolarHBondContact NH2-O 2.84Å
200	K	84.7	Confident	82.3	Confident	123 Å²	123	66.9 Å²	66.9	54%	0.535	35%	0.35	S	S	.	.	H	α-helix	trans	-74.2	-42.8	173	-169.6	174.8	-174.1	-73.3	0	111.3	R197 Y198 R203 E204	R197-K200 WeakPolarHBondContact O-CB 3.49Å; R197-K200 PolarHBondContact O-N 3.17Å; R197-K200 VanDerWaalsContact O-N 3.08Å; Y198-K200 PolarHBondContact O-N 2.64Å; Y198-K200 VanDerWaalsContact O-N 3.14Å; K200-R203 PolarHBondContact O-N 3.18Å; K200-E204 IonicContact NZ-OE1 2.73Å; K200-E204 PolarHBondContact NZ-OE1 3.37Å; K200-E204 VanDerWaalsContact O-CG 3.29Å; K200-E204 WeakPolarHBondContact O-CG 3.37Å; K200-E204 PolarHBondContact O-N 3Å
201	V	87.1	Confident	82.7	Confident	25 Å²	25	65 Å²	65	15%	0.152	34%	0.335	C	S	.	.	H	α-helix	trans	-66.2	-40.1	177.4	-179.9	0	0	0	0	111.8	K166 F188 R197 Y198 E204 E205	K166-V201 HydrophobicContact CD-CG1 3.95Å; K166-V201 HydrophobicContact CG-CG1 4.29Å; F188-V201 HydrophobicContact CZ-CB 4.49Å; F188-V201 HydrophobicContact CZ-CG1 4.07Å; R197-V201 PolarHBondContact O-N 3.29Å; Y198-V201 CarbonylContact O-C 3.29Å; Y198-V201 WeakPolarHBondContact O-CA 3.22Å; Y198-V201 PolarHBondContact O-N 3.33Å; V201-E204 PolarHBondContact O-N 2.95Å; V201-E205 PolarHBondContact O-N 2.87Å
202	V	88	Confident	83.1	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.006	32%	0.315	C	S	.	.	H	α-helix	trans	-61.9	-47.5	175.4	176.7	0	0	0	0	110.2	L169 L183 F188 Y198 E204 E205 L206 L212	L169-V202 HydrophobicContact CD1-CG2 4.22Å; L183-V202 HydrophobicContact CD1-CG2 3.84Å; F188-V202 HydrophobicContact CE1-CG2 3.78Å; F188-V202 HydrophobicContact CZ-CG2 4.3Å; Y198-V202 HydrophobicContact CD2-CG2 4Å; Y198-V202 WeakPolarHBondContact O-CG2 3.44Å; Y198-V202 PolarHBondContact O-N 2.76Å; V202-E204 VanDerWaalsContact C-N 3.26Å; V202-E204 PolarHBondContact O-N 3.28Å; V202-E205 PolarHBondContact O-N 3.25Å; V202-E205 VanDerWaalsContact O-N 3.12Å; V202-L206 HydrophobicContact CG1-CD1 4.31Å; V202-L206 WeakPolarHBondContact O-CB 3.1Å; V202-L206 PolarHBondContact O-N 2.68Å; V202-L212 HydrophobicContact CB-CD2 3.86Å; V202-L212 HydrophobicContact CG1-CD1 4.03Å; V202-L212 HydrophobicContact CG1-CD2 3.73Å; V202-L212 HydrophobicContact CG2-CD2 4.36Å
203	R	85.7	Confident	83.8	Confident	107 Å²	107	58 Å²	58	40%	0.404	31%	0.305	S	S	.	.	H	α-helix	trans	-62.8	-29.3	176	-171.7	-176	-61	137.3	0.3	113.7	R199 K200 E205 I217	R199-R203 WeakPolarHBondContact O-CB 3.35Å; R199-R203 PolarHBondContact O-N 3.2Å; K200-R203 PolarHBondContact O-N 3.18Å; R203-E205 VanDerWaalsContact C-N 3.32Å; R203-I217 VanDerWaalsContact NE-CG2 3.26Å
204	E	86.2	Confident	84.7	Confident	105 Å²	105	62.6 Å²	62.6	49%	0.491	32%	0.319	S	S	.	.	H	α-helix	trans	-72.4	-23.1	176.2	-78	168	179.3	0	0	113.1	K200 V201 V202	K200-E204 IonicContact NZ-OE1 2.73Å; K200-E204 PolarHBondContact NZ-OE1 3.37Å; K200-E204 VanDerWaalsContact O-CG 3.29Å; K200-E204 WeakPolarHBondContact O-CG 3.37Å; K200-E204 PolarHBondContact O-N 3Å; V201-E204 PolarHBondContact O-N 2.95Å; V202-E204 VanDerWaalsContact C-N 3.26Å; V202-E204 PolarHBondContact O-N 3.28Å
205	E	85.5	Confident	85.5	Confident	40 Å²	40	65.4 Å²	65.4	19%	0.187	33%	0.325	C	S	.	.	H	α-helix	trans	-101.2	-38.7	176.8	-64.6	-58.1	122.8	0	0	113.8	K166 R173 V201 V202 R203	K166-E205 HydrophobicContact CD-CG 4.39Å; K166-E205 WeakPolarHBondContact CE-OE1 3.29Å; K166-E205 HydrophobicContact CG-CG 4.28Å; K166-E205 VanDerWaalsContact NZ-CD 3.35Å; K166-E205 IonicContact NZ-OE1 3.75Å; K166-E205 PolarHBondContact NZ-OE1 2.77Å; R173-E205 WeakPolarHBondContact CD-O 3.44Å; V201-E205 PolarHBondContact O-N 2.87Å; V202-E205 PolarHBondContact O-N 3.25Å; V202-E205 VanDerWaalsContact O-N 3.12Å; R203-E205 VanDerWaalsContact C-N 3.32Å
206	L	87.7	Confident	86.1	Confident	1 Å²	1	64 Å²	64	1%	0.005	33%	0.327	C	S	.	.			trans	-119.1	73.3	-169.8	-58.2	179.2	0	0	0	109.4	L169 L172 R173 L181 V202 Q208 I209	L169-L206 HydrophobicContact CB-CD1 4.49Å; L172-L206 HydrophobicContact CB-CD1 3.96Å; L172-L206 HydrophobicContact CB-CD2 4.01Å; L172-L206 HydrophobicContact CD1-CD1 4.26Å; R173-L206 HydrophobicContact CB-CD2 3.71Å; R173-L206 HydrophobicContact CG-CD2 4.39Å; R173-L206 VanDerWaalsContact N-CD2 3.27Å; L181-L206 HydrophobicContact CD2-CD1 4.04Å; V202-L206 HydrophobicContact CG1-CD1 4.31Å; V202-L206 WeakPolarHBondContact O-CB 3.1Å; V202-L206 PolarHBondContact O-N 2.68Å; L206-Q208 VanDerWaalsContact C-OE1 3.28Å; L206-Q208 VanDerWaalsContact CA-OE1 3.3Å; L206-Q208 PolarHBondContact O-N 3.03Å; L206-I209 HydrophobicContact CB-CD1 3.57Å; L206-I209 HydrophobicContact CB-CG1 4.04Å; L206-I209 HydrophobicContact CD1-CD1 3.63Å; L206-I209 HydrophobicContact CG-CD1 4.2Å
207	S	83.8	Confident	86.3	Confident	103 Å²	103	58.4 Å²	58.4	72%	0.72	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-4.2	-178.4	59.9	0	0	0	0	114.3
208	Q	86.6	Confident	85.4	Confident	52 Å²	52	57.7 Å²	57.7	24%	0.243	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-13.2	177.9	77.5	-78.1	16.2	0	0	113.9	L172 C175 L206	L172-Q208 PolarHBondContact O-NE2 3.1Å; C175-Q208 PolarHBondContact O-NE2 3.41Å; L206-Q208 VanDerWaalsContact C-OE1 3.28Å; L206-Q208 VanDerWaalsContact CA-OE1 3.3Å; L206-Q208 PolarHBondContact O-N 3.03Å
209	I	88.9	Confident	83.8	Confident	9 Å²	9	64.2 Å²	64.2	5%	0.046	33%	0.332	C	S	.	.			trans	-78.6	125.9	-175.6	-65.2	178.8	0	0	0	110.6	L178 L181 L206 I211 L212 I217	L178-I209 HydrophobicContact CD2-CD1 4.22Å; L178-I209 HydrophobicContact CD2-CG1 4.47Å; L178-I209 HydrophobicContact CG-CG1 4.38Å; L181-I209 HydrophobicContact CB-CD1 3.81Å; L181-I209 HydrophobicContact CB-CG2 4.45Å; L181-I209 HydrophobicContact CD2-CD1 3.55Å; L181-I209 HydrophobicContact CG-CD1 4.33Å; L206-I209 HydrophobicContact CB-CD1 3.57Å; L206-I209 HydrophobicContact CB-CG1 4.04Å; L206-I209 HydrophobicContact CD1-CD1 3.63Å; L206-I209 HydrophobicContact CG-CD1 4.2Å; I209-I211 WeakPolarHBondContact CG2-O 3.22Å; I209-L212 HydrophobicContact CG2-CB 4.31Å; I209-I217 HydrophobicContact CG2-CD1 4.28Å
210	S	88.4	Confident	81.7	Confident	53 Å²	53	68.1 Å²	68.1	37%	0.371	36%	0.355	S	S	.	.	S	Bend	trans	-97.2	-27.8	176.8	68.5	0	0	0	0	113	T179 P216 I217	T179-S210 PolarHBondContact O-N 3.04Å; T179-S210 PolarHBondContact O-OG 3.02Å; S210-P216 CarbonylContact O-C 3.21Å; S210-P216 WeakPolarHBondContact O-CA 3.46Å; S210-I217 PolarHBondContact O-N 2.98Å
211	I	90.5	Very high	79.4	Confident	61 Å²	61	68.3 Å²	68.3	31%	0.313	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	126.2	177.9	-58	174.6	0	0	0	109.2	T179 S180 L181 I209	T179-I211 PolarHBondContact O-N 3.2Å; S180-I211 WeakPolarHBondContact CA-O 3.25Å; L181-I211 PolarHBondContact N-O 2.85Å; I209-I211 WeakPolarHBondContact CG2-O 3.22Å
212	L	90.5	Very high	76.9	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	120.9	176.7	175	61.8	0	0	0	108.1	L181 L183 Y198 R199 V202 I209 D214 I215 I217	L181-L212 HydrophobicContact CB-CD1 4.42Å; L181-L212 HydrophobicContact CD2-CD1 4.48Å; L181-L212 HydrophobicContact CG-CD1 4.46Å; L181-L212 CarbonylContact O-C 3.45Å; L181-L212 VanDerWaalsContact O-CA 3.31Å; L181-L212 WeakPolarHBondContact O-CA 3.38Å; L183-L212 HydrophobicContact CD1-CD1 4.45Å; Y198-L212 HydrophobicContact CE2-CD2 4.43Å; R199-L212 HydrophobicContact CB-CD2 4.15Å; R199-L212 HydrophobicContact CG-CD2 4Å; R199-L212 PolarHBondContact NH1-O 3.13Å; R199-L212 PolarHBondContact NH2-O 3.41Å; V202-L212 HydrophobicContact CB-CD2 3.86Å; V202-L212 HydrophobicContact CG1-CD1 4.03Å; V202-L212 HydrophobicContact CG1-CD2 3.73Å; V202-L212 HydrophobicContact CG2-CD2 4.36Å; I209-L212 HydrophobicContact CG2-CB 4.31Å; L212-D214 PolarHBondContact O-N 2.81Å; L212-I215 PolarHBondContact N-O 3.45Å; L212-I215 VanDerWaalsContact N-O 3.11Å; L212-I215 PolarHBondContact O-N 3.06Å; L212-I215 VanDerWaalsContact O-N 3.09Å; L212-I217 HydrophobicContact CB-CD1 3.99Å; L212-I217 HydrophobicContact CB-CG1 4.25Å; L212-I217 HydrophobicContact CD2-CD1 4.29Å
213	D	88.5	Confident	74.3	Confident	12 Å²	12	76.5 Å²	76.5	6%	0.064	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	57.5	-176.6	-44.4	-75.7	0	0	0	112.6	L181 L183 E184 Y198 R199 I215	L181-D213 PolarHBondContact O-N 2.88Å; L183-D213 PolarHBondContact N-OD1 3.24Å; E184-D213 HydrophobicContact CG-CB 3.98Å; E184-D213 PolarHBondContact N-OD1 2.86Å; Y198-D213 VanDerWaalsContact CE2-OD2 3.28Å; Y198-D213 WeakPolarHBondContact CE2-OD2 3.26Å; Y198-D213 VanDerWaalsContact CZ-OD2 3.25Å; Y198-D213 VanDerWaalsContact OH-CG 3.29Å; Y198-D213 PolarHBondContact OH-OD2 3.22Å; R199-D213 IonicContact NH1-OD2 3.17Å; R199-D213 PolarHBondContact NH1-OD2 2.83Å; R199-D213 VanDerWaalsContact NH1-OD2 3.11Å; D213-I215 WeakPolarHBondContact O-CG1 3.47Å; D213-I215 PolarHBondContact O-N 3.23Å
214	D	85.2	Confident	71.9	Confident	140 Å²	140	79.5 Å²	79.5	75%	0.749	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	-0.4	-175.3	-58	-35	0	0	0	116.8	L212	L212-D214 PolarHBondContact O-N 2.81Å
215	I	86.2	Confident	69.5	Low	92 Å²	92	79.7 Å²	79.7	47%	0.472	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	117.8	-177.1	-64.3	160.3	0	0	0	108.3	R199 L212 D213	R199-I215 PolarHBondContact NH2-O 2.84Å; L212-I215 PolarHBondContact N-O 3.45Å; L212-I215 VanDerWaalsContact N-O 3.11Å; L212-I215 PolarHBondContact O-N 3.06Å; L212-I215 VanDerWaalsContact O-N 3.09Å; D213-I215 WeakPolarHBondContact O-CG1 3.47Å; D213-I215 PolarHBondContact O-N 3.23Å
216	P	85.4	Confident	67.2	Low	83 Å²	83	81.3 Å²	81.3	54%	0.539	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	143.5	-179.7	25.4	-33.8	0	0	0	112	S210 Q218	S210-P216 CarbonylContact O-C 3.21Å; S210-P216 WeakPolarHBondContact O-CA 3.46Å; P216-Q218 PolarHBondContact O-N 2.94Å
217	I	78.6	Confident	64.7	Low	14 Å²	14	89.7 Å²	89.7	7%	0.072	52%	0.521	C	S	.	.			trans	-82.2	113	171.4	-70.2	-177.8	0	0	0	107.8	R203 I209 S210 L212 D219	R203-I217 VanDerWaalsContact NE-CG2 3.26Å; I209-I217 HydrophobicContact CG2-CD1 4.28Å; S210-I217 PolarHBondContact O-N 2.98Å; L212-I217 HydrophobicContact CB-CD1 3.99Å; L212-I217 HydrophobicContact CB-CG1 4.25Å; L212-I217 HydrophobicContact CD2-CD1 4.29Å; I217-D219 PolarHBondContact O-N 3.15Å
218	Q	63.3	Low	62.6	Low	159 Å²	159	92.6 Å²	92.6	74%	0.743	52%	0.517	S	S	*	.			trans	-80.7	112.4	175.5	-69.2	-178.8	-7.2	0	0	110.4	P216 N220	P216-Q218 PolarHBondContact O-N 2.94Å; Q218-N220 PolarHBondContact O-N 3.16Å
219	D	53.3	Low	60.5	Low	138 Å²	138	94.7 Å²	94.7	74%	0.738	53%	0.53	S	S	*	.			trans	-76.6	63.4	174.7	-69.8	-39.5	0	0	0	112.3	I217	I217-D219 PolarHBondContact O-N 3.15Å
220	N	41.7	Very low	58.6	Low	112 Å²	112	100.9 Å²	100.9	60%	0.599	56%	0.562	S	S	*	*			trans	-163.7	132.9	159.9	-114.9	-65.7	0	0	0	112.3	Q218 T222	Q218-N220 PolarHBondContact O-N 3.16Å; N220-T222 HydrophobicContact CB-CG2 3.96Å; N220-T222 PolarHBondContact O-N 2.87Å
221	P	36.6	Very low	56.9	Low	128 Å²	128	103 Å²	103	83%	0.831	57%	0.573	S	S	*	*			trans	-78.3	52.3	164.9	35.1	-34.8	0	0	0	110.8	S223	P221-S223 VanDerWaalsContact C-N 3.26Å; P221-S223 PolarHBondContact O-N 2.85Å
222	T	34.3	Very low	55.2	Low	84 Å²	84	107 Å²	107	52%	0.515	59%	0.588	S	S	.	*			trans	-70.7	79.8	175.6	36.3	0	0	0	0	111.1	N220 H224	N220-T222 HydrophobicContact CB-CG2 3.96Å; N220-T222 PolarHBondContact O-N 2.87Å; T222-H224 PolarHBondContact O-N 2.72Å
223	S	33.3	Very low	53.7	Low	113 Å²	113	111 Å²	111	79%	0.79	61%	0.606	S	S	*	*	S	Bend	trans	44.5	23	152.8	-60.4	0	0	0	0	118.9	P221	P221-S223 VanDerWaalsContact C-N 3.26Å; P221-S223 PolarHBondContact O-N 2.85Å
224	H	36.5	Very low	52.7	Low	171 Å²	171	115.3 Å²	115.3	79%	0.792	63%	0.629	S	S	*	*			trans	-105.9	65.5	170.3	-67.2	-33.4	0	0	0	110.1	T222 G226	T222-H224 PolarHBondContact O-N 2.72Å; H224-G226 PolarHBondContact O-N 2.96Å
225	S	35.3	Very low	51.8	Low	108 Å²	108	112.5 Å²	112.5	76%	0.755	62%	0.62	S	S	*	*			trans	-59.4	97.8	146.5	54.3	0	0	0	0	107	E227	S225-E227 PolarHBondContact O-N 3.28Å
226	G	37.3	Very low	51	Low	74 Å²	74	112.6 Å²	112.6	76%	0.763	62%	0.619	S	S	*	*			trans	-68.9	56.3	-172.6	0	0	0	0	0	115	H224 Y228	H224-G226 PolarHBondContact O-N 2.96Å; G226-Y228 PolarHBondContact O-N 3.09Å; G226-Y228 VanDerWaalsContact O-N 3.12Å
227	E	34.4	Very low	50.6	Low	177 Å²	177	114.4 Å²	114.4	83%	0.827	62%	0.615	S	S	*	*			trans	-61.3	99.9	141.1	-173.3	159.5	-143.8	0	0	104.9	S225 D229	S225-E227 PolarHBondContact O-N 3.28Å; E227-D229 PolarHBondContact O-N 3.1Å
228	Y	39.4	Very low	50.4	Low	164 Å²	164	119.7 Å²	119.7	64%	0.643	64%	0.639	S	S	*	*			trans	-57.8	110.3	-175.8	-153.2	-78.3	0	0	0	107.4	G226 I230	G226-Y228 PolarHBondContact O-N 3.09Å; G226-Y228 VanDerWaalsContact O-N 3.12Å; Y228-I230 PolarHBondContact O-N 3.22Å
229	D	42.6	Very low	50.9	Low	97 Å²	97	119.2 Å²	119.2	52%	0.519	63%	0.632	S	S	.	*			trans	-69.7	105.1	-172.4	-165	-27.8	0	0	0	108.7	E227 T231 K232	E227-D229 PolarHBondContact O-N 3.1Å; D229-T231 VanDerWaalsContact CG-OG1 3.27Å; D229-T231 PolarHBondContact O-N 3.45Å; D229-T231 VanDerWaalsContact O-N 3.11Å; D229-T231 WeakPolarHBondContact OD1-CB 3.2Å; D229-T231 PolarHBondContact OD1-N 2.78Å; D229-T231 VanDerWaalsContact OD1-N 3.15Å; D229-T231 PolarHBondContact OD1-OG1 3.36Å; D229-K232 WeakPolarHBondContact O-CB 3.06Å; D229-K232 PolarHBondContact O-N 3.21Å
230	I	49.6	Very low	52	Low	139 Å²	139	116 Å²	116	71%	0.713	61%	0.614	S	S	*	*	H	α-helix	trans	-60	-26.9	-172.8	-59.1	177.8	0	0	0	110.3	Y228 K232 F233	Y228-I230 PolarHBondContact O-N 3.22Å; I230-K232 PolarHBondContact O-N 3Å; I230-F233 WeakPolarHBondContact O-CB 3.16Å; I230-F233 PolarHBondContact O-N 3.42Å
231	T	52.6	Low	53.7	Low	98 Å²	98	112.7 Å²	112.7	60%	0.601	60%	0.596	S	S	*	*	H	α-helix	trans	-68.1	-17.7	175.8	68.2	0	0	0	0	113.9	D229	D229-T231 VanDerWaalsContact CG-OG1 3.27Å; D229-T231 PolarHBondContact O-N 3.45Å; D229-T231 VanDerWaalsContact O-N 3.11Å; D229-T231 WeakPolarHBondContact OD1-CB 3.2Å; D229-T231 PolarHBondContact OD1-N 2.78Å; D229-T231 VanDerWaalsContact OD1-N 3.15Å; D229-T231 PolarHBondContact OD1-OG1 3.36Å
232	K	55.6	Low	55.6	Low	143 Å²	143	110.1 Å²	110.1	62%	0.622	57%	0.574	S	S	*	*	H	α-helix	trans	-90.4	-21.6	177.7	-134.9	179.5	-175	-173.9	0	113	D229 I230 D234 S235	D229-K232 WeakPolarHBondContact O-CB 3.06Å; D229-K232 PolarHBondContact O-N 3.21Å; I230-K232 PolarHBondContact O-N 3Å; K232-D234 PolarHBondContact O-N 3.16Å; K232-S235 WeakPolarHBondContact O-CB 3.46Å; K232-S235 PolarHBondContact O-N 3.25Å; K232-S235 VanDerWaalsContact O-N 3.12Å
233	F	59	Low	57.4	Low	86 Å²	86	109 Å²	109	38%	0.377	57%	0.565	S	S	.	*	H	α-helix	trans	-59	-35.1	171.4	-178.8	-97.8	0	0	0	111.1	I230 S235 E236 W237	I230-F233 WeakPolarHBondContact O-CB 3.16Å; I230-F233 PolarHBondContact O-N 3.42Å; F233-S235 PolarHBondContact O-N 3.19Å; F233-E236 PolarHBondContact O-N 3.38Å; F233-E236 VanDerWaalsContact O-N 3.16Å; F233-W237 HydrophobicContact CD1-CB 4.04Å; F233-W237 HydrophobicContact CD1-CG 4.43Å; F233-W237 HydrophobicContact CE1-CB 3.75Å; F233-W237 AromaticContact CE1-CD2 3.82Å; F233-W237 HydrophobicContact CE1-CD2 3.82Å; F233-W237 AromaticContact CE1-CE3 3.98Å; F233-W237 HydrophobicContact CE1-CE3 3.98Å; F233-W237 AromaticContact CE1-CG 3.73Å; F233-W237 HydrophobicContact CE1-CG 3.73Å; F233-W237 HydrophobicContact CE2-CE3 4.4Å; F233-W237 HydrophobicContact CZ-CB 4.21Å; F233-W237 AromaticContact CZ-CD2 3.87Å; F233-W237 HydrophobicContact CZ-CD2 3.87Å; F233-W237 AromaticContact CZ-CE3 3.51Å; F233-W237 HydrophobicContact CZ-CE3 3.51Å; F233-W237 HydrophobicContact CZ-CG 4.19Å; F233-W237 HydrophobicContact CZ-CZ3 4.17Å; F233-W237 WeakPolarHBondContact O-CB 3.41Å; F233-W237 PolarHBondContact O-N 3.03Å
234	D	66.2	Low	59.5	Low	102 Å²	102	106.4 Å²	106.4	55%	0.545	54%	0.542	S	S	.	.	H	α-helix	trans	-56.3	-34.6	176.6	-64.4	-38.7	0	0	0	112.3	K232 E238	K232-D234 PolarHBondContact O-N 3.16Å; D234-E238 VanDerWaalsContact O-CB 3.27Å; D234-E238 WeakPolarHBondContact O-CB 3.2Å; D234-E238 PolarHBondContact O-N 3.39Å
235	S	67.4	Low	61.4	Low	81 Å²	81	105 Å²	105	57%	0.566	53%	0.533	S	S	*	.	H	α-helix	trans	-71.4	-42.5	177.6	-55.8	0	0	0	0	112.8	K232 F233 W237 Y239	K232-S235 WeakPolarHBondContact O-CB 3.46Å; K232-S235 PolarHBondContact O-N 3.25Å; K232-S235 VanDerWaalsContact O-N 3.12Å; F233-S235 PolarHBondContact O-N 3.19Å; S235-W237 VanDerWaalsContact C-N 3.35Å; S235-Y239 PolarHBondContact O-N 3.03Å; S235-Y239 VanDerWaalsContact O-N 3.16Å
236	E	68.6	Low	63.1	Low	94 Å²	94	106.9 Å²	106.9	44%	0.439	53%	0.53	S	S	.	.	H	α-helix	trans	-70.6	-35.7	177.5	-64.3	176.2	173.1	0	0	110.7	F233 Y239 I240	F233-E236 PolarHBondContact O-N 3.38Å; F233-E236 VanDerWaalsContact O-N 3.16Å; E236-Y239 PolarHBondContact O-N 3.03Å; E236-I240 WeakPolarHBondContact O-CB 3.42Å; E236-I240 WeakPolarHBondContact O-CD1 3.45Å; E236-I240 VanDerWaalsContact O-CG1 3.25Å; E236-I240 WeakPolarHBondContact O-CG1 3.44Å; E236-I240 PolarHBondContact O-N 3.35Å
237	W	76.7	Confident	64.6	Low	121 Å²	121	108.9 Å²	108.9	46%	0.458	52%	0.522	S	S	.	.	H	α-helix	trans	-72.2	-40.3	176.4	-163.7	-117.8	0	0	0	112.1	F233 S235 Y239 I240 N241	F233-W237 HydrophobicContact CD1-CB 4.04Å; F233-W237 HydrophobicContact CD1-CG 4.43Å; F233-W237 HydrophobicContact CE1-CB 3.75Å; F233-W237 AromaticContact CE1-CD2 3.82Å; F233-W237 HydrophobicContact CE1-CD2 3.82Å; F233-W237 AromaticContact CE1-CE3 3.98Å; F233-W237 HydrophobicContact CE1-CE3 3.98Å; F233-W237 AromaticContact CE1-CG 3.73Å; F233-W237 HydrophobicContact CE1-CG 3.73Å; F233-W237 HydrophobicContact CE2-CE3 4.4Å; F233-W237 HydrophobicContact CZ-CB 4.21Å; F233-W237 AromaticContact CZ-CD2 3.87Å; F233-W237 HydrophobicContact CZ-CD2 3.87Å; F233-W237 AromaticContact CZ-CE3 3.51Å; F233-W237 HydrophobicContact CZ-CE3 3.51Å; F233-W237 HydrophobicContact CZ-CG 4.19Å; F233-W237 HydrophobicContact CZ-CZ3 4.17Å; F233-W237 WeakPolarHBondContact O-CB 3.41Å; F233-W237 PolarHBondContact O-N 3.03Å; S235-W237 VanDerWaalsContact C-N 3.35Å; W237-Y239 VanDerWaalsContact C-N 3.32Å; W237-Y239 PolarHBondContact O-N 3Å; W237-I240 HydrophobicContact CE3-CD1 4.31Å; W237-I240 HydrophobicContact CE3-CG2 4.34Å; W237-I240 HydrophobicContact CZ3-CG2 4.29Å; W237-I240 PolarHBondContact O-N 2.97Å; W237-N241 PolarHBondContact NE1-ND2 3Å; W237-N241 VanDerWaalsContact NE1-ND2 3.18Å; W237-N241 WeakPolarHBondContact O-CB 3.27Å; W237-N241 VanDerWaalsContact O-CG 3.29Å; W237-N241 PolarHBondContact O-N 3.46Å; W237-N241 PolarHBondContact O-ND2 2.98Å
238	E	74.3	Confident	66	Low	124 Å²	124	103.3 Å²	103.3	58%	0.579	51%	0.512	S	S	*	.	H	α-helix	trans	-58.1	-45.9	171.1	-164.5	72.4	-140.3	0	0	110.2	D234 I240 N241 I242	D234-E238 VanDerWaalsContact O-CB 3.27Å; D234-E238 WeakPolarHBondContact O-CB 3.2Å; D234-E238 PolarHBondContact O-N 3.39Å; E238-I240 PolarHBondContact O-N 3.38Å; E238-N241 PolarHBondContact O-N 3.37Å; E238-I242 HydrophobicContact CG-CD1 4.15Å; E238-I242 WeakPolarHBondContact O-CB 3.45Å; E238-I242 VanDerWaalsContact O-CG1 3.25Å; E238-I242 WeakPolarHBondContact O-CG1 3.47Å; E238-I242 PolarHBondContact O-N 3.23Å
239	Y	74.6	Confident	66.9	Low	150 Å²	150	101.4 Å²	101.4	59%	0.588	51%	0.512	S	S	*	.	H	α-helix	trans	-62	-43.7	176.1	-178.6	-113.2	0	0	0	113.2	S235 E236 W237 I242 L243	S235-Y239 PolarHBondContact O-N 3.03Å; S235-Y239 VanDerWaalsContact O-N 3.16Å; E236-Y239 PolarHBondContact O-N 3.03Å; W237-Y239 VanDerWaalsContact C-N 3.32Å; W237-Y239 PolarHBondContact O-N 3Å; Y239-I242 PolarHBondContact O-N 3.24Å; Y239-L243 HydrophobicContact CD1-CD1 4.08Å; Y239-L243 HydrophobicContact CE1-CD1 3.57Å; Y239-L243 HydrophobicContact CE1-CG 4.47Å; Y239-L243 HydrophobicContact CE2-CD1 4.36Å; Y239-L243 HydrophobicContact CE2-CG 4.44Å; Y239-L243 PolarHBondContact O-N 2.86Å
240	I	76.6	Confident	67.4	Low	70 Å²	70	100.2 Å²	100.2	36%	0.359	51%	0.506	S	S	.	.	H	α-helix	trans	-63.1	-40.5	174.4	-72.2	164.3	0	0	0	111.2	E236 W237 E238 L243 L244	E236-I240 WeakPolarHBondContact O-CB 3.42Å; E236-I240 WeakPolarHBondContact O-CD1 3.45Å; E236-I240 VanDerWaalsContact O-CG1 3.25Å; E236-I240 WeakPolarHBondContact O-CG1 3.44Å; E236-I240 PolarHBondContact O-N 3.35Å; W237-I240 HydrophobicContact CE3-CD1 4.31Å; W237-I240 HydrophobicContact CE3-CG2 4.34Å; W237-I240 HydrophobicContact CZ3-CG2 4.29Å; W237-I240 PolarHBondContact O-N 2.97Å; E238-I240 PolarHBondContact O-N 3.38Å; I240-L243 PolarHBondContact O-N 2.61Å; I240-L244 HydrophobicContact CG2-CD1 3.81Å; I240-L244 HydrophobicContact CG2-CG 4.4Å; I240-L244 WeakPolarHBondContact O-CB 3.25Å; I240-L244 VanDerWaalsContact O-CG 3.25Å; I240-L244 WeakPolarHBondContact O-CG 3.48Å; I240-L244 PolarHBondContact O-N 3.15Å
241	N	76.4	Confident	67.7	Low	42 Å²	42	98.7 Å²	98.7	23%	0.225	51%	0.507	C	S	.	.	H	α-helix	trans	-69.7	-34.2	176.7	-73	-56.7	0	0	0	112.3	W237 E238 K245 L250	W237-N241 PolarHBondContact NE1-ND2 3Å; W237-N241 VanDerWaalsContact NE1-ND2 3.18Å; W237-N241 WeakPolarHBondContact O-CB 3.27Å; W237-N241 VanDerWaalsContact O-CG 3.29Å; W237-N241 PolarHBondContact O-N 3.46Å; W237-N241 PolarHBondContact O-ND2 2.98Å; E238-N241 PolarHBondContact O-N 3.37Å; N241-K245 WeakPolarHBondContact O-CB 3.25Å; N241-K245 PolarHBondContact O-N 3.45Å; N241-L250 HydrophobicContact CB-CD1 4.02Å; N241-L250 WeakPolarHBondContact OD1-CD1 3.48Å
242	I	76.8	Confident	67.4	Low	75 Å²	75	96.7 Å²	96.7	39%	0.385	51%	0.506	S	S	.	.	H	α-helix	trans	-62.3	-51	171.5	-71.6	162.5	0	0	0	109.7	E238 Y239 L244 K245 E246	E238-I242 HydrophobicContact CG-CD1 4.15Å; E238-I242 WeakPolarHBondContact O-CB 3.45Å; E238-I242 VanDerWaalsContact O-CG1 3.25Å; E238-I242 WeakPolarHBondContact O-CG1 3.47Å; E238-I242 PolarHBondContact O-N 3.23Å; Y239-I242 PolarHBondContact O-N 3.24Å; I242-L244 PolarHBondContact O-N 3.47Å; I242-K245 CarbonylContact O-C 3.22Å; I242-K245 WeakPolarHBondContact O-CA 3.5Å; I242-K245 WeakPolarHBondContact O-CB 3.19Å; I242-K245 PolarHBondContact O-N 3.02Å; I242-E246 HydrophobicContact CG2-CG 4.5Å; I242-E246 WeakPolarHBondContact O-CG 3.3Å; I242-E246 PolarHBondContact O-N 2.72Å
243	L	72.8	Confident	66.8	Low	61 Å²	61	98.9 Å²	98.9	32%	0.319	52%	0.516	S	S	.	.	H	α-helix	trans	-58.4	-45.2	175.8	-76.3	170.2	0	0	0	112.5	Y239 I240 K245 E246 I247	Y239-L243 HydrophobicContact CD1-CD1 4.08Å; Y239-L243 HydrophobicContact CE1-CD1 3.57Å; Y239-L243 HydrophobicContact CE1-CG 4.47Å; Y239-L243 HydrophobicContact CE2-CD1 4.36Å; Y239-L243 HydrophobicContact CE2-CG 4.44Å; Y239-L243 PolarHBondContact O-N 2.86Å; I240-L243 PolarHBondContact O-N 2.61Å; L243-K245 PolarHBondContact O-N 3.36Å; L243-E246 PolarHBondContact O-N 3.05Å; L243-I247 WeakPolarHBondContact O-CB 3.43Å; L243-I247 WeakPolarHBondContact O-CD1 3.4Å; L243-I247 WeakPolarHBondContact O-CG1 3.42Å; L243-I247 PolarHBondContact O-N 3.09Å
244	L	76.5	Confident	65.8	Low	57 Å²	57	100.2 Å²	100.2	30%	0.298	53%	0.531	S	S	.	.	H	α-helix	trans	-66	-25.1	177	-72.4	170	0	0	0	113	I240 I242 G248 L249 L250	I240-L244 HydrophobicContact CG2-CD1 3.81Å; I240-L244 HydrophobicContact CG2-CG 4.4Å; I240-L244 WeakPolarHBondContact O-CB 3.25Å; I240-L244 VanDerWaalsContact O-CG 3.25Å; I240-L244 WeakPolarHBondContact O-CG 3.48Å; I240-L244 PolarHBondContact O-N 3.15Å; I242-L244 PolarHBondContact O-N 3.47Å; L244-G248 PolarHBondContact O-N 3.45Å; L244-L249 HydrophobicContact CD2-CB 4.28Å; L244-L249 HydrophobicContact CD2-CD1 3.91Å; L244-L249 WeakPolarHBondContact O-CA 3.07Å; L244-L249 PolarHBondContact O-N 3.3Å; L244-L250 HydrophobicContact CB-CD1 3.58Å; L244-L250 HydrophobicContact CB-CG 3.84Å; L244-L250 HydrophobicContact CD1-CD1 4.26Å; L244-L250 PolarHBondContact O-N 3.01Å; L244-L250 VanDerWaalsContact O-N 3.14Å
245	K	76.2	Confident	64.2	Low	142 Å²	142	104.2 Å²	104.2	62%	0.617	54%	0.544	S	S	*	.	H	α-helix	trans	-80.6	-38.8	174.2	-173.5	-179.1	179.8	-174.5	0	111.9	N241 I242 L243 G248 L250	N241-K245 WeakPolarHBondContact O-CB 3.25Å; N241-K245 PolarHBondContact O-N 3.45Å; I242-K245 CarbonylContact O-C 3.22Å; I242-K245 WeakPolarHBondContact O-CA 3.5Å; I242-K245 WeakPolarHBondContact O-CB 3.19Å; I242-K245 PolarHBondContact O-N 3.02Å; L243-K245 PolarHBondContact O-N 3.36Å; K245-G248 PolarHBondContact O-N 3.49Å; K245-G248 VanDerWaalsContact O-N 3.12Å; K245-L250 HydrophobicContact CB-CB 4.44Å
246	E	70.9	Confident	62.5	Low	148 Å²	148	106.7 Å²	106.7	69%	0.692	55%	0.55	S	S	*	*	H	α-helix	trans	-64.2	-38	171.9	-72.2	-178.9	158.1	0	0	112.1	I242 L243 G248	I242-E246 HydrophobicContact CG2-CG 4.5Å; I242-E246 WeakPolarHBondContact O-CG 3.3Å; I242-E246 PolarHBondContact O-N 2.72Å; L243-E246 PolarHBondContact O-N 3.05Å; E246-G248 PolarHBondContact O-N 3.37Å
247	I	70.3	Confident	60.8	Low	116 Å²	116	110.1 Å²	110.1	60%	0.595	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-1.2	175.3	-59.4	162.8	0	0	0	111.5	L243 L249	L243-I247 WeakPolarHBondContact O-CB 3.43Å; L243-I247 WeakPolarHBondContact O-CD1 3.4Å; L243-I247 WeakPolarHBondContact O-CG1 3.42Å; L243-I247 PolarHBondContact O-N 3.09Å; I247-L249 VanDerWaalsContact C-N 3.28Å; I247-L249 HydrophobicContact CB-CD1 4.48Å; I247-L249 HydrophobicContact CG2-CD1 3.81Å; I247-L249 HydrophobicContact CG2-CG 4.07Å; I247-L249 PolarHBondContact O-N 3.22Å
248	G	62	Low	58.8	Low	60 Å²	60	109.9 Å²	109.9	62%	0.619	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.9	9	175.7	0	0	0	0	0	115.5	L244 K245 E246	L244-G248 PolarHBondContact O-N 3.45Å; K245-G248 PolarHBondContact O-N 3.49Å; K245-G248 VanDerWaalsContact O-N 3.12Å; E246-G248 PolarHBondContact O-N 3.37Å
249	L	60	Low	56.8	Low	123 Å²	123	111.5 Å²	111.5	64%	0.644	60%	0.595	S	S	*	*			trans	-81.7	-16	-179	-66.4	170	0	0	0	113.2	L244 I247	L244-L249 HydrophobicContact CD2-CB 4.28Å; L244-L249 HydrophobicContact CD2-CD1 3.91Å; L244-L249 WeakPolarHBondContact O-CA 3.07Å; L244-L249 PolarHBondContact O-N 3.3Å; I247-L249 VanDerWaalsContact C-N 3.28Å; I247-L249 HydrophobicContact CB-CD1 4.48Å; I247-L249 HydrophobicContact CG2-CD1 3.81Å; I247-L249 HydrophobicContact CG2-CG 4.07Å; I247-L249 PolarHBondContact O-N 3.22Å
250	L	52.8	Low	54.6	Low	72 Å²	72	107.7 Å²	107.7	38%	0.377	60%	0.601	S	S	.	*	S	Bend	trans	-110.4	100	173.3	-73.5	174.5	0	0	0	112	N241 L244 K245 G252	N241-L250 HydrophobicContact CB-CD1 4.02Å; N241-L250 WeakPolarHBondContact OD1-CD1 3.48Å; L244-L250 HydrophobicContact CB-CD1 3.58Å; L244-L250 HydrophobicContact CB-CG 3.84Å; L244-L250 HydrophobicContact CD1-CD1 4.26Å; L244-L250 PolarHBondContact O-N 3.01Å; L244-L250 VanDerWaalsContact O-N 3.14Å; K245-L250 HydrophobicContact CB-CB 4.44Å; L250-G252 PolarHBondContact O-N 3.36Å
251	S	55.9	Low	52.4	Low	107 Å²	107	111.9 Å²	111.9	75%	0.748	62%	0.619	S	S	*	*			trans	-65.2	114.4	166.2	-178.2	0	0	0	0	110	K253	S251-K253 VanDerWaalsContact C-N 3.31Å; S251-K253 PolarHBondContact O-N 3.37Å
252	G	46.9	Very low	50.1	Low	56 Å²	56	118.3 Å²	118.3	58%	0.577	65%	0.645	S	S	*	*			trans	-71.7	73.4	-174.2	0	0	0	0	0	114.2	L250 T254	L250-G252 PolarHBondContact O-N 3.36Å; G252-T254 PolarHBondContact O-N 3.12Å
253	K	42.9	Very low	47.8	Very low	190 Å²	190	121 Å²	121	83%	0.826	67%	0.67	S	S	*	*			trans	-73.7	74.9	166.8	-74	-172.9	176.2	180	0	110.7	S251 K255	S251-K253 VanDerWaalsContact C-N 3.31Å; S251-K253 PolarHBondContact O-N 3.37Å; K253-K255 PolarHBondContact O-N 2.75Å
254	T	38.1	Very low	45.7	Very low	113 Å²	113	121.1 Å²	121.1	69%	0.693	69%	0.687	S	S	*	*			trans	-57.3	104.2	166.2	45.9	0	0	0	0	109.3	G252 N256	G252-T254 PolarHBondContact O-N 3.12Å; T254-N256 VanDerWaalsContact C-N 3.27Å; T254-N256 PolarHBondContact O-N 3.12Å
255	K	32.6	Very low	43.4	Very low	186 Å²	186	129.3 Å²	129.3	81%	0.809	72%	0.715	S	S	*	*			trans	-70.8	89.9	166.5	-74	-175.5	177.4	-179.9	0	108	K253 I257	K253-K255 PolarHBondContact O-N 2.75Å; K255-I257 VanDerWaalsContact C-N 3.32Å; K255-I257 PolarHBondContact O-N 2.92Å
256	N	31.2	Very low	41.2	Very low	133 Å²	133	128.3 Å²	128.3	71%	0.711	72%	0.723	S	S	*	*			trans	-63.6	99	164.1	-70.8	-5.4	0	0	0	107.2	T254 V258	T254-N256 VanDerWaalsContact C-N 3.27Å; T254-N256 PolarHBondContact O-N 3.12Å; N256-V258 HydrophobicContact CB-CG2 4.46Å; N256-V258 PolarHBondContact O-N 3.36Å
257	I	31.7	Very low	39.2	Very low	167 Å²	167	129.3 Å²	129.3	86%	0.856	73%	0.732	S	S	*	*			trans	-77.4	88.3	169.5	-60	176	0	0	0	105.6	K255	K255-I257 VanDerWaalsContact C-N 3.32Å; K255-I257 PolarHBondContact O-N 2.92Å
258	V	36.1	Very low	37.3	Very low	115 Å²	115	129.9 Å²	129.9	70%	0.697	74%	0.741	S	S	*	*			trans	-117.6	140.8	168.3	179.3	0	0	0	0	107.2	N256	N256-V258 HydrophobicContact CB-CG2 4.46Å; N256-V258 PolarHBondContact O-N 3.36Å
259	D	31	Very low	35.6	Very low	159 Å²	159	133.3 Å²	133.3	85%	0.85	75%	0.75	S	S	*	*			trans	-49.2	156.5	-168.5	-47.5	-75.2	0	0	0	116.1
260	G	29.2	Very low	34.1	Very low	70 Å²	70	131.1 Å²	131.1	72%	0.722	76%	0.757	S	S	*	*			trans	118.6	110.9	155.6	0	0	0	0	0	116.8
261	E	30.2	Very low	33	Very low	157 Å²	157	136.8 Å²	136.8	73%	0.734	78%	0.782	S	S	*	*			trans	40.7	106.3	136.7	-55	-134.9	95	0	0	121.5
262	K	28.8	Very low	31.6	Very low	178 Å²	178	138.4 Å²	138.4	77%	0.774	79%	0.788	S	S	*	*				45.5	125	129.1	-60.3	170.4	-168.2	133.5	0	120.6
263	S	28.1	Very low	30.9	Very low	130 Å²	130	143.5 Å²	143.5	91%	0.909	80%	0.8	S	S	*	*			trans	86.5	142.8	143.3	-156.7	0	0	0	0	118.3
264	G	27.8	Very low	30.3	Very low	65 Å²	65	143.3 Å²	143.3	67%	0.67	80%	0.802	S	S	*	*			trans	104.3	95.4	164	0	0	0	0	0	116.2
265	Y	28.1	Very low	29.8	Very low	228 Å²	228	143.2 Å²	143.2	89%	0.894	81%	0.812	S	S	*	*			trans	-78.8	143.8	146.1	-6	-89.7	0	0	0	107.5
266	P	30.9	Very low	29.6	Very low	121 Å²	121	137.7 Å²	137.7	79%	0.786	81%	0.808	S	S	*	*				-148	176.5	90.1	39.3	-22.4	0	0	0	116.3
267	L	28.1	Very low	29.4	Very low	170 Å²	170	142.6 Å²	142.6	89%	0.89	82%	0.817	S	S	*	*			trans	-75.7	129.6	173.1	174.6	81	0	0	0	111.8
268	V	30.3	Very low	29.5	Very low	128 Å²	128	140 Å²	140	78%	0.776	81%	0.813	S	S	*	*			trans	-137.5	153.2	163.3	-179.7	0	0	0	0	110.5
269	T	28	Very low	29.4	Very low	131 Å²	131	140.8 Å²	140.8	80%	0.804	82%	0.819	S	S	*	*			trans	-63.4	149.5	-168	47.1	0	0	0	0	116.5
270	G	26.6	Very low	29.6	Very low	78 Å²	78	139 Å²	139	80%	0.804	81%	0.809	S	S	*	*			trans	-76.3	-179.3	178.2	0	0	0	0	0	117.2
271	E	30.5	Very low	29.8	Very low	190 Å²	190	139.9 Å²	139.9	89%	0.888	82%	0.818	S	S	*	*			trans	-119	143.7	169.8	-70.3	-175.4	126.7	0	0	110
272	T	26.3	Very low	30.1	Very low	142 Å²	142	139.1 Å²	139.1	87%	0.871	82%	0.818	S	S	*	*			trans	-92.3	131.4	172.9	45.5	0	0	0	0	110.4
273	I	33	Very low	30.7	Very low	163 Å²	163	141 Å²	141	84%	0.836	82%	0.82	S	S	*	*			trans	-125.2	137.1	167.8	-60.7	-178.7	0	0	0	108.4
274	E	29.4	Very low	31.2	Very low	185 Å²	185	140.1 Å²	140.1	86%	0.864	81%	0.812	S	S	*	*			trans	-78.3	149.3	-160.3	-61	171.5	103.9	0	0	114.9	G276	E274-G276 VanDerWaalsContact C-N 3.32Å; E274-G276 PolarHBondContact O-N 2.89Å
275	A	28.1	Very low	31.5	Very low	111 Å²	111	143.3 Å²	143.3	92%	0.917	82%	0.818	S	S	*	*			trans	-80	70	178.8	0	0	0	0	0	112.8	R277	A275-R277 PolarHBondContact O-N 3.11Å
276	G	28.1	Very low	32.2	Very low	70 Å²	70	138 Å²	138	72%	0.722	82%	0.815	S	S	*	*			trans	-77.1	98.4	179.1	0	0	0	0	0	114.6	E274	E274-G276 VanDerWaalsContact C-N 3.32Å; E274-G276 PolarHBondContact O-N 2.89Å
277	R	27.3	Very low	32.3	Very low	237 Å²	237	136.7 Å²	136.7	89%	0.894	81%	0.814	S	S	*	*			trans	38.9	109.6	159	-65.3	-179.5	175.3	-176.7	-1.7	118.1	A275	A275-R277 PolarHBondContact O-N 3.11Å
278	S	32.6	Very low	32.7	Very low	111 Å²	111	135.9 Å²	135.9	78%	0.776	81%	0.81	S	S	*	*			trans	-119.7	101	158	-170.1	0	0	0	0	111.8
279	T	34	Very low	32.8	Very low	133 Å²	133	139.2 Å²	139.2	82%	0.816	81%	0.814	S	S	*	*			trans	-99.1	53	176.1	54.6	0	0	0	0	111.1
280	L	36.7	Very low	33	Very low	121 Å²	121	142.1 Å²	142.1	63%	0.634	82%	0.818	S	S	*	*			trans	-136.4	93.9	-178	-76.1	178.7	0	0	0	112.1	L282	L280-L282 HydrophobicContact CB-CD1 4.33Å; L280-L282 HydrophobicContact CB-CG 4.24Å; L280-L282 HydrophobicContact CD1-CD1 4.37Å; L280-L282 PolarHBondContact O-N 3.15Å
281	G	31.9	Very low	33.3	Very low	89 Å²	89	147.8 Å²	147.8	92%	0.918	82%	0.821	S	S	*	*			trans	-74.4	72.5	167.6	0	0	0	0	0	111.7	R283	G281-R283 PolarHBondContact O-N 3.33Å
282	L	37.8	Very low	33.3	Very low	141 Å²	141	149.4 Å²	149.4	74%	0.738	82%	0.82	S	S	*	*			trans	-83.3	104.1	179.6	-72.8	171.1	0	0	0	111.4	L280	L280-L282 HydrophobicContact CB-CD1 4.33Å; L280-L282 HydrophobicContact CB-CG 4.24Å; L280-L282 HydrophobicContact CD1-CD1 4.37Å; L280-L282 PolarHBondContact O-N 3.15Å
283	R	41.2	Very low	33.5	Very low	216 Å²	216	152.2 Å²	152.2	82%	0.815	82%	0.823	S	S	*	*			trans	-65.3	133.9	172.7	-178.1	178	-176.2	158.4	1.2	110.5	G281 T285	G281-R283 PolarHBondContact O-N 3.33Å; R283-T285 PolarHBondContact O-N 3.3Å
284	P	38.8	Very low	33.4	Very low	113 Å²	113	153.2 Å²	153.2	73%	0.734	82%	0.822	S	S	*	*			trans	-56.9	127.7	175.4	-26.6	35.4	0	0	0	112.6	S286	P284-S286 PolarHBondContact O-N 3.29Å
285	T	33.8	Very low	33.3	Very low	131 Å²	131	150 Å²	150	80%	0.804	82%	0.819	S	S	*	*			trans	-90.6	71.2	-172.6	50.6	0	0	0	0	112.6	R283	R283-T285 PolarHBondContact O-N 3.3Å
286	S	42	Very low	33.3	Very low	118 Å²	118	152 Å²	152	83%	0.825	81%	0.813	S	S	*	*			trans	-101.9	-3.2	170.2	55.4	0	0	0	0	114	P284	P284-S286 PolarHBondContact O-N 3.29Å
287	A	34.6	Very low	33.4	Very low	93 Å²	93	156 Å²	156	77%	0.769	82%	0.817	S	S	*	*			trans	-108	51.5	-175.4	0	0	0	0	0	113.5
288	L	35.2	Very low	33.3	Very low	153 Å²	153	152.4 Å²	152.4	80%	0.801	81%	0.81	S	S	*	*			trans	-111.8	111.1	170.2	-96.3	167.3	0	0	0	110.5	Q290	L288-Q290 PolarHBondContact O-N 2.79Å
289	K	33.4	Very low	33.2	Very low	197 Å²	197	157 Å²	157	86%	0.857	82%	0.817	S	S	*	*			trans	-54.8	128.1	176.5	-68.8	178.6	177	177.4	0	110.3	K291	K289-K291 PolarHBondContact O-N 3.16Å
290	Q	31.8	Very low	33	Very low	193 Å²	193	155.7 Å²	155.7	90%	0.902	81%	0.808	S	S	*	*			trans	-57.9	109	161.3	-74.6	179.6	-22.6	0	0	108.2	L288	L288-Q290 PolarHBondContact O-N 2.79Å
291	K	33	Very low	32.9	Very low	196 Å²	196	158.8 Å²	158.8	85%	0.852	82%	0.819	S	S	*	*			trans	-70.6	135	171.4	-78.8	-175.4	175.6	179.3	0	108.6	K289 Q293	K289-K291 PolarHBondContact O-N 3.16Å; K291-Q293 PolarHBondContact O-N 3.19Å
292	Y	31.5	Very low	32.9	Very low	225 Å²	225	159.5 Å²	159.5	88%	0.882	81%	0.808	S	S	*	*			trans	-49.8	133.2	168.9	-89.6	-111.6	0	0	0	110.4	K294	Y292-K294 PolarHBondContact O-N 3.12Å; Y292-K294 VanDerWaalsContact O-N 3.16Å
293	Q	30.1	Very low	32.7	Very low	200 Å²	200	161.4 Å²	161.4	94%	0.935	81%	0.81	S	S	*	*			trans	-63.7	114.1	163.4	-74.4	179.3	-25.6	0	0	108.2	K291	K291-Q293 PolarHBondContact O-N 3.19Å
294	K	29.8	Very low	32.4	Very low	184 Å²	184	158 Å²	158	80%	0.8	81%	0.809	S	S	*	*			trans	-106.9	107.2	166.3	-163.4	172.5	-173	178.5	0	107.3	Y292 I296	Y292-K294 PolarHBondContact O-N 3.12Å; Y292-K294 VanDerWaalsContact O-N 3.16Å; K294-I296 PolarHBondContact O-N 2.94Å
295	S	28.1	Very low	32.2	Very low	117 Å²	117	155.1 Å²	155.1	82%	0.818	80%	0.799	S	S	*	*			trans	-61.7	115.9	178.8	50.8	0	0	0	0	110.3
296	I	27.5	Very low	32.3	Very low	153 Å²	153	159.3 Å²	159.3	79%	0.785	80%	0.802	S	S	*	*			trans	-110.8	126.2	168.2	-64.3	178.5	0	0	0	106.6	K294	K294-I296 PolarHBondContact O-N 2.94Å
297	I	29.6	Very low	32	Very low	156 Å²	156	160 Å²	160	80%	0.8	80%	0.796	S	S	*	*			trans	-73.9	145.2	-178	-65.3	171.3	0	0	0	109.3
298	Q	26.3	Very low	31.8	Very low	160 Å²	160	161.9 Å²	161.9	75%	0.748	79%	0.792	S	S	*	*			trans	-62.7	142.7	-178.8	-61.5	158.5	-91.8	0	0	112.1
299	F	30.7	Very low	31.6	Very low	209 Å²	209	161.2 Å²	161.2	92%	0.917	79%	0.788	S	S	*	*			trans	-140.4	154.9	131.9	-95.7	-73.6	0	0	0	109.2
300	T	30.2	Very low	31.4	Very low	105 Å²	105	160.1 Å²	160.1	64%	0.644	78%	0.783	S	S	*	*			trans	-116.9	144	-163.6	46.3	0	0	0	0	111.9
301	E	33.7	Very low	31.3	Very low	185 Å²	185	158.3 Å²	158.3	86%	0.864	78%	0.779	S	S	*	*				174.7	167	108.4	-89	-162.9	152.7	0	0	112.1
302	P	33	Very low	31.2	Very low	104 Å²	104	154 Å²	154	68%	0.675	77%	0.773	S	S	*	*			trans	-132.4	176.6	-156.8	44.3	-29.5	0	0	0	117
303	K	32.7	Very low	31.3	Very low	181 Å²	181	155.3 Å²	155.3	79%	0.787	78%	0.777	S	S	*	*			trans	70.8	154.2	155.6	-78	177.5	179.4	-173.7	0	117.5
304	D	34.6	Very low	31.6	Very low	146 Å²	146	151.1 Å²	151.1	78%	0.781	77%	0.77	S	S	*	*			cis	-153.9	166.5	12	-109	-33.1	0	0	0	112.4
305	G	33.9	Very low	31.6	Very low	52 Å²	52	148.4 Å²	148.4	54%	0.536	77%	0.774	S	S	.	*			trans	106.3	104.9	133.6	0	0	0	0	0	123.3
306	Y	36.7	Very low	32	Very low	219 Å²	219	148.1 Å²	148.1	86%	0.859	77%	0.772	S	S	*	*			trans	63.6	157.2	141.7	-51.1	-71.6	0	0	0	118.6
307	N	35.2	Very low	32.4	Very low	131 Å²	131	147.4 Å²	147.4	70%	0.701	77%	0.774	S	S	*	*			cis	-163.4	170.2	0.7	-125.7	-19.1	0	0	0	108.2
308	I	31.8	Very low	32.6	Very low	134 Å²	134	145.2 Å²	145.2	69%	0.687	77%	0.768	S	S	*	*			cis	-150.6	-103.1	0.4	-169.7	157.4	0	0	0	114.3
309	L	30.4	Very low	33.1	Very low	138 Å²	138	146.3 Å²	146.3	72%	0.723	78%	0.776	S	S	*	*			trans	-145.1	-178.2	-169.7	-53.8	161.9	0	0	0	109.4
310	K	29.7	Very low	33.2	Very low	174 Å²	174	142.7 Å²	142.7	76%	0.757	77%	0.766	S	S	*	*			cis	-170.1	167.4	11.5	-148.9	169.6	-175.3	176.4	0	113.2
311	L	29.4	Very low	33.6	Very low	156 Å²	156	147.7 Å²	147.7	82%	0.817	78%	0.779	S	S	*	*			trans	94.2	157	140.6	-141.8	64.3	0	0	0	121.2
312	S	30.2	Very low	33.4	Very low	104 Å²	104	147.2 Å²	147.2	73%	0.727	78%	0.776	S	S	*	*			trans	-139.5	172.6	-164.7	52.7	0	0	0	0	112.7
313	R	34.8	Very low	33.4	Very low	253 Å²	253	148.2 Å²	148.2	96%	0.955	78%	0.78	S	S	*	*			trans	-156.2	170.1	168.5	-112.9	169.4	-177.1	177.9	-0.3	112.7
314	S	34.6	Very low	33.2	Very low	113 Å²	113	147.8 Å²	147.8	79%	0.79	78%	0.778	S	S	*	*			trans	-130.6	152.3	-147.5	-48.3	0	0	0	0	117.6
315	S	31.4	Very low	33.1	Very low	126 Å²	126	147.5 Å²	147.5	88%	0.881	78%	0.776	S	S	*	*			trans	23.3	133.8	142.7	-158.2	0	0	0	0	123.3
316	S	35.2	Very low	32.9	Very low	112 Å²	112	151.7 Å²	151.7	78%	0.783	79%	0.786	S	S	*	*			trans	-172.3	145.9	160.1	-154.2	0	0	0	0	108.2
317	V	37.3	Very low	32.8	Very low	137 Å²	137	150.7 Å²	150.7	83%	0.83	79%	0.789	S	S	*	*			cis	-152.5	-177.8	-7.8	101.6	0	0	0	0	109.4
318	V	33.7	Very low	33	Very low	111 Å²	111	153.9 Å²	153.9	67%	0.673	80%	0.8	S	S	*	*			trans	-112.1	154.3	-174.6	178.9	0	0	0	0	113.1
319	M	36.7	Very low	33.1	Very low	183 Å²	183	155.7 Å²	155.7	90%	0.901	81%	0.805	S	S	*	*			trans	-166	141.4	140.8	-104.1	-56.4	178.8	0	0	112.7
320	D	31.8	Very low	33.5	Very low	132 Å²	132	157.1 Å²	157.1	71%	0.706	81%	0.813	S	S	*	*			trans	-105.7	165.1	-170.2	-57.7	-76.6	0	0	0	115.3
321	K	38.3	Very low	33.8	Very low	211 Å²	211	153.6 Å²	153.6	92%	0.917	81%	0.806	S	S	*	*			trans	-164.9	130.5	139.9	-111.5	162.5	-173.2	175	0	113.5
322	E	29.8	Very low	34.3	Very low	175 Å²	175	150.3 Å²	150.3	82%	0.818	80%	0.796	S	S	*	*			trans	-82.2	167.2	172.4	-53.4	177.5	104.5	0	0	112.6
323	V	33.1	Very low	35	Very low	124 Å²	124	153.5 Å²	153.5	75%	0.752	80%	0.799	S	S	*	*				175.9	116.3	116.4	150.7	0	0	0	0	111.4
324	K	29.3	Very low	35.3	Very low	172 Å²	172	148.4 Å²	148.4	75%	0.748	79%	0.79	S	S	*	*			trans	33.7	144.3	133.5	-58.4	-177.9	-179.3	175.9	0	120.2
325	L	32	Very low	35.9	Very low	141 Å²	141	148.7 Å²	148.7	74%	0.738	79%	0.788	S	S	*	*			cis	-167.6	174.9	6.5	-119.4	171.7	0	0	0	110.9
326	N	29.3	Very low	36.4	Very low	139 Å²	139	147 Å²	147	74%	0.743	77%	0.772	S	S	*	*			trans	71.3	94.2	161.9	-58.2	-5.2	0	0	0	119.4
327	E	34	Very low	36.4	Very low	199 Å²	199	145.2 Å²	145.2	93%	0.93	77%	0.771	S	S	*	*			trans	-128.8	148.9	136.5	-73.3	-165.4	158.1	0	0	108.2
328	E	40.6	Very low	36.4	Very low	198 Å²	198	147.2 Å²	147.2	93%	0.925	77%	0.769	S	S	*	*			trans	-91.6	149.8	-171.7	-65	-174	140.3	0	0	113.3	L330	E328-L330 PolarHBondContact O-N 3.47Å
329	E	33.9	Very low	36.6	Very low	171 Å²	171	148.4 Å²	148.4	80%	0.799	78%	0.776	S	S	*	*			trans	-72.5	124.2	-171.4	-70.9	-179.1	94.3	0	0	114.3	V331	E329-V331 HydrophobicContact CB-CG2 4.24Å; E329-V331 HydrophobicContact CG-CG2 4.38Å; E329-V331 WeakPolarHBondContact OE1-CG2 3.19Å
330	L	38.4	Very low	36.7	Very low	168 Å²	168	146.9 Å²	146.9	88%	0.88	77%	0.77	S	S	*	*			trans	-116.8	59.4	156.6	-70.9	179.4	0	0	0	111	E328 S332	E328-L330 PolarHBondContact O-N 3.47Å; L330-S332 PolarHBondContact O-N 2.85Å; L330-S332 VanDerWaalsContact O-N 3.12Å
331	V	35.1	Very low	37.1	Very low	101 Å²	101	146.9 Å²	146.9	61%	0.612	78%	0.779	S	S	*	*			trans	-63.3	110.7	174.2	177.4	0	0	0	0	109.6	E329	E329-V331 HydrophobicContact CB-CG2 4.24Å; E329-V331 HydrophobicContact CG-CG2 4.38Å; E329-V331 WeakPolarHBondContact OE1-CG2 3.19Å
332	S	40.6	Very low	37	Very low	87 Å²	87	139 Å²	139	61%	0.608	76%	0.757	S	S	*	*			trans	-69.8	139.6	-177.5	-67.6	0	0	0	0	112.7	L330 L334	L330-S332 PolarHBondContact O-N 2.85Å; L330-S332 VanDerWaalsContact O-N 3.12Å; S332-L334 PolarHBondContact O-N 3.47Å
333	E	44.8	Very low	37.4	Very low	171 Å²	171	133.4 Å²	133.4	80%	0.799	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	18.5	-176	-58	-171.1	106.4	0	0	116.2	T336	E333-T336 PolarHBondContact O-OG1 3.16Å
334	L	40.8	Very low	38.5	Very low	146 Å²	146	134 Å²	134	76%	0.764	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-7.1	-175.5	-72.9	167.7	0	0	0	114.2	S332	S332-L334 PolarHBondContact O-N 3.47Å
335	T	47.6	Very low	39.2	Very low	119 Å²	119	127.5 Å²	127.5	73%	0.73	73%	0.726	S	S	*	*	S	Bend	trans	-92.4	-11.8	175.2	51	0	0	0	0	113.6	G337	T335-G337 VanDerWaalsContact C-N 3.34Å; T335-G337 PolarHBondContact O-N 3.24Å
336	T	41.6	Very low	40	Very low	90 Å²	90	123.5 Å²	123.5	55%	0.552	71%	0.713	S	S	*	*	S	Bend	trans	-92.2	33.4	-167.8	56.5	0	0	0	0	115.1	E333 K338	E333-T336 PolarHBondContact O-OG1 3.16Å; T336-K338 PolarHBondContact O-N 2.82Å
337	G	35.2	Very low	40.8	Very low	75 Å²	75	119.7 Å²	119.7	77%	0.773	70%	0.701	S	S	*	*			trans	63	6.6	156.2	0	0	0	0	0	119	T335 V339	T335-G337 VanDerWaalsContact C-N 3.34Å; T335-G337 PolarHBondContact O-N 3.24Å; G337-V339 PolarHBondContact O-N 2.98Å
338	K	38.4	Very low	41.5	Very low	178 Å²	178	115.1 Å²	115.1	77%	0.774	68%	0.683	S	S	*	*			trans	-78.7	120.2	-179.2	-88.8	175.5	178	166.4	0	112.3	T336 I340	T336-K338 PolarHBondContact O-N 2.82Å; K338-I340 PolarHBondContact O-N 3.32Å
339	V	37.5	Very low	42	Very low	136 Å²	136	113.7 Å²	113.7	82%	0.824	67%	0.669	S	S	*	*			trans	-72	96.9	173.5	-178.3	0	0	0	0	110	G337 C341	G337-V339 PolarHBondContact O-N 2.98Å; V339-C341 PolarHBondContact O-N 3.32Å
340	I	39.6	Very low	42.7	Very low	151 Å²	151	115.2 Å²	115.2	77%	0.774	67%	0.669	S	S	*	*			trans	-83	93.3	174.5	-57.6	178.6	0	0	0	109.2	K338 G342	K338-I340 PolarHBondContact O-N 3.32Å; I340-G342 PolarHBondContact O-N 3.34Å
341	C	39.7	Very low	43	Very low	132 Å²	132	116.8 Å²	116.8	89%	0.892	66%	0.663	S	S	*	*			trans	-75.2	65.4	172.4	47.4	0	0	0	0	112.1	V339	V339-C341 PolarHBondContact O-N 3.32Å
342	G	36.3	Very low	43.4	Very low	45 Å²	45	121.3 Å²	121.3	46%	0.464	67%	0.669	S	S	.	*			trans	-126.6	132.4	174.3	0	0	0	0	0	111.2	I340	I340-G342 PolarHBondContact O-N 3.34Å
343	G	38.1	Very low	43.2	Very low	58 Å²	58	125.6 Å²	125.6	60%	0.598	68%	0.677	S	S	*	*			trans	-59.1	143.8	-173.1	0	0	0	0	0	113.7	G345 A346	G343-G345 PolarHBondContact O-N 2.82Å; G343-A346 WeakPolarHBondContact O-CB 3.44Å; G343-A346 PolarHBondContact O-N 2.84Å
344	I	55.2	Low	42.6	Very low	137 Å²	137	122.3 Å²	122.3	70%	0.703	67%	0.673	S	S	*	*	H	α-helix	trans	-46.7	-40.1	-174.1	-79	168.8	0	0	0	113.7	A346 A347 L348	I344-A346 PolarHBondContact O-N 2.7Å; I344-A346 VanDerWaalsContact O-N 3.17Å; I344-A347 PolarHBondContact O-N 2.65Å; I344-L348 HydrophobicContact CG2-CD1 3.64Å; I344-L348 HydrophobicContact CG2-CG 4.18Å; I344-L348 WeakPolarHBondContact O-CG 3.39Å; I344-L348 PolarHBondContact O-N 2.87Å
345	G	44	Very low	42.1	Very low	36 Å²	36	121.2 Å²	121.2	37%	0.371	67%	0.674	S	S	.	*	H	α-helix	trans	-65.1	-13.4	177.3	0	0	0	0	0	115.4	G343 R349	G343-G345 PolarHBondContact O-N 2.82Å; G345-R349 PolarHBondContact O-NE 3.48Å; G345-R349 PolarHBondContact O-NH2 2.93Å; G345-R349 VanDerWaalsContact O-NH2 3.12Å
346	A	49	Very low	41.5	Very low	56 Å²	56	123.8 Å²	123.8	46%	0.463	68%	0.683	S	S	.	*	H	α-helix	trans	-85.3	-46.9	170.2	0	0	0	0	0	111.1	G343 I344 L348 R349 Y350	G343-A346 WeakPolarHBondContact O-CB 3.44Å; G343-A346 PolarHBondContact O-N 2.84Å; I344-A346 PolarHBondContact O-N 2.7Å; I344-A346 VanDerWaalsContact O-N 3.17Å; A346-L348 VanDerWaalsContact C-N 3.32Å; A346-L348 PolarHBondContact O-N 3.17Å; A346-R349 PolarHBondContact O-N 3.27Å; A346-Y350 PolarHBondContact O-N 3.4Å
347	A	45.7	Very low	41	Very low	59 Å²	59	124.4 Å²	124.4	49%	0.488	70%	0.697	S	S	.	*	H	α-helix	trans	-60.2	-39.8	176.8	0	0	0	0	0	112.4	I344 R349 Y350 R351	I344-A347 PolarHBondContact O-N 2.65Å; A347-R349 VanDerWaalsContact C-N 3.34Å; A347-R349 PolarHBondContact O-N 3.17Å; A347-Y350 PolarHBondContact O-N 3.16Å; A347-R351 PolarHBondContact O-N 2.73Å
348	L	49.5	Very low	40.7	Very low	104 Å²	104	130.1 Å²	130.1	55%	0.545	70%	0.704	S	S	.	*	H	α-helix	trans	-68.1	-29.3	174.5	-69.6	174.4	0	0	0	113.3	I344 A346 R352	I344-L348 HydrophobicContact CG2-CD1 3.64Å; I344-L348 HydrophobicContact CG2-CG 4.18Å; I344-L348 WeakPolarHBondContact O-CG 3.39Å; I344-L348 PolarHBondContact O-N 2.87Å; A346-L348 VanDerWaalsContact C-N 3.32Å; A346-L348 PolarHBondContact O-N 3.17Å; L348-R352 PolarHBondContact O-N 2.76Å
349	R	50.7	Low	40.4	Very low	168 Å²	168	127.6 Å²	127.6	63%	0.634	71%	0.709	S	S	*	*	H	α-helix	trans	-73.7	-40.7	174.6	-89.6	178.4	-75.9	-151.6	-3.1	112	G345 A346 A347 R351 R352 F353	G345-R349 PolarHBondContact O-NE 3.48Å; G345-R349 PolarHBondContact O-NH2 2.93Å; G345-R349 VanDerWaalsContact O-NH2 3.12Å; A346-R349 PolarHBondContact O-N 3.27Å; A347-R349 VanDerWaalsContact C-N 3.34Å; A347-R349 PolarHBondContact O-N 3.17Å; R349-R351 PolarHBondContact O-N 3.17Å; R349-R352 PolarHBondContact O-N 3.42Å; R349-R352 VanDerWaalsContact O-N 3.09Å; R349-F353 PolarHBondContact O-N 2.89Å
350	Y	48.8	Very low	40	Very low	202 Å²	202	124 Å²	124	79%	0.792	70%	0.699	S	S	*	*	H	α-helix	trans	-61	-33.7	173.8	-122.2	-83.8	0	0	0	112.4	A346 A347	A346-Y350 PolarHBondContact O-N 3.4Å; A347-Y350 PolarHBondContact O-N 3.16Å
351	R	45.3	Very low	39.4	Very low	201 Å²	201	122.8 Å²	122.8	76%	0.758	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-14.9	174.5	-72.9	-176.7	175	177.1	-1.6	115.2	A347 R349	A347-R351 PolarHBondContact O-N 2.73Å; R349-R351 PolarHBondContact O-N 3.17Å
352	R	42.7	Very low	38.8	Very low	197 Å²	197	121.4 Å²	121.4	74%	0.743	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-5.5	174.7	-88.6	-173.2	170.6	-175.8	-3.1	113.6	L348 R349	L348-R352 PolarHBondContact O-N 2.76Å; R349-R352 PolarHBondContact O-N 3.42Å; R349-R352 VanDerWaalsContact O-N 3.09Å
353	F	36.1	Very low	38.4	Very low	176 Å²	176	124.4 Å²	124.4	77%	0.772	72%	0.723	S	S	*	*			trans	-127.4	79.3	178.1	-78.6	-85.8	0	0	0	111.3	R349	R349-F353 PolarHBondContact O-N 2.89Å
354	S	32	Very low	37.8	Very low	103 Å²	103	126.7 Å²	126.7	72%	0.72	73%	0.729	S	S	*	*			trans	-133.1	129.5	161	-167.5	0	0	0	0	108
355	P	32.1	Very low	36.4	Very low	122 Å²	122	125.2 Å²	125.2	79%	0.792	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-81.2	136.2	-169.9	31.3	-34.3	0	0	0	112.6
356	L	33.4	Very low	35.6	Very low	173 Å²	173	127.9 Å²	127.9	91%	0.906	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-85.2	146.8	150.8	-103.1	75	0	0	0	108.8
357	A	32.4	Very low	34.8	Very low	103 Å²	103	132.8 Å²	132.8	85%	0.851	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-79.8	155.6	-160.9	0	0	0	0	0	115.1
358	E	27.5	Very low	33.8	Very low	196 Å²	196	137.1 Å²	137.1	92%	0.916	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-86.3	127.4	172.8	-62.5	-177.7	129.6	0	0	111.9
359	S	33.7	Very low	33	Very low	125 Å²	125	138.7 Å²	138.7	87%	0.874	79%	0.791	S	S	*	*			trans	-173.1	142.3	146.4	53.7	0	0	0	0	109
360	G	28.3	Very low	31.8	Very low	61 Å²	61	134.3 Å²	134.3	63%	0.629	79%	0.786	S	S	*	*			cis	174.1	148.1	-10.2	0	0	0	0	0	109.9
361	S	27.3	Very low	31	Very low	124 Å²	124	135.6 Å²	135.6	87%	0.867	79%	0.791	S	S	*	*			trans	62.9	125.7	-174.7	69.2	0	0	0	0	115
362	A	26.2	Very low	30	Very low	104 Å²	104	132.1 Å²	132.1	86%	0.86	79%	0.787	S	S	*	*			cis	90.2	90	44.4	0	0	0	0	0	114
363	A	29.3	Very low	29.2	Very low	108 Å²	108	128.8 Å²	128.8	89%	0.893	79%	0.792	S	S	*	*			trans	-146.9	151.1	158	0	0	0	0	0	109.3
364	S	25.5	Very low	28.7	Very low	105 Å²	105	128.8 Å²	128.8	73%	0.734	79%	0.792	S	S	*	*			trans	-104.7	151.8	-174.6	172.4	0	0	0	0	112.2
365	S	25.6	Very low	28.4	Very low	107 Å²	107	132.3 Å²	132.3	75%	0.748	80%	0.801	S	S	*	*			trans	66.5	150.1	151.4	46.9	0	0	0	0	119.6
366	A	25.7	Very low	28.2	Very low	91 Å²	91	135.9 Å²	135.9	75%	0.752	80%	0.804	S	S	*	*			trans	57.4	102.6	167.3	0	0	0	0	0	117.3
367	L	33.3	Very low	27.8	Very low	160 Å²	160	134.8 Å²	134.8	84%	0.838	81%	0.805	S	S	*	*				-161.3	130.8	95.4	-100.4	161	0	0	0	110.8
368	D	25.5	Very low	27.7	Very low	150 Å²	150	133.4 Å²	133.4	80%	0.802	80%	0.801	S	S	*	*			trans	-73.7	137.9	164	-174.9	12.4	0	0	0	108.4
369	N	31	Very low	27.6	Very low	136 Å²	136	131.6 Å²	131.6	73%	0.727	80%	0.798	S	S	*	*			trans	-159.2	116.4	169.5	-111.2	-41.3	0	0	0	112.3
370	S	26.7	Very low	27.5	Very low	77 Å²	77	133.8 Å²	133.8	54%	0.538	80%	0.799	S	S	.	*			trans	-76.9	147.6	-177.5	60	0	0	0	0	113.6
371	Y	31.3	Very low	27.4	Very low	229 Å²	229	137.1 Å²	137.1	90%	0.898	80%	0.802	S	S	*	*			trans	-125.4	88.7	143.7	-78.8	-78	0	0	0	109.7
372	I	25	Very low	27.7	Very low	128 Å²	128	139 Å²	139	66%	0.656	80%	0.797	S	S	*	*			trans	-112.7	103.7	171.7	-57.8	176.7	0	0	0	108.2	K374	I372-K374 HydrophobicContact CG2-CG 3.97Å; I372-K374 PolarHBondContact O-N 2.89Å; I372-K374 VanDerWaalsContact O-N 3.17Å
373	C	26.2	Very low	28.1	Very low	126 Å²	126	140.6 Å²	140.6	85%	0.851	79%	0.791	S	S	*	*			trans	-82.6	88.7	169.7	-69.8	0	0	0	0	110.4	L375	C373-L375 PolarHBondContact O-N 2.96Å
374	K	24.7	Very low	28.1	Very low	177 Å²	177	143.9 Å²	143.9	77%	0.77	79%	0.788	S	S	*	*			trans	-73.1	111.2	166.2	-72.8	169.1	-179.5	168.1	0	109.3	I372 K376	I372-K374 HydrophobicContact CG2-CG 3.97Å; I372-K374 PolarHBondContact O-N 2.89Å; I372-K374 VanDerWaalsContact O-N 3.17Å; K374-K376 PolarHBondContact O-N 3.11Å
375	L	26.9	Very low	28.5	Very low	177 Å²	177	142.9 Å²	142.9	93%	0.927	78%	0.779	S	S	*	*			trans	-86.4	102.5	160.4	-74.2	173.7	0	0	0	108.7	C373	C373-L375 PolarHBondContact O-N 2.96Å
376	K	27.1	Very low	28.6	Very low	196 Å²	196	144.5 Å²	144.5	85%	0.852	78%	0.784	S	S	*	*			trans	-83.9	142.7	167.3	-102.8	-170.2	171.3	-170.4	0	109.5	K374	K374-K376 PolarHBondContact O-N 3.11Å
377	T	25.2	Very low	28.8	Very low	150 Å²	150	144 Å²	144	92%	0.92	79%	0.788	S	S	*	*			trans	-62.5	144.7	167.1	34	0	0	0	0	111.7
378	G	29.3	Very low	28.5	Very low	74 Å²	74	145.4 Å²	145.4	76%	0.763	79%	0.791	S	S	*	*			trans	-164.9	119.9	174.4	0	0	0	0	0	110.6
379	N	25.3	Very low	28.7	Very low	159 Å²	159	147 Å²	147	85%	0.85	79%	0.793	S	S	*	*			trans	-68.9	144.4	178.3	-87.5	-16.7	0	0	0	111.9
380	L	32	Very low	28.7	Very low	171 Å²	171	146 Å²	146	90%	0.895	79%	0.792	S	S	*	*			trans	-157	121.3	141.4	-111.4	167.9	0	0	0	110.1
381	N	26.9	Very low	28.7	Very low	130 Å²	130	149.6 Å²	149.6	70%	0.695	81%	0.806	S	S	*	*			trans	-81.7	142	174.8	-64.6	-28	0	0	0	110.4
382	Q	34.1	Very low	28.7	Very low	165 Å²	165	145.5 Å²	145.5	77%	0.771	80%	0.799	S	S	*	*				176.1	124.2	118.4	-94.4	157.2	75.4	0	0	113.9
383	N	32.8	Very low	28.9	Very low	136 Å²	136	147.2 Å²	147.2	73%	0.727	81%	0.808	S	S	*	*			trans	58	108.9	134.9	-50.1	-6.1	0	0	0	121.2
384	E	29.1	Very low	29	Very low	177 Å²	177	146.6 Å²	146.6	83%	0.827	80%	0.8	S	S	*	*				45.2	151.1	109.3	-69.9	-92.4	109.6	0	0	121.5
385	P	35.1	Very low	29.3	Very low	84 Å²	84	143.8 Å²	143.8	55%	0.545	80%	0.798	S	S	.	*			cis	-146.1	-171.6	-34.7	40.3	-21.5	0	0	0	114.7
386	T	26.6	Very low	29.6	Very low	141 Å²	141	140.8 Å²	140.8	87%	0.865	79%	0.787	S	S	*	*			trans	60.6	119.4	157	50.2	0	0	0	0	120.7
387	G	30.2	Very low	29.9	Very low	81 Å²	81	139.4 Å²	139.4	84%	0.835	79%	0.788	S	S	*	*			trans	-171.4	106.3	162.3	0	0	0	0	0	111.7
388	Q	27.7	Very low	30.5	Very low	190 Å²	190	137 Å²	137	89%	0.888	77%	0.77	S	S	*	*			trans	-82	130.9	-179.6	-63.8	169.9	-28.8	0	0	111.4
389	Q	30.1	Very low	30.9	Very low	182 Å²	182	141.1 Å²	141.1	85%	0.85	77%	0.769	S	S	*	*			trans	-162.8	124.6	144.5	-115.7	154.6	55.2	0	0	116.1
390	T	29.8	Very low	31.5	Very low	116 Å²	116	141.3 Å²	141.3	71%	0.712	76%	0.764	S	S	*	*			trans	50.3	114.7	147.5	52.9	0	0	0	0	121	N392	T390-N392 PolarHBondContact O-N 3.41Å
391	N	28	Very low	32	Very low	153 Å²	153	137 Å²	137	82%	0.818	75%	0.745	S	S	*	*			trans	-62	127.7	165	-53.8	-37.6	0	0	0	111.8
392	N	30.3	Very low	32.7	Very low	143 Å²	143	135.6 Å²	135.6	77%	0.765	74%	0.737	S	S	*	*			trans	-135	96.7	160.5	-88.2	-41.8	0	0	0	108.8	T390 T394	T390-N392 PolarHBondContact O-N 3.41Å; N392-T394 PolarHBondContact O-N 3.06Å; N392-T394 VanDerWaalsContact O-N 3.16Å
393	I	28.6	Very low	33.6	Very low	164 Å²	164	131 Å²	131	84%	0.841	72%	0.722	S	S	*	*			trans	-84.5	88.4	-180	-56.9	175.9	0	0	0	108.6
394	T	29.5	Very low	34.2	Very low	112 Å²	112	128.8 Å²	128.8	69%	0.687	71%	0.711	S	S	*	*			trans	-95.2	117.8	173.1	-52.2	0	0	0	0	109.6	N392 V396	N392-T394 PolarHBondContact O-N 3.06Å; N392-T394 VanDerWaalsContact O-N 3.16Å; T394-V396 HydrophobicContact CG2-CG2 4.11Å; T394-V396 PolarHBondContact O-N 3.33Å
395	T	30.6	Very low	35.2	Very low	119 Å²	119	125.7 Å²	125.7	73%	0.73	70%	0.697	S	S	*	*			trans	-72.6	105.1	-178.3	50.1	0	0	0	0	111.6
396	V	33.1	Very low	36.1	Very low	113 Å²	113	126.5 Å²	126.5	69%	0.685	69%	0.693	S	S	*	*			trans	-126.1	-13.3	177.9	-173.6	0	0	0	0	112.6	T394 D398	T394-V396 HydrophobicContact CG2-CG2 4.11Å; T394-V396 PolarHBondContact O-N 3.33Å; V396-D398 PolarHBondContact O-N 3.03Å; V396-D398 VanDerWaalsContact O-N 3.17Å
397	L	34	Very low	37.7	Very low	167 Å²	167	125.9 Å²	125.9	87%	0.874	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	41	-169.2	-66.9	171.3	0	0	0	115.1
398	D	37.1	Very low	39	Very low	101 Å²	101	124.2 Å²	124.2	54%	0.54	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-128.9	-18.9	-178.6	-74.4	-66.3	0	0	0	115.2	V396 T401 I402	V396-D398 PolarHBondContact O-N 3.03Å; V396-D398 VanDerWaalsContact O-N 3.17Å; D398-T401 PolarHBondContact O-OG1 3.37Å; D398-I402 VanDerWaalsContact O-CD1 3.3Å; D398-I402 WeakPolarHBondContact O-CD1 3.37Å; D398-I402 WeakPolarHBondContact O-CG1 3.47Å
399	H	37.6	Very low	40.6	Very low	160 Å²	160	120.2 Å²	120.2	74%	0.741	63%	0.631	S	S	*	*	H	α-helix	trans	-92.1	-26	-167.7	-107.2	-68	0	0	0	115.7	S403	H399-S403 PolarHBondContact O-OG 3.48Å
400	E	38	Very low	42.2	Very low	162 Å²	162	118.9 Å²	118.9	76%	0.757	62%	0.619	S	S	*	*	H	α-helix	trans	-86	-27.8	178.8	-64.5	-171.9	141.8	0	0	113	S403 N404	E400-S403 PolarHBondContact O-OG 3.07Å; E400-S403 VanDerWaalsContact O-OG 3.12Å; E400-N404 PolarHBondContact O-N 3.24Å; E400-N404 PolarHBondContact O-ND2 3.03Å
401	T	43.2	Very low	44.1	Very low	80 Å²	80	116.6 Å²	116.6	49%	0.491	60%	0.599	S	S	.	*	H	α-helix	trans	-66.6	-50.2	175.2	40.4	0	0	0	0	111	D398 S403 N404 E405	D398-T401 PolarHBondContact O-OG1 3.37Å; T401-S403 VanDerWaalsContact C-N 3.34Å; T401-S403 PolarHBondContact O-N 3.26Å; T401-N404 PolarHBondContact O-N 2.64Å; T401-E405 PolarHBondContact O-N 3.18Å; T401-E405 VanDerWaalsContact O-N 3.09Å
402	I	41.8	Very low	45.7	Very low	101 Å²	101	114.5 Å²	114.5	52%	0.518	58%	0.584	S	S	.	*	H	α-helix	trans	-61.6	-39.3	-179.1	-62.7	173.8	0	0	0	112	D398 N404 E405 E406	D398-I402 VanDerWaalsContact O-CD1 3.3Å; D398-I402 WeakPolarHBondContact O-CD1 3.37Å; D398-I402 WeakPolarHBondContact O-CG1 3.47Å; I402-N404 VanDerWaalsContact C-N 3.34Å; I402-N404 PolarHBondContact O-N 3.28Å; I402-E405 PolarHBondContact O-N 2.83Å; I402-E406 PolarHBondContact O-N 2.92Å
403	S	51.6	Low	47.2	Very low	68 Å²	68	111.2 Å²	111.2	48%	0.476	57%	0.572	S	S	.	*	H	α-helix	trans	-70.3	-30.1	179.8	61.6	0	0	0	0	113.1	H399 E400 T401 F407	H399-S403 PolarHBondContact O-OG 3.48Å; E400-S403 PolarHBondContact O-OG 3.07Å; E400-S403 VanDerWaalsContact O-OG 3.12Å; T401-S403 VanDerWaalsContact C-N 3.34Å; T401-S403 PolarHBondContact O-N 3.26Å; S403-F407 WeakPolarHBondContact O-CB 3.17Å; S403-F407 PolarHBondContact O-N 3.41Å
404	N	47.2	Very low	49.2	Very low	90 Å²	90	107.5 Å²	107.5	48%	0.481	55%	0.554	S	S	.	*	H	α-helix	trans	-69.5	-45.6	170.9	-79.5	-64.9	0	0	0	111.6	E400 T401 I402 E406 F407 Y408	E400-N404 PolarHBondContact O-N 3.24Å; E400-N404 PolarHBondContact O-ND2 3.03Å; T401-N404 PolarHBondContact O-N 2.64Å; I402-N404 VanDerWaalsContact C-N 3.34Å; I402-N404 PolarHBondContact O-N 3.28Å; N404-E406 PolarHBondContact O-N 3.32Å; N404-F407 WeakPolarHBondContact O-CB 3.41Å; N404-F407 PolarHBondContact O-N 3.5Å; N404-F407 VanDerWaalsContact O-N 3.15Å; N404-Y408 WeakPolarHBondContact O-CD2 3.4Å; N404-Y408 PolarHBondContact O-N 2.78Å
405	E	49	Very low	51.1	Low	113 Å²	113	106 Å²	106	53%	0.528	54%	0.54	S	S	.	.	H	α-helix	trans	-61.6	-42.8	178.3	-70.8	178.8	173.2	0	0	112.2	T401 I402 F407 Y408 L409	T401-E405 PolarHBondContact O-N 3.18Å; T401-E405 VanDerWaalsContact O-N 3.09Å; I402-E405 PolarHBondContact O-N 2.83Å; E405-F407 VanDerWaalsContact C-N 3.27Å; E405-F407 PolarHBondContact O-N 3.07Å; E405-Y408 PolarHBondContact O-N 2.89Å; E405-L409 WeakPolarHBondContact O-CG 3.42Å; E405-L409 PolarHBondContact O-N 3.44Å
406	E	53.5	Low	52.9	Low	100 Å²	100	103.4 Å²	103.4	47%	0.467	52%	0.524	S	S	.	.	H	α-helix	trans	-64	-33.1	175.5	-151.4	-158	145.7	0	0	112.2	I402 N404 R410	I402-E406 PolarHBondContact O-N 2.92Å; N404-E406 PolarHBondContact O-N 3.32Å; E406-R410 WeakPolarHBondContact O-CB 3.5Å; E406-R410 WeakPolarHBondContact O-CD 3.46Å; E406-R410 WeakPolarHBondContact O-CG 3.49Å; E406-R410 PolarHBondContact O-N 2.85Å; E406-R410 IonicContact OE1-CZ 2.64Å; E406-R410 IonicContact OE1-NE 3.81Å; E406-R410 PolarHBondContact OE1-NE 3.31Å; E406-R410 IonicContact OE1-NH2 2.82Å; E406-R410 PolarHBondContact OE1-NH2 3.32Å
407	F	61.3	Low	54.6	Low	129 Å²	129	103 Å²	103	57%	0.566	52%	0.518	S	S	*	.	H	α-helix	trans	-67.2	-41.7	175.2	-179.1	-94.5	0	0	0	112.3	S403 N404 E405 K411	S403-F407 WeakPolarHBondContact O-CB 3.17Å; S403-F407 PolarHBondContact O-N 3.41Å; N404-F407 WeakPolarHBondContact O-CB 3.41Å; N404-F407 PolarHBondContact O-N 3.5Å; N404-F407 VanDerWaalsContact O-N 3.15Å; E405-F407 VanDerWaalsContact C-N 3.27Å; E405-F407 PolarHBondContact O-N 3.07Å; F407-K411 WeakPolarHBondContact O-CB 3.25Å; F407-K411 PolarHBondContact O-N 3.33Å
408	Y	57	Low	56.6	Low	45 Å²	45	101.1 Å²	101.1	18%	0.176	50%	0.503	C	S	.	.	H	α-helix	trans	-66	-47.4	176	-77.9	-69.6	0	0	0	112.2	N404 E405 R410 K411 E412 S680 N681	N404-Y408 WeakPolarHBondContact O-CD2 3.4Å; N404-Y408 PolarHBondContact O-N 2.78Å; E405-Y408 PolarHBondContact O-N 2.89Å; Y408-R410 VanDerWaalsContact C-N 3.3Å; Y408-R410 PolarHBondContact O-N 2.92Å; Y408-K411 WeakPolarHBondContact O-CB 3.38Å; Y408-K411 PolarHBondContact O-N 2.96Å; Y408-E412 PolarHBondContact O-N 2.88Å; Y408-S680 WeakPolarHBondContact CE1-O 3.35Å; Y408-S680 PolarHBondContact OH-O 3.22Å; Y408-S680 PolarHBondContact OH-OG 3.29Å; Y408-N681 WeakPolarHBondContact CE2-O 3.37Å
409	L	60.5	Low	58.3	Low	106 Å²	106	100.1 Å²	100.1	56%	0.555	49%	0.494	S	S	*	.	H	α-helix	trans	-59.4	-39.7	177.3	-70.1	169.3	0	0	0	112.1	E405 E412 C413	E405-L409 WeakPolarHBondContact O-CG 3.42Å; E405-L409 PolarHBondContact O-N 3.44Å; L409-E412 PolarHBondContact O-N 3.45Å; L409-C413 WeakPolarHBondContact O-CB 3.2Å; L409-C413 PolarHBondContact O-N 3.48Å; L409-C413 PolarHBondContact O-SG 3.45Å
410	R	65.2	Low	59.8	Low	154 Å²	154	95.8 Å²	95.8	58%	0.581	48%	0.477	S	S	*	.	H	α-helix	trans	-62.9	-40.8	173.2	-75	169.8	177.2	-142.4	7.5	112.4	E406 Y408 C413 D414	E406-R410 WeakPolarHBondContact O-CB 3.5Å; E406-R410 WeakPolarHBondContact O-CD 3.46Å; E406-R410 WeakPolarHBondContact O-CG 3.49Å; E406-R410 PolarHBondContact O-N 2.85Å; E406-R410 IonicContact OE1-CZ 2.64Å; E406-R410 IonicContact OE1-NE 3.81Å; E406-R410 PolarHBondContact OE1-NE 3.31Å; E406-R410 IonicContact OE1-NH2 2.82Å; E406-R410 PolarHBondContact OE1-NH2 3.32Å; Y408-R410 VanDerWaalsContact C-N 3.3Å; Y408-R410 PolarHBondContact O-N 2.92Å; R410-C413 PolarHBondContact O-N 3.11Å; R410-D414 PolarHBondContact O-N 2.96Å
411	K	68.5	Low	61.3	Low	69 Å²	69	90.2 Å²	90.2	30%	0.3	46%	0.458	S	S	.	.	H	α-helix	trans	-66.1	-41.4	178.5	-171.8	-173.1	179.4	-169.1	0	111.7	F407 Y408 D414 I415 S679	F407-K411 WeakPolarHBondContact O-CB 3.25Å; F407-K411 PolarHBondContact O-N 3.33Å; Y408-K411 WeakPolarHBondContact O-CB 3.38Å; Y408-K411 PolarHBondContact O-N 2.96Å; K411-D414 PolarHBondContact O-N 2.87Å; K411-I415 HydrophobicContact CG-CD1 4.41Å; K411-I415 VanDerWaalsContact O-CG1 3.3Å; K411-I415 WeakPolarHBondContact O-CG1 3.48Å; K411-I415 PolarHBondContact O-N 3.41Å; K411-S679 PolarHBondContact NZ-O 2.89Å; K411-S679 PolarHBondContact NZ-OG 3.35Å
412	E	63.3	Low	62.8	Low	108 Å²	108	89 Å²	89	51%	0.505	45%	0.447	S	S	.	.	H	α-helix	trans	-65.3	-43.7	173.6	-69.4	-177.4	146.4	0	0	111.6	Y408 L409 D414 I415 V416	Y408-E412 PolarHBondContact O-N 2.88Å; L409-E412 PolarHBondContact O-N 3.45Å; E412-D414 PolarHBondContact O-N 3.43Å; E412-I415 PolarHBondContact O-N 3.01Å; E412-I415 VanDerWaalsContact O-N 3.17Å; E412-V416 WeakPolarHBondContact O-CG2 3.3Å; E412-V416 PolarHBondContact O-N 3.06Å
413	C	61.2	Low	64.4	Low	75 Å²	75	91.6 Å²	91.6	51%	0.507	45%	0.45	S	S	.	.	H	α-helix	trans	-56.9	-46.1	173.7	-70.8	0	0	0	0	112.3	L409 R410 I415 V416 L417	L409-C413 WeakPolarHBondContact O-CB 3.2Å; L409-C413 PolarHBondContact O-N 3.48Å; L409-C413 PolarHBondContact O-SG 3.45Å; R410-C413 PolarHBondContact O-N 3.11Å; C413-I415 VanDerWaalsContact C-N 3.33Å; C413-I415 PolarHBondContact O-N 2.82Å; C413-V416 PolarHBondContact O-N 3.41Å; C413-L417 VanDerWaalsContact O-CB 3.27Å; C413-L417 WeakPolarHBondContact O-CB 3.37Å; C413-L417 WeakPolarHBondContact O-CG 3.19Å; C413-L417 PolarHBondContact O-N 3.34Å
414	D	70.8	Confident	65.1	Low	86 Å²	86	95.6 Å²	95.6	46%	0.46	46%	0.455	S	S	.	.	H	α-helix	trans	-66.7	-32.1	178.2	-88.9	-25.6	0	0	0	112.2	R410 K411 E412 K418	R410-D414 PolarHBondContact O-N 2.96Å; K411-D414 PolarHBondContact O-N 2.87Å; E412-D414 PolarHBondContact O-N 3.43Å; D414-K418 WeakPolarHBondContact O-CB 3.28Å; D414-K418 PolarHBondContact O-N 3.22Å; D414-K418 VanDerWaalsContact O-N 3.11Å
415	I	69.9	Low	66.3	Low	80 Å²	80	98.1 Å²	98.1	41%	0.41	46%	0.462	S	S	.	.	H	α-helix	trans	-66.6	-53	172.1	-70	163.3	0	0	0	110.6	K411 E412 C413 L417 K418 E419	K411-I415 HydrophobicContact CG-CD1 4.41Å; K411-I415 VanDerWaalsContact O-CG1 3.3Å; K411-I415 WeakPolarHBondContact O-CG1 3.48Å; K411-I415 PolarHBondContact O-N 3.41Å; E412-I415 PolarHBondContact O-N 3.01Å; E412-I415 VanDerWaalsContact O-N 3.17Å; C413-I415 VanDerWaalsContact C-N 3.33Å; C413-I415 PolarHBondContact O-N 2.82Å; I415-L417 VanDerWaalsContact C-N 3.3Å; I415-L417 PolarHBondContact O-N 3.21Å; I415-K418 WeakPolarHBondContact O-CA 3.23Å; I415-K418 WeakPolarHBondContact O-CB 3.39Å; I415-K418 PolarHBondContact O-N 3.14Å; I415-E419 HydrophobicContact CG2-CG 4.44Å; I415-E419 WeakPolarHBondContact O-CG 3.47Å; I415-E419 PolarHBondContact O-N 2.93Å
416	V	67.5	Low	67.1	Low	64 Å²	64	97.4 Å²	97.4	39%	0.388	46%	0.461	S	S	.	.	H	α-helix	trans	-61.5	-38.4	-179.9	172	0	0	0	0	111.3	E412 C413 K418 E419 L420	E412-V416 WeakPolarHBondContact O-CG2 3.3Å; E412-V416 PolarHBondContact O-N 3.06Å; C413-V416 PolarHBondContact O-N 3.41Å; V416-K418 VanDerWaalsContact C-N 3.32Å; V416-K418 PolarHBondContact O-N 2.86Å; V416-E419 PolarHBondContact O-N 2.94Å; V416-L420 HydrophobicContact CG1-CD1 3.92Å; V416-L420 HydrophobicContact CG1-CG 4.42Å; V416-L420 VanDerWaalsContact O-CB 3.23Å; V416-L420 WeakPolarHBondContact O-CB 3.35Å; V416-L420 VanDerWaalsContact O-CG 3.28Å; V416-L420 WeakPolarHBondContact O-CG 3.42Å; V416-L420 PolarHBondContact O-N 3.3Å
417	L	69.4	Low	67.2	Low	106 Å²	106	98.6 Å²	98.6	56%	0.555	47%	0.466	S	S	*	.	H	α-helix	trans	-65.7	-32.3	174.1	-75.1	171	0	0	0	113	C413 I415 A421	C413-L417 VanDerWaalsContact O-CB 3.27Å; C413-L417 WeakPolarHBondContact O-CB 3.37Å; C413-L417 WeakPolarHBondContact O-CG 3.19Å; C413-L417 PolarHBondContact O-N 3.34Å; I415-L417 VanDerWaalsContact C-N 3.3Å; I415-L417 PolarHBondContact O-N 3.21Å; L417-A421 WeakPolarHBondContact O-CB 3.16Å; L417-A421 PolarHBondContact O-N 3.23Å; L417-A421 VanDerWaalsContact O-N 3.11Å
418	K	75.2	Confident	66.6	Low	127 Å²	127	96.4 Å²	96.4	55%	0.552	47%	0.467	S	S	*	.	H	α-helix	trans	-73.8	-45.8	175.1	-172.9	-174	173.3	-164.2	0	111.5	D414 I415 V416 L420 A421 E422	D414-K418 WeakPolarHBondContact O-CB 3.28Å; D414-K418 PolarHBondContact O-N 3.22Å; D414-K418 VanDerWaalsContact O-N 3.11Å; I415-K418 WeakPolarHBondContact O-CA 3.23Å; I415-K418 WeakPolarHBondContact O-CB 3.39Å; I415-K418 PolarHBondContact O-N 3.14Å; V416-K418 VanDerWaalsContact C-N 3.32Å; V416-K418 PolarHBondContact O-N 2.86Å; K418-L420 VanDerWaalsContact C-N 3.35Å; K418-L420 PolarHBondContact O-N 3.12Å; K418-A421 WeakPolarHBondContact O-CA 3.27Å; K418-A421 WeakPolarHBondContact O-CB 3.34Å; K418-A421 PolarHBondContact O-N 2.9Å; K418-E422 WeakPolarHBondContact CE-OE1 3.45Å; K418-E422 PolarHBondContact O-N 3Å
419	E	71.9	Confident	65.7	Low	79 Å²	79	102.1 Å²	102.1	37%	0.369	50%	0.495	S	S	.	.	H	α-helix	trans	-57.3	-47.3	172.8	-69.6	174.4	164.4	0	0	110.8	R116 I415 V416 A421 E422 W423	R116-E419 IonicContact CZ-OE1 2.68Å; R116-E419 IonicContact CZ-OE2 3.8Å; R116-E419 IonicContact NH1-OE1 2.68Å; R116-E419 PolarHBondContact NH1-OE1 2.81Å; R116-E419 IonicContact NH1-OE2 2.77Å; R116-E419 PolarHBondContact NH1-OE2 2.99Å; R116-E419 VanDerWaalsContact NH1-OE2 3.17Å; R116-E419 IonicContact NH2-OE1 3.11Å; R116-E419 IonicContact NH2-OE2 3.74Å; R116-E419 PolarHBondContact NH2-OE2 3Å; I415-E419 HydrophobicContact CG2-CG 4.44Å; I415-E419 WeakPolarHBondContact O-CG 3.47Å; I415-E419 PolarHBondContact O-N 2.93Å; V416-E419 PolarHBondContact O-N 2.94Å; E419-A421 PolarHBondContact O-N 3.38Å; E419-E422 PolarHBondContact O-N 3.39Å; E419-E422 VanDerWaalsContact O-N 3.12Å; E419-W423 WeakPolarHBondContact O-CB 3.4Å; E419-W423 PolarHBondContact O-N 3.39Å
420	L	69.5	Low	64.5	Low	70 Å²	70	102.7 Å²	102.7	37%	0.366	51%	0.505	S	S	.	.	H	α-helix	trans	-64.3	-18.5	173.7	-77.9	171.3	0	0	0	114.2	V416 K418 R424	V416-L420 HydrophobicContact CG1-CD1 3.92Å; V416-L420 HydrophobicContact CG1-CG 4.42Å; V416-L420 VanDerWaalsContact O-CB 3.23Å; V416-L420 WeakPolarHBondContact O-CB 3.35Å; V416-L420 VanDerWaalsContact O-CG 3.28Å; V416-L420 WeakPolarHBondContact O-CG 3.42Å; V416-L420 PolarHBondContact O-N 3.3Å; K418-L420 VanDerWaalsContact C-N 3.35Å; K418-L420 PolarHBondContact O-N 3.12Å; L420-R424 VanDerWaalsContact O-CB 3.3Å; L420-R424 WeakPolarHBondContact O-CB 3.13Å; L420-R424 WeakPolarHBondContact O-CD 3.42Å; L420-R424 WeakPolarHBondContact O-CG 3.3Å; L420-R424 PolarHBondContact O-N 3.15Å; L420-R424 PolarHBondContact O-NH1 2.94Å
421	A	70.2	Confident	63.4	Low	44 Å²	44	105 Å²	105	36%	0.364	52%	0.52	S	S	.	.	H	α-helix	trans	-85.7	-34.6	172.3	0	0	0	0	0	111.8	L417 K418 E419 K425	L417-A421 WeakPolarHBondContact O-CB 3.16Å; L417-A421 PolarHBondContact O-N 3.23Å; L417-A421 VanDerWaalsContact O-N 3.11Å; K418-A421 WeakPolarHBondContact O-CA 3.27Å; K418-A421 WeakPolarHBondContact O-CB 3.34Å; K418-A421 PolarHBondContact O-N 2.9Å; E419-A421 PolarHBondContact O-N 3.38Å; A421-K425 WeakPolarHBondContact O-CG 3.18Å; A421-K425 PolarHBondContact O-N 3.21Å; A421-K425 VanDerWaalsContact O-N 3.08Å
422	E	75.3	Confident	61.6	Low	55 Å²	55	110.1 Å²	110.1	26%	0.257	55%	0.549	S	S	.	.	H	α-helix	trans	-75.3	-41.6	176.2	-69.5	177.8	-162.6	0	0	111.4	K418 E419 R424 K425 L426	K418-E422 WeakPolarHBondContact CE-OE1 3.45Å; K418-E422 PolarHBondContact O-N 3Å; E419-E422 PolarHBondContact O-N 3.39Å; E419-E422 VanDerWaalsContact O-N 3.12Å; E422-R424 PolarHBondContact O-N 3.12Å; E422-K425 WeakPolarHBondContact O-CB 3.39Å; E422-K425 PolarHBondContact O-N 3.49Å; E422-K425 VanDerWaalsContact O-N 3.15Å; E422-L426 PolarHBondContact O-N 3.48Å
423	W	74.7	Confident	60	Low	156 Å²	156	112.8 Å²	112.8	59%	0.591	57%	0.566	S	S	*	*	H	α-helix	trans	-59.7	-44.9	170.1	-166.2	94.1	0	0	0	111.6	E419 K425 L426 H427	E419-W423 WeakPolarHBondContact O-CB 3.4Å; E419-W423 PolarHBondContact O-N 3.39Å; W423-K425 VanDerWaalsContact C-N 3.32Å; W423-K425 PolarHBondContact O-N 2.8Å; W423-L426 PolarHBondContact O-N 2.89Å; W423-H427 AromaticContact CD1-CD2 3.98Å; W423-H427 AromaticContact CD2-CD2 3.49Å; W423-H427 VanDerWaalsContact CD2-CD2 3.49Å; W423-H427 AromaticContact CE2-CD2 3.32Å; W423-H427 AromaticContact CE2-NE2 3.64Å; W423-H427 HydrophobicContact CE3-CB 4.45Å; W423-H427 AromaticContact CE3-CD2 3.93Å; W423-H427 AromaticContact CG-CD2 3.92Å; W423-H427 HydrophobicContact CH2-CB 4.49Å; W423-H427 AromaticContact CZ2-CD2 3.64Å; W423-H427 AromaticContact CZ2-NE2 3.92Å; W423-H427 HydrophobicContact CZ3-CB 4.27Å; W423-H427 AromaticContact NE1-CD2 3.64Å; W423-H427 AromaticContact NE1-NE2 3.57Å; W423-H427 PolarHBondContact O-CD2 3.27Å; W423-H427 VanDerWaalsContact O-CD2 3.3Å; W423-H427 PolarHBondContact O-N 2.99Å
424	R	66.4	Low	58.5	Low	151 Å²	151	117.2 Å²	117.2	57%	0.57	59%	0.585	S	S	*	*	H	α-helix	trans	-61.8	-36.1	174	-81.6	179.9	-174.4	110.2	-3.1	112.7	L420 E422 S428	L420-R424 VanDerWaalsContact O-CB 3.3Å; L420-R424 WeakPolarHBondContact O-CB 3.13Å; L420-R424 WeakPolarHBondContact O-CD 3.42Å; L420-R424 WeakPolarHBondContact O-CG 3.3Å; L420-R424 PolarHBondContact O-N 3.15Å; L420-R424 PolarHBondContact O-NH1 2.94Å; E422-R424 PolarHBondContact O-N 3.12Å; R424-S428 WeakPolarHBondContact O-CB 3.45Å; R424-S428 PolarHBondContact O-N 3.11Å; R424-S428 PolarHBondContact O-OG 3.22Å; R424-S428 VanDerWaalsContact O-OG 3.05Å
425	K	72.4	Confident	56.6	Low	144 Å²	144	118.8 Å²	118.8	63%	0.626	60%	0.602	S	S	*	*	H	α-helix	trans	-61.8	-55.5	173.3	-74.8	167.7	-177.2	174.8	0	110.5	A421 E422 W423 H427 S428	A421-K425 WeakPolarHBondContact O-CG 3.18Å; A421-K425 PolarHBondContact O-N 3.21Å; A421-K425 VanDerWaalsContact O-N 3.08Å; E422-K425 WeakPolarHBondContact O-CB 3.39Å; E422-K425 PolarHBondContact O-N 3.49Å; E422-K425 VanDerWaalsContact O-N 3.15Å; W423-K425 VanDerWaalsContact C-N 3.32Å; W423-K425 PolarHBondContact O-N 2.8Å; K425-H427 VanDerWaalsContact C-N 3.27Å; K425-H427 PolarHBondContact O-N 3.46Å; K425-S428 PolarHBondContact O-N 2.55Å; K425-S428 VanDerWaalsContact O-N 3.1Å; K425-S428 PolarHBondContact O-OG 3.04Å
426	L	65.3	Low	54.5	Low	98 Å²	98	120.7 Å²	120.7	51%	0.513	62%	0.621	S	S	.	*	H	α-helix	trans	-51.1	-42.5	178.8	-86.6	163.9	0	0	0	113.3	E422 W423 L672	E422-L426 PolarHBondContact O-N 3.48Å; W423-L426 PolarHBondContact O-N 2.89Å; L426-L672 HydrophobicContact CD1-CD1 3.86Å; L426-L672 HydrophobicContact CD2-CD1 4.32Å; L426-L672 HydrophobicContact CG-CD1 4.11Å
427	H	55.7	Low	52.7	Low	124 Å²	124	127.3 Å²	127.3	57%	0.574	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	4.7	-177	-65.7	-72.5	0	0	0	114.7	W423 K425	W423-H427 AromaticContact CD1-CD2 3.98Å; W423-H427 AromaticContact CD2-CD2 3.49Å; W423-H427 VanDerWaalsContact CD2-CD2 3.49Å; W423-H427 AromaticContact CE2-CD2 3.32Å; W423-H427 AromaticContact CE2-NE2 3.64Å; W423-H427 HydrophobicContact CE3-CB 4.45Å; W423-H427 AromaticContact CE3-CD2 3.93Å; W423-H427 AromaticContact CG-CD2 3.92Å; W423-H427 HydrophobicContact CH2-CB 4.49Å; W423-H427 AromaticContact CZ2-CD2 3.64Å; W423-H427 AromaticContact CZ2-NE2 3.92Å; W423-H427 HydrophobicContact CZ3-CB 4.27Å; W423-H427 AromaticContact NE1-CD2 3.64Å; W423-H427 AromaticContact NE1-NE2 3.57Å; W423-H427 PolarHBondContact O-CD2 3.27Å; W423-H427 VanDerWaalsContact O-CD2 3.3Å; W423-H427 PolarHBondContact O-N 2.99Å; K425-H427 VanDerWaalsContact C-N 3.27Å; K425-H427 PolarHBondContact O-N 3.46Å
428	S	48.7	Very low	50.8	Low	84 Å²	84	127.9 Å²	127.9	59%	0.587	66%	0.658	S	S	*	*			trans	-92.9	-8	176.5	64.7	0	0	0	0	115	R424 K425 P430	R424-S428 WeakPolarHBondContact O-CB 3.45Å; R424-S428 PolarHBondContact O-N 3.11Å; R424-S428 PolarHBondContact O-OG 3.22Å; R424-S428 VanDerWaalsContact O-OG 3.05Å; K425-S428 PolarHBondContact O-N 2.55Å; K425-S428 VanDerWaalsContact O-N 3.1Å; K425-S428 PolarHBondContact O-OG 3.04Å; S428-P430 WeakPolarHBondContact O-CD 3.45Å
429	E	37.7	Very low	48.8	Very low	164 Å²	164	130.2 Å²	130.2	77%	0.766	67%	0.674	S	S	*	*	S	Bend	trans	-66.5	124.3	175.6	-71.3	-153.7	155.4	0	0	111.4	K431	E429-K431 PolarHBondContact O-N 2.84Å
430	P	37.1	Very low	47.1	Very low	119 Å²	119	136 Å²	136	77%	0.773	70%	0.698	S	S	*	*			trans	-75.6	98.9	-178.5	30.1	-33.7	0	0	0	110.4	S428 L432	S428-P430 WeakPolarHBondContact O-CD 3.45Å; P430-L432 PolarHBondContact O-N 3Å
431	K	40.5	Very low	45.2	Very low	203 Å²	203	144.2 Å²	144.2	88%	0.883	73%	0.725	S	S	*	*			trans	-46.7	126.8	172	-71.2	-174.2	177.3	-178.6	0	110.4	E429 L433	E429-K431 PolarHBondContact O-N 2.84Å; K431-L433 PolarHBondContact O-N 3.23Å; K431-L433 VanDerWaalsContact O-N 3.09Å
432	L	31.9	Very low	43.4	Very low	176 Å²	176	154.2 Å²	154.2	92%	0.921	75%	0.753	S	S	*	*			trans	-55.9	107.4	-162.1	-63	170.3	0	0	0	113.7	P430	P430-L432 PolarHBondContact O-N 3Å
433	L	29.5	Very low	41.3	Very low	163 Å²	163	160.8 Å²	160.8	85%	0.853	78%	0.781	S	S	*	*			trans	-119	33.5	176.2	-152.9	77.8	0	0	0	113.5	K431	K431-L433 PolarHBondContact O-N 3.23Å; K431-L433 VanDerWaalsContact O-N 3.09Å
434	N	29.1	Very low	39.3	Very low	169 Å²	169	161.5 Å²	161.5	90%	0.904	80%	0.796	S	S	*	*			trans	-119.9	52.6	-176.2	-84.2	-33.2	0	0	0	113.6
435	S	30.1	Very low	37.6	Very low	118 Å²	118	163.9 Å²	163.9	83%	0.825	81%	0.81	S	S	*	*			trans	-147.9	54.7	165	-160.2	0	0	0	0	112.9
436	C	27.2	Very low	35.7	Very low	120 Å²	120	163.8 Å²	163.8	81%	0.811	82%	0.822	S	S	*	*			trans	-149.2	55.2	177.5	-101.6	0	0	0	0	113.5
437	K	30	Very low	34.2	Very low	204 Å²	204	165.1 Å²	165.1	89%	0.887	83%	0.834	S	S	*	*	S	Bend	trans	-156.5	150.4	160.6	-93.2	121.3	-173.5	177.6	0	109.8
438	S	29	Very low	32.9	Very low	118 Å²	118	169.2 Å²	169.2	83%	0.825	85%	0.85	S	S	*	*			trans	82	48.2	166.5	-53.1	0	0	0	0	120.2
439	I	32.9	Very low	32.3	Very low	175 Å²	175	168.9 Å²	168.9	90%	0.897	85%	0.853	S	S	*	*			trans	-113.1	100.4	146.4	-62.1	-176.8	0	0	0	109.4
440	K	35.7	Very low	32.1	Very low	201 Å²	201	168.5 Å²	168.5	87%	0.874	86%	0.856	S	S	*	*			trans	-86.1	116.7	174.4	-78.8	179.8	178.2	173.4	0	110.2	R442	K440-R442 PolarHBondContact O-N 3.04Å
441	R	29.1	Very low	32.1	Very low	242 Å²	242	170.6 Å²	170.6	91%	0.913	86%	0.86	S	S	*	*			trans	6	103	154.6	-65.3	175.3	173.6	169.3	-2.2	115.9
442	R	32.5	Very low	31.7	Very low	255 Å²	255	170.2 Å²	170.2	96%	0.962	86%	0.861	S	S	*	*			trans	-114.1	119.8	139	-98.2	-177	167	151.6	-2.8	108.4	K440	K440-R442 PolarHBondContact O-N 3.04Å
443	K	31.5	Very low	31.5	Very low	193 Å²	193	167.4 Å²	167.4	84%	0.839	86%	0.855	S	S	*	*			trans	-75	134.8	167.5	-63.4	175.9	178.7	178.5	0	107.3
444	N	33.4	Very low	31.7	Very low	171 Å²	171	165.1 Å²	165.1	91%	0.914	85%	0.85	S	S	*	*			trans	-148.1	160.6	141.3	-102.7	-14.4	0	0	0	108.9
445	K	29.9	Very low	31.8	Very low	200 Å²	200	161.9 Å²	161.9	87%	0.87	84%	0.841	S	S	*	*			trans	-137.6	97.3	-155.4	175.3	-159.1	170.7	-166.9	0	109.7
446	V	32.6	Very low	32	Very low	142 Å²	142	162.5 Å²	162.5	86%	0.861	84%	0.839	S	S	*	*			trans	-133.3	169.3	170.6	-171	0	0	0	0	108.4
447	T	34.8	Very low	32	Very low	127 Å²	127	164.1 Å²	164.1	78%	0.779	84%	0.838	S	S	*	*			trans	-103.1	141.1	-146.6	42.3	0	0	0	0	116.9	A449	T447-A449 PolarHBondContact O-N 2.97Å
448	K	29.1	Very low	32.2	Very low	210 Å²	210	161.4 Å²	161.4	91%	0.913	83%	0.832	S	S	*	*			trans	-10.5	101.5	150.5	-173.8	-168.2	-179.9	-169.1	0	116.7
449	A	35.3	Very low	32.4	Very low	77 Å²	77	160 Å²	160	64%	0.636	82%	0.822	S	S	*	*			trans	-171.2	132.4	158	0	0	0	0	0	105.1	T447	T447-A449 PolarHBondContact O-N 2.97Å
450	D	33.7	Very low	32.5	Very low	156 Å²	156	157.5 Å²	157.5	83%	0.834	82%	0.818	S	S	*	*			cis	-137	176.5	-2.7	-71.9	-55.1	0	0	0	110.4
451	L	36.3	Very low	32.4	Very low	163 Å²	163	155.9 Å²	155.9	85%	0.853	82%	0.818	S	S	*	*			trans	-98	126.6	160.8	-75	87.4	0	0	0	108.3
452	E	31.9	Very low	32.6	Very low	194 Å²	194	149.4 Å²	149.4	91%	0.907	81%	0.811	S	S	*	*			trans	-162.7	165.8	138	-115.1	160.1	-155.2	0	0	111.9
453	C	28.6	Very low	32.8	Very low	117 Å²	117	145 Å²	145	79%	0.791	81%	0.806	S	S	*	*			trans	-104	-168.6	-178.9	-67	0	0	0	0	108.1
454	P	34.1	Very low	32.9	Very low	116 Å²	116	143.1 Å²	143.1	75%	0.753	80%	0.8	S	S	*	*			cis	-143.5	-161.5	11	44.3	-22.7	0	0	0	116.3
455	S	30.7	Very low	32.9	Very low	101 Å²	101	140.4 Å²	140.4	71%	0.706	79%	0.786	S	S	*	*			trans	-52	148.2	174.2	48	0	0	0	0	115.7
456	V	33.1	Very low	33.2	Very low	131 Å²	131	137 Å²	137	79%	0.794	78%	0.782	S	S	*	*			trans	-91.6	117.2	168.4	178.5	0	0	0	0	110.5
457	I	27.4	Very low	33.3	Very low	153 Å²	153	137 Å²	137	79%	0.785	78%	0.776	S	S	*	*			trans	-134.6	118	158.9	-61.9	177.7	0	0	0	106.3
458	L	34.2	Very low	33.3	Very low	148 Å²	148	136.5 Å²	136.5	78%	0.775	77%	0.769	S	S	*	*			trans	-154.5	138.5	179.5	-67.2	176.1	0	0	0	108
459	S	33	Very low	33.5	Very low	88 Å²	88	132.3 Å²	132.3	62%	0.615	76%	0.756	S	S	*	*			cis	-158.1	153.7	-14.4	-71.9	0	0	0	0	109.1
460	P	36.2	Very low	33.6	Very low	123 Å²	123	135.8 Å²	135.8	80%	0.799	76%	0.759	S	S	*	*			trans	-83.6	157.4	151.2	35.3	-30.9	0	0	0	110.7
461	N	33.5	Very low	33.7	Very low	166 Å²	166	137.6 Å²	137.6	89%	0.888	75%	0.754	S	S	*	*			trans	-85.4	157.3	176.4	-64.2	-17	0	0	0	111.7
462	S	32.1	Very low	33.5	Very low	107 Å²	107	136 Å²	136	75%	0.748	75%	0.746	S	S	*	*			trans	-143.6	119.3	178.7	59.6	0	0	0	0	112.4
463	D	36.8	Very low	33.7	Very low	162 Å²	162	132.8 Å²	132.8	87%	0.866	74%	0.74	S	S	*	*			trans	-157.2	143	161.8	-72	-54	0	0	0	104.6
464	E	35	Very low	33.8	Very low	154 Å²	154	135.9 Å²	135.9	72%	0.72	74%	0.74	S	S	*	*			cis	-155.6	155.6	1.5	-128.8	-163.2	149.2	0	0	110.4
465	N	33.3	Very low	33.8	Very low	114 Å²	114	137.4 Å²	137.4	61%	0.61	74%	0.737	S	S	*	*			trans	59.6	138.6	148.6	-65.4	-34	0	0	0	125.1
466	T	34.7	Very low	33.8	Very low	128 Å²	128	140.7 Å²	140.7	79%	0.785	74%	0.741	S	S	*	*			trans	65.4	144.6	149.5	49.3	0	0	0	0	120.7
467	L	34.8	Very low	33.7	Very low	143 Å²	143	138.6 Å²	138.6	75%	0.749	73%	0.731	S	S	*	*			cis	-164.2	169	-23.6	-157.3	68.9	0	0	0	109.2
468	D	34.9	Very low	33.9	Very low	116 Å²	116	136.5 Å²	136.5	62%	0.62	73%	0.726	S	S	*	*			trans	67.6	105	152.7	-76.4	-12.7	0	0	0	123
469	N	34.8	Very low	33.7	Very low	121 Å²	121	136.4 Å²	136.4	65%	0.647	72%	0.722	S	S	*	*				75.9	139.4	118.4	-59.4	-36	0	0	0	123.8
470	H	37.3	Very low	33.7	Very low	150 Å²	150	138.9 Å²	138.9	69%	0.694	73%	0.728	S	S	*	*			trans	71	146	154.2	-66.6	-33	0	0	0	119
471	R	35.1	Very low	33.4	Very low	194 Å²	194	138.3 Å²	138.3	73%	0.732	72%	0.722	S	S	*	*			cis	-170.2	140.7	-28	-129.5	-171.1	-179.9	149.4	0.4	109.7
472	D	32.4	Very low	33.5	Very low	129 Å²	129	137.4 Å²	137.4	69%	0.69	72%	0.722	S	S	*	*			trans	54.6	166.5	148.5	-57.1	-34.5	0	0	0	121.6
473	V	35.6	Very low	33.4	Very low	127 Å²	127	138.1 Å²	138.1	77%	0.77	72%	0.722	S	S	*	*			trans	68.8	108.4	173.4	-164.7	0	0	0	0	114.9
474	K	30.1	Very low	33.2	Very low	182 Å²	182	136 Å²	136	79%	0.791	72%	0.72	S	S	*	*			cis	94.5	157	40.1	-80.3	-165.9	160.7	-158.5	0	114.6
475	E	34.7	Very low	32.8	Very low	149 Å²	149	136.4 Å²	136.4	70%	0.696	73%	0.727	S	S	*	*			trans	75.8	119.9	173.5	-74.4	143.2	-131.2	0	0	114.4
476	E	30.5	Very low	32.9	Very low	170 Å²	170	140.8 Å²	140.8	79%	0.794	74%	0.74	S	S	*	*				80.2	143.4	51.8	-69	-166.5	118.3	0	0	112.1
477	C	30.5	Very low	32.6	Very low	86 Å²	86	139.4 Å²	139.4	58%	0.581	74%	0.736	S	S	*	*			cis	-159.4	158.1	-7.1	-118.7	0	0	0	0	112.1
478	T	31.3	Very low	32.3	Very low	110 Å²	110	140.6 Å²	140.6	68%	0.675	74%	0.742	S	S	*	*			trans	44.5	-170.4	145	64.9	0	0	0	0	119.2
479	E	30.8	Very low	32.2	Very low	146 Å²	146	143.8 Å²	143.8	68%	0.682	75%	0.754	S	S	*	*			cis	-143.7	162.5	-9.2	-130.4	135	-98.6	0	0	104.7	V481	E479-V481 HydrophobicContact CG-CG2 4.47Å
480	D	32.4	Very low	32.1	Very low	139 Å²	139	144.2 Å²	144.2	74%	0.743	76%	0.756	S	S	*	*			cis	-151.6	149.6	37.6	-78.7	-59.9	0	0	0	108.4
481	V	31.3	Very low	31.9	Very low	111 Å²	111	141.6 Å²	141.6	67%	0.673	75%	0.754	S	S	*	*			cis	76.8	90.7	44.5	-173.5	0	0	0	0	115.1	E479	E479-V481 HydrophobicContact CG-CG2 4.47Å
482	V	34.3	Very low	31.9	Very low	148 Å²	148	137.8 Å²	137.8	90%	0.897	75%	0.747	S	S	*	*			trans	-139.3	130.5	141.5	-178.3	0	0	0	0	109.3
483	T	29.6	Very low	32.1	Very low	121 Å²	121	138 Å²	138	74%	0.742	74%	0.744	S	S	*	*			trans	-106.1	147.7	-172.6	56.8	0	0	0	0	113.7
484	S	32.8	Very low	32	Very low	117 Å²	117	140.4 Å²	140.4	82%	0.818	74%	0.744	S	S	*	*			trans	-156	119.5	142.8	62.6	0	0	0	0	113.2
485	N	27.3	Very low	32.3	Very low	164 Å²	164	136.3 Å²	136.3	88%	0.877	74%	0.737	S	S	*	*			trans	-124.2	129.8	166.5	-91.2	-32.7	0	0	0	108.4
486	K	36.1	Very low	32	Very low	205 Å²	205	139.6 Å²	139.6	89%	0.891	74%	0.744	S	S	*	*			trans	-168.6	151.5	166.2	-100	166	-173.9	178.5	0	107.5
487	S	27.8	Very low	32.2	Very low	99 Å²	99	137.8 Å²	137.8	69%	0.692	75%	0.745	S	S	*	*			cis	151	113.9	-26.1	-89	0	0	0	0	107.7
488	L	28.3	Very low	32.2	Very low	168 Å²	168	139.8 Å²	139.8	88%	0.88	75%	0.754	S	S	*	*			trans	59.3	132	172.2	-73.6	72.1	0	0	0	115.5
489	E	34.2	Very low	32.3	Very low	184 Å²	184	143.7 Å²	143.7	86%	0.86	77%	0.765	S	S	*	*				-163.6	180	68.5	-80.6	-171.8	146.6	0	0	109.7
490	N	31.9	Very low	32.2	Very low	129 Å²	129	146.4 Å²	146.4	69%	0.69	77%	0.774	S	S	*	*			cis	-173.6	171.1	-42.1	-169.3	3.7	0	0	0	106.3
491	C	33.4	Very low	32.4	Very low	96 Å²	96	150 Å²	150	65%	0.649	78%	0.783	S	S	*	*			trans	71.6	142.7	167.1	-59.5	0	0	0	0	118.5
492	N	35.3	Very low	32.3	Very low	113 Å²	113	154.1 Å²	154.1	60%	0.604	79%	0.792	S	S	*	*			cis	-167.6	136.7	-21.2	-116.1	-36.9	0	0	0	112.9
493	Q	36.6	Very low	32.2	Very low	133 Å²	133	155.1 Å²	155.1	62%	0.621	79%	0.791	S	S	*	*			trans	65.6	155.6	143.2	-67.5	167	46.4	0	0	119.6
494	K	34	Very low	32.3	Very low	178 Å²	178	153 Å²	153	77%	0.774	79%	0.786	S	S	*	*			cis	-153.1	161.1	5.4	-126.9	154.1	-174.9	155.2	0	111.5
495	P	35.4	Very low	32.3	Very low	97 Å²	97	155.1 Å²	155.1	63%	0.63	79%	0.789	S	S	*	*			trans	-130	-175.8	-163.2	27.3	-3	0	0	0	117.5
496	Y	28.5	Very low	32.4	Very low	218 Å²	218	151.6 Å²	151.6	86%	0.855	78%	0.777	S	S	*	*			trans	74.9	161.1	170.8	-53.9	-74.4	0	0	0	116.7
497	T	34.7	Very low	32.2	Very low	131 Å²	131	148.4 Å²	148.4	80%	0.804	77%	0.769	S	S	*	*			cis	-135.4	175.6	16.1	53	0	0	0	0	114.4
498	T	29.5	Very low	32.4	Very low	128 Å²	128	151.5 Å²	151.5	79%	0.785	77%	0.773	S	S	*	*			trans	-100	152	-178	56.8	0	0	0	0	114.5
499	H	34.1	Very low	32.5	Very low	193 Å²	193	150.3 Å²	150.3	89%	0.894	77%	0.767	S	S	*	*			trans	-145.2	138.8	150.9	-96.6	-74	0	0	0	113.7
500	K	29.7	Very low	32.5	Very low	202 Å²	202	149.5 Å²	149.5	88%	0.878	76%	0.763	S	S	*	*			trans	-101.5	148.2	169.5	-71.4	172.8	177.7	166.6	0	110.3
501	K	35.6	Very low	32.5	Very low	215 Å²	215	150.1 Å²	150.1	94%	0.935	77%	0.767	S	S	*	*			trans	-147.4	147.3	147.8	-111.8	172.6	-177.6	177.5	0	110.6
502	K	29.4	Very low	32.6	Very low	197 Å²	197	153.4 Å²	153.4	86%	0.857	77%	0.772	S	S	*	*			trans	-104.1	146.1	177.9	-70.8	177.6	175.2	177.8	0	110.1
503	L	32.5	Very low	32.7	Very low	169 Å²	169	157.1 Å²	157.1	89%	0.885	78%	0.783	S	S	*	*			trans	-167.8	124	138.2	-122.8	67.7	0	0	0	104.6
504	A	31.3	Very low	32.6	Very low	76 Å²	76	158.2 Å²	158.2	63%	0.628	79%	0.793	S	S	*	*			cis	93.2	128.2	28.4	0	0	0	0	0	114
505	N	32.5	Very low	32.6	Very low	163 Å²	163	155.4 Å²	155.4	87%	0.872	79%	0.793	S	S	*	*			trans	71.4	152.5	173.8	-58.9	-3.9	0	0	0	117.8
506	S	29.6	Very low	32.6	Very low	90 Å²	90	155.2 Å²	155.2	63%	0.629	80%	0.8	S	S	*	*			cis	-167.1	169.5	-35.5	-157.7	0	0	0	0	110.8
507	N	31.5	Very low	32.8	Very low	137 Å²	137	150.1 Å²	150.1	73%	0.733	79%	0.793	S	S	*	*			trans	70.5	167	159.4	-55.2	-7.8	0	0	0	117.9
508	Q	31.5	Very low	32.4	Very low	164 Å²	164	153.4 Å²	153.4	77%	0.766	80%	0.797	S	S	*	*				-170.3	175.2	-62.2	-115.6	-178.9	-14.7	0	0	109.3
509	N	31.8	Very low	32.5	Very low	143 Å²	143	157.1 Å²	157.1	77%	0.765	80%	0.802	S	S	*	*			trans	69.2	125	177.5	-51.3	-19.3	0	0	0	114.2
510	Q	32.6	Very low	32.1	Very low	167 Å²	167	155.9 Å²	155.9	78%	0.78	80%	0.799	S	S	*	*			cis	77.5	108.8	25.7	-53.9	-165.2	13.5	0	0	116.7
511	N	33.1	Very low	32.3	Very low	142 Å²	142	151.4 Å²	151.4	76%	0.759	79%	0.793	S	S	*	*				169.6	114.6	128.4	-83.4	-23.6	0	0	0	108.9
512	H	35.5	Very low	32.1	Very low	165 Å²	165	147.1 Å²	147.1	76%	0.764	78%	0.78	S	S	*	*				79.6	97.6	77.8	-90.9	-71	0	0	0	115.7
513	K	36.5	Very low	32.2	Very low	192 Å²	192	145.6 Å²	145.6	84%	0.835	78%	0.776	S	S	*	*				169.9	119.8	118.5	-92.2	167.6	-178.4	-179.9	0	115
514	N	34.4	Very low	32.4	Very low	155 Å²	155	144.4 Å²	144.4	83%	0.829	77%	0.769	S	S	*	*			trans	55.6	159.1	143.2	-67	16.6	0	0	0	123
515	P	35.6	Very low	32.6	Very low	120 Å²	120	145.2 Å²	145.2	78%	0.779	76%	0.763	S	S	*	*			trans	-133.6	-172.3	-150.3	44.2	-27.2	0	0	0	117.2
516	A	35	Very low	32.8	Very low	92 Å²	92	145.9 Å²	145.9	76%	0.76	76%	0.758	S	S	*	*			trans	92.6	148.9	164.9	0	0	0	0	0	117.5
517	P	32.5	Very low	33.3	Very low	111 Å²	111	144.8 Å²	144.8	72%	0.721	75%	0.751	S	S	*	*			cis	-135	171.9	-28	36.3	-18.8	0	0	0	115.5
518	F	25.4	Very low	33.7	Very low	201 Å²	201	144.7 Å²	144.7	88%	0.882	75%	0.746	S	S	*	*			trans	38.5	102.7	158.5	-78.1	-72.3	0	0	0	121.4
519	K	33.1	Very low	34.2	Very low	206 Å²	206	142.4 Å²	142.4	90%	0.896	74%	0.737	S	S	*	*				-163.6	124.7	122.5	-110.4	167.2	-175.9	174.6	0	110.2
520	M	25.9	Very low	34.5	Very low	166 Å²	166	143.5 Å²	143.5	82%	0.818	74%	0.735	S	S	*	*			trans	-107.4	86	-176.4	-161	174.6	86.2	0	0	110.8
521	S	32.5	Very low	35.1	Very low	108 Å²	108	141.2 Å²	141.2	76%	0.755	73%	0.727	S	S	*	*			trans	-84.5	111.4	173.6	-59.1	0	0	0	0	109.9	E523	S521-E523 PolarHBondContact O-N 3.02Å
522	N	31.9	Very low	35.4	Very low	125 Å²	125	142.5 Å²	142.5	67%	0.668	73%	0.726	S	S	*	*			trans	-76.4	82.4	177	-79.8	-8	0	0	0	111.4	I524	N522-I524 PolarHBondContact O-N 3.32Å
523	E	30.8	Very low	35.6	Very low	165 Å²	165	140.7 Å²	140.7	77%	0.771	72%	0.718	S	S	*	*			trans	-82.9	90.5	167.6	-174.9	158.1	-135.2	0	0	110.4	S521	S521-E523 PolarHBondContact O-N 3.02Å
524	I	38.3	Very low	35.7	Very low	144 Å²	144	139.6 Å²	139.6	74%	0.738	71%	0.713	S	S	*	*			trans	-102.5	90.7	175.1	-58.6	-177.6	0	0	0	110.2	N522	N522-I524 PolarHBondContact O-N 3.32Å
525	D	35.3	Very low	35.8	Very low	93 Å²	93	137.6 Å²	137.6	50%	0.497	70%	0.702	S	S	.	*			trans	45.6	86	141.8	-150.5	-16.8	0	0	0	118.6	S527	D525-S527 VanDerWaalsContact CG-OG 3.29Å; D525-S527 PolarHBondContact O-N 3.02Å; D525-S527 WeakPolarHBondContact OD1-CB 3.05Å; D525-S527 PolarHBondContact OD1-N 2.84Å; D525-S527 PolarHBondContact OD1-OG 3.05Å
526	K	35.9	Very low	35.8	Very low	177 Å²	177	139.6 Å²	139.6	77%	0.77	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	5.9	175.2	-67.8	166.1	-178.8	154.6	0	114.3
527	S	40.8	Very low	36.1	Very low	68 Å²	68	145.3 Å²	145.3	48%	0.476	70%	0.701	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.3	-38.7	-175.3	71.2	0	0	0	0	114.7	D525 I529	D525-S527 VanDerWaalsContact CG-OG 3.29Å; D525-S527 PolarHBondContact O-N 3.02Å; D525-S527 WeakPolarHBondContact OD1-CB 3.05Å; D525-S527 PolarHBondContact OD1-N 2.84Å; D525-S527 PolarHBondContact OD1-OG 3.05Å; S527-I529 PolarHBondContact O-N 3.1Å
528	Q	40.2	Very low	36.3	Very low	135 Å²	135	149.4 Å²	149.4	63%	0.631	70%	0.702	S	S	*	*	S	Bend	trans	-71.6	-29	-167.1	-70.9	-83.4	-13	0	0	114.4
529	I	41	Very low	37	Very low	115 Å²	115	145.6 Å²	145.6	59%	0.59	69%	0.69	S	S	*	*	H	α-helix	trans	-74.4	-32.6	-167.1	-64.7	173.7	0	0	0	112.7	S527 I531	S527-I529 PolarHBondContact O-N 3.1Å; I529-I531 VanDerWaalsContact C-N 3.26Å; I529-I531 PolarHBondContact O-N 3.02Å
530	K	39.1	Very low	37.2	Very low	166 Å²	166	143.8 Å²	143.8	72%	0.722	68%	0.682	S	S	*	*	H	α-helix	trans	-69	-17.3	-175	-75.8	-177.9	175.5	176.9	0	114.6
531	I	43.7	Very low	37.8	Very low	120 Å²	120	139.9 Å²	139.9	62%	0.615	67%	0.671	S	S	*	*	H	α-helix	trans	-82.8	-42.8	-178.9	-63.5	177.5	0	0	0	111.3	I529 Q533 K534	I529-I531 VanDerWaalsContact C-N 3.26Å; I529-I531 PolarHBondContact O-N 3.02Å; I531-Q533 PolarHBondContact O-N 3.08Å; I531-K534 PolarHBondContact O-N 3.26Å
532	K	39.2	Very low	38.1	Very low	169 Å²	169	142.9 Å²	142.9	74%	0.735	67%	0.67	S	S	*	*	H	α-helix	trans	-67.9	-36.4	-178.5	-70.8	-173.3	176.3	-179.5	0	113	K534 L535 F536	K532-K534 VanDerWaalsContact C-N 3.29Å; K532-K534 PolarHBondContact O-N 3.12Å; K532-L535 PolarHBondContact O-N 2.76Å; K532-F536 PolarHBondContact O-N 3.49Å
533	Q	41.6	Very low	38.2	Very low	126 Å²	126	146 Å²	146	59%	0.589	68%	0.679	S	S	*	*	H	α-helix	trans	-65.9	-28.1	176	-70.5	-179.5	-22.5	0	0	113.6	I531	I531-Q533 PolarHBondContact O-N 3.08Å
534	K	36.9	Very low	38.4	Very low	170 Å²	170	145.9 Å²	145.9	74%	0.739	68%	0.682	S	S	*	*	H	α-helix	trans	-79.7	-22.9	-177.7	-152.8	171.2	-172.7	177.7	0	113.3	I531 K532	I531-K534 PolarHBondContact O-N 3.26Å; K532-K534 VanDerWaalsContact C-N 3.29Å; K532-K534 PolarHBondContact O-N 3.12Å
535	L	37.3	Very low	38.1	Very low	113 Å²	113	144.1 Å²	144.1	59%	0.592	68%	0.678	S	S	*	*	H	α-helix	trans	-77.1	-44.3	171.9	-85.4	159.5	0	0	0	112.1	K532 R537 R538	K532-L535 PolarHBondContact O-N 2.76Å; L535-R537 VanDerWaalsContact C-N 3.3Å; L535-R537 PolarHBondContact O-N 3.17Å; L535-R538 PolarHBondContact O-N 2.8Å
536	F	35.9	Very low	37.9	Very low	161 Å²	161	147.3 Å²	147.3	71%	0.706	70%	0.695	S	S	*	*	H	α-helix	trans	-60.7	-38.1	-177.3	-137.4	-102.2	0	0	0	112.7	K532 R538 L539	K532-F536 PolarHBondContact O-N 3.49Å; F536-R538 VanDerWaalsContact C-N 3.27Å; F536-R538 PolarHBondContact O-N 3.06Å; F536-L539 PolarHBondContact O-N 3.32Å
537	R	41.8	Very low	37.8	Very low	213 Å²	213	147.8 Å²	147.8	80%	0.804	70%	0.7	S	S	*	*	H	α-helix	trans	-68.4	-18	175.9	-69.4	-174.6	177.5	-176.5	-0.9	114.6	L535	L535-R537 VanDerWaalsContact C-N 3.3Å; L535-R537 PolarHBondContact O-N 3.17Å
538	R	35.9	Very low	37.3	Very low	196 Å²	196	152.5 Å²	152.5	74%	0.74	72%	0.719	S	S	*	*	H	α-helix	trans	-88.8	-12.2	176.1	-89.3	-175.9	165.3	-175.6	-5	114.4	L535 F536	L535-R538 PolarHBondContact O-N 2.8Å; F536-R538 VanDerWaalsContact C-N 3.27Å; F536-R538 PolarHBondContact O-N 3.06Å
539	L	40	Very low	36.8	Very low	122 Å²	122	151 Å²	151	64%	0.639	72%	0.724	S	S	*	*	H	α-helix	trans	-89.5	-42.3	176.5	-75.1	161.1	0	0	0	111.7	F536 S541 K542	F536-L539 PolarHBondContact O-N 3.32Å; L539-S541 PolarHBondContact O-N 3.22Å; L539-K542 PolarHBondContact O-N 3.03Å; L539-K542 VanDerWaalsContact O-N 3.17Å
540	K	37.3	Very low	36.4	Very low	168 Å²	168	151.7 Å²	151.7	73%	0.73	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-59.4	-27.2	176.9	-106.5	-175.1	176.2	-178.3	0	113.8
541	S	39.2	Very low	35.8	Very low	84 Å²	84	151.1 Å²	151.1	59%	0.587	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-89.9	8.3	179.8	80.3	0	0	0	0	115.3	L539	L539-S541 PolarHBondContact O-N 3.22Å
542	K	38.7	Very low	35.3	Very low	170 Å²	170	155.6 Å²	155.6	74%	0.739	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-117.4	-2.1	175.9	-79.4	-163.1	169.2	-162.8	0	114.2	L539	L539-K542 PolarHBondContact O-N 3.03Å; L539-K542 VanDerWaalsContact O-N 3.17Å
543	F	34.1	Very low	34.9	Very low	192 Å²	192	155.8 Å²	155.8	84%	0.842	75%	0.75	S	S	*	*	S	Bend	trans	-105.4	5.5	-179.3	-122	-88.6	0	0	0	113.6
544	L	35.1	Very low	34.1	Very low	161 Å²	161	154.9 Å²	154.9	84%	0.843	76%	0.758	S	S	*	*	S	Bend	trans	-116.7	17.7	-175.5	-135.7	77.7	0	0	0	113.4
545	T	31.8	Very low	33.9	Very low	107 Å²	107	153.4 Å²	153.4	66%	0.656	76%	0.756	S	S	*	*	S	Bend	trans	-130.7	57.4	-176.6	57.4	0	0	0	0	111
546	N	31.2	Very low	33.6	Very low	161 Å²	161	154.2 Å²	154.2	86%	0.861	76%	0.762	S	S	*	*			trans	-166.8	95.6	166.7	-102.8	-13.5	0	0	0	108.3
547	Q	33.6	Very low	33.3	Very low	186 Å²	186	153.2 Å²	153.2	87%	0.869	76%	0.763	S	S	*	*			trans	165.8	81.2	163.7	-90.1	-87.6	-15.8	0	0	107.1
548	L	29.3	Very low	32.8	Very low	167 Å²	167	153.5 Å²	153.5	87%	0.874	77%	0.765	S	S	*	*			trans	-137	144.5	169.3	-89.9	172.9	0	0	0	107.3
549	S	30	Very low	32.3	Very low	105 Å²	105	149.3 Å²	149.3	73%	0.734	77%	0.765	S	S	*	*			trans	62.8	138.3	-156	76.8	0	0	0	0	112.4
550	T	32.7	Very low	31.9	Very low	129 Å²	129	150.5 Å²	150.5	79%	0.791	78%	0.777	S	S	*	*			cis	-131.7	130.5	23.9	48.9	0	0	0	0	114.1
551	N	27.4	Very low	31.3	Very low	153 Å²	153	147 Å²	147	82%	0.818	77%	0.774	S	S	*	*			trans	-80.2	146.5	153.9	-72.6	-26.8	0	0	0	108.9
552	Y	31.5	Very low	30.8	Very low	215 Å²	215	151.3 Å²	151.3	84%	0.843	79%	0.785	S	S	*	*				-176.7	153	129.3	-109.5	-70.9	0	0	0	112.7
553	F	30.6	Very low	30.3	Very low	173 Å²	173	149.1 Å²	149.1	76%	0.759	79%	0.786	S	S	*	*			trans	60.7	91.4	167.1	-75.1	-72.3	0	0	0	120.8
554	S	26.3	Very low	30	Very low	106 Å²	106	146.6 Å²	146.6	74%	0.741	79%	0.79	S	S	*	*			trans	-71.1	161.3	136.5	-41.8	0	0	0	0	110.9
555	I	32.6	Very low	29.7	Very low	139 Å²	139	143.4 Å²	143.4	71%	0.713	78%	0.781	S	S	*	*			trans	175.8	114.7	130.4	-90.9	156	0	0	0	112.9
556	N	30	Very low	29.7	Very low	131 Å²	131	143.7 Å²	143.7	70%	0.701	79%	0.787	S	S	*	*			trans	58	150.2	140.5	-60.6	-8	0	0	0	126.7
557	N	31.1	Very low	29.8	Very low	139 Å²	139	140.4 Å²	140.4	74%	0.743	78%	0.777	S	S	*	*			trans	77	130.3	154.9	-62.8	-19.9	0	0	0	118.2
558	R	29.6	Very low	29.7	Very low	220 Å²	220	138.2 Å²	138.2	83%	0.83	77%	0.772	S	S	*	*			cis	109.7	103.4	22.7	-90.9	-166.3	168	-170.2	-2.5	112
559	S	26.6	Very low	29.8	Very low	107 Å²	107	135.3 Å²	135.3	75%	0.748	77%	0.765	S	S	*	*			trans	35.7	108.8	135	60.9	0	0	0	0	119.4
560	V	30.7	Very low	29.9	Very low	147 Å²	147	135.2 Å²	135.2	89%	0.891	77%	0.765	S	S	*	*			trans	-133.9	146.3	148.2	-179.8	0	0	0	0	107.7
561	S	26	Very low	29.8	Very low	96 Å²	96	136.5 Å²	136.5	67%	0.671	77%	0.765	S	S	*	*			trans	-116.9	-178.2	-179.3	48.6	0	0	0	0	111.1
562	E	28.3	Very low	30	Very low	173 Å²	173	135 Å²	135	81%	0.808	76%	0.764	S	S	*	*			trans	85.3	124.2	161	-59.9	-174.2	133.4	0	0	119.9
563	V	27.6	Very low	30.1	Very low	125 Å²	125	131.5 Å²	131.5	76%	0.758	76%	0.758	S	S	*	*			trans	60.8	110.1	134.5	-177.6	0	0	0	0	119.3
564	C	28.3	Very low	30	Very low	138 Å²	138	129.8 Å²	129.8	93%	0.932	76%	0.757	S	S	*	*				-147.9	155.9	119.1	-106.4	0	0	0	0	109.9
565	S	29.2	Very low	30.3	Very low	95 Å²	95	135 Å²	135	66%	0.664	76%	0.762	S	S	*	*			trans	-134.3	166.1	-169.8	50.7	0	0	0	0	111.7
566	S	31.2	Very low	30.2	Very low	112 Å²	112	134.3 Å²	134.3	78%	0.783	76%	0.76	S	S	*	*			trans	65.1	147.3	173.6	28.8	0	0	0	0	116.6
567	S	33	Very low	30.1	Very low	92 Å²	92	132.9 Å²	132.9	64%	0.643	76%	0.76	S	S	*	*			cis	-166.6	175.9	-10.9	45.3	0	0	0	0	112
568	D	31	Very low	30.3	Very low	141 Å²	141	134 Å²	134	75%	0.754	77%	0.765	S	S	*	*			trans	90.5	144.7	147.8	-60	-48.4	0	0	0	123.8
569	S	32.1	Very low	30.2	Very low	106 Å²	106	130.9 Å²	130.9	74%	0.741	76%	0.764	S	S	*	*			trans	75.2	79.1	157.5	66	0	0	0	0	121.6
570	S	31.7	Very low	30.5	Very low	103 Å²	103	132.5 Å²	132.5	72%	0.72	77%	0.77	S	S	*	*				35.5	125.1	118.3	63.9	0	0	0	0	121.7
571	L	30.3	Very low	30.3	Very low	155 Å²	155	132.8 Å²	132.8	81%	0.812	77%	0.767	S	S	*	*				178.9	121.4	111.7	-98.6	167.1	0	0	0	112.6
572	P	31.9	Very low	30.6	Very low	121 Å²	121	135.3 Å²	135.3	79%	0.786	78%	0.778	S	S	*	*			trans	-105.8	136.2	158.7	34.9	-26.2	0	0	0	110.9
573	I	34.7	Very low	30.6	Very low	142 Å²	142	132.7 Å²	132.7	73%	0.728	78%	0.779	S	S	*	*			trans	-103.9	118.7	172.2	-63	178.2	0	0	0	108.9	Y575	I573-Y575 HydrophobicContact CG2-CD2 3.63Å; I573-Y575 HydrophobicContact CG2-CE2 3.88Å
574	N	28.1	Very low	30.8	Very low	138 Å²	138	132.5 Å²	132.5	74%	0.738	78%	0.783	S	S	*	*			trans	-116.5	134.2	168.1	-170.3	41.2	0	0	0	107.1
575	Y	32.7	Very low	30.8	Very low	215 Å²	215	131.9 Å²	131.9	84%	0.843	78%	0.775	S	S	*	*			trans	-124.7	120	176	-102.4	-72.6	0	0	0	110.6	I573	I573-Y575 HydrophobicContact CG2-CD2 3.63Å; I573-Y575 HydrophobicContact CG2-CE2 3.88Å
576	D	30.6	Very low	30.9	Very low	125 Å²	125	137.2 Å²	137.2	67%	0.668	79%	0.787	S	S	*	*			trans	-105.6	156.2	-171.5	-139.2	-48.2	0	0	0	112.1
577	S	27.9	Very low	30.5	Very low	101 Å²	101	136.7 Å²	136.7	71%	0.706	78%	0.783	S	S	*	*			trans	-19.5	127.9	171.4	46.5	0	0	0	0	119.4
578	I	34.2	Very low	30.4	Very low	163 Å²	163	140.7 Å²	140.7	84%	0.836	80%	0.795	S	S	*	*			trans	-132	126.8	150.7	-64.9	-175.8	0	0	0	109.2
579	N	27.8	Very low	30.2	Very low	153 Å²	153	138.7 Å²	138.7	82%	0.818	79%	0.792	S	S	*	*			trans	-80.4	146	171.4	-75.8	-45.8	0	0	0	111.6
580	T	33.4	Very low	30.2	Very low	142 Å²	142	138.1 Å²	138.1	87%	0.871	79%	0.788	S	S	*	*				-161.2	144	128.5	13.7	0	0	0	0	112.1
581	N	27.2	Very low	30	Very low	153 Å²	153	140.2 Å²	140.2	82%	0.818	79%	0.791	S	S	*	*			trans	-78.6	147.9	172.6	-53.9	-44	0	0	0	110.5
582	T	32.3	Very low	30	Very low	148 Å²	148	138.7 Å²	138.7	91%	0.908	79%	0.792	S	S	*	*				-164.5	144.2	124.4	16.7	0	0	0	0	110.9
583	S	28	Very low	29.9	Very low	119 Å²	119	137.1 Å²	137.1	83%	0.832	78%	0.784	S	S	*	*			trans	-98.8	140.8	172.2	47.5	0	0	0	0	110.9
584	S	31.8	Very low	29.8	Very low	121 Å²	121	135 Å²	135	85%	0.846	78%	0.782	S	S	*	*			trans	-161.6	132.1	151.7	50.5	0	0	0	0	110.7
585	V	28.3	Very low	29.9	Very low	125 Å²	125	135.3 Å²	135.3	76%	0.758	78%	0.784	S	S	*	*			trans	-76.7	138.9	171.5	174.3	0	0	0	0	109.1
586	F	30.5	Very low	29.7	Very low	207 Å²	207	135.7 Å²	135.7	91%	0.908	78%	0.783	S	S	*	*			trans	-167	127.8	136.6	-103.2	-63.7	0	0	0	111.6
587	S	23	Very low	29.8	Very low	101 Å²	101	139.3 Å²	139.3	71%	0.706	80%	0.796	S	S	*	*			trans	-88.6	148.9	170.7	19	0	0	0	0	111.2
588	I	30.7	Very low	29.9	Very low	176 Å²	176	144 Å²	144	90%	0.903	80%	0.804	S	S	*	*			trans	-165.3	160.3	150.2	-103.4	151.8	0	0	0	108.8
589	S	27.3	Very low	29.7	Very low	98 Å²	98	144.7 Å²	144.7	69%	0.685	81%	0.808	S	S	*	*			trans	-113	164.4	-154.6	55.2	0	0	0	0	116.1
590	S	32.2	Very low	29.9	Very low	94 Å²	94	146.2 Å²	146.2	66%	0.657	81%	0.808	S	S	*	*			trans	82.3	124.2	143.7	75.5	0	0	0	0	121.6
591	N	27.6	Very low	29.8	Very low	147 Å²	147	146.3 Å²	146.3	79%	0.786	80%	0.803	S	S	*	*			trans	54	115.1	130.4	-57.1	-15.3	0	0	0	121.3
592	C	29.3	Very low	30	Very low	124 Å²	124	144.2 Å²	144.2	84%	0.838	80%	0.801	S	S	*	*				-162.9	169.8	100.6	-102.8	0	0	0	0	113.3
593	S	30.6	Very low	29.8	Very low	87 Å²	87	143 Å²	143	61%	0.608	80%	0.798	S	S	*	*			trans	-132.3	161.5	-157.9	-42.2	0	0	0	0	115.8
594	S	32	Very low	29.8	Very low	98 Å²	98	142 Å²	142	69%	0.685	79%	0.791	S	S	*	*			trans	95.2	120.9	145.9	-52.9	0	0	0	0	119
595	N	30.3	Very low	29.7	Very low	145 Å²	145	144.5 Å²	144.5	78%	0.775	79%	0.789	S	S	*	*				-149.1	110.1	126.6	-126.5	-24.1	0	0	0	114.9
596	R	29.1	Very low	29.7	Very low	222 Å²	222	143.7 Å²	143.7	84%	0.838	78%	0.784	S	S	*	*			trans	23.6	128.2	145.6	-59.2	173.8	176.5	-159.5	0.6	119.7
597	Q	31.9	Very low	29.6	Very low	201 Å²	201	141.7 Å²	141.7	94%	0.939	78%	0.778	S	S	*	*				-152.2	168.9	101.2	-106.8	175.3	45.9	0	0	111.5
598	K	30.9	Very low	29.7	Very low	200 Å²	200	141.9 Å²	141.9	87%	0.87	78%	0.778	S	S	*	*			trans	-107.2	133.9	-169.6	-67.3	175.3	178.6	173.6	0	111.9
599	L	30	Very low	29.5	Very low	177 Å²	177	142.7 Å²	142.7	93%	0.927	78%	0.775	S	S	*	*			trans	-137.9	155.8	145.5	-97.6	158.8	0	0	0	107.9
600	K	30.9	Very low	29.5	Very low	186 Å²	186	147.6 Å²	147.6	81%	0.809	79%	0.785	S	S	*	*			trans	-129.9	163.7	-172.2	-89.3	-165.7	171.2	-166.2	0	111
601	N	31.2	Very low	29.2	Very low	143 Å²	143	150.3 Å²	150.3	77%	0.765	79%	0.792	S	S	*	*			trans	80.2	101.8	178.6	-48.9	-5.6	0	0	0	111.3
602	S	31.3	Very low	29.3	Very low	110 Å²	110	152.1 Å²	152.1	77%	0.769	80%	0.796	S	S	*	*				71.8	124.7	64.2	76.6	0	0	0	0	112.9
603	S	29.6	Very low	29.2	Very low	122 Å²	122	154.3 Å²	154.3	85%	0.853	79%	0.793	S	S	*	*			cis	-148.6	142	3.5	-163.5	0	0	0	0	110.9
604	S	28	Very low	29.2	Very low	99 Å²	99	156.3 Å²	156.3	69%	0.692	80%	0.802	S	S	*	*			trans	-144.8	119.8	175.1	54.3	0	0	0	0	108.6	V606	S604-V606 PolarHBondContact O-N 2.97Å
605	H	28.9	Very low	28.9	Very low	172 Å²	172	158.5 Å²	158.5	80%	0.796	81%	0.806	S	S	*	*			trans	-73.3	120.8	176.4	-148.9	-92.5	0	0	0	108.4
606	V	28.4	Very low	28.8	Very low	109 Å²	109	157.3 Å²	157.3	66%	0.661	80%	0.803	S	S	*	*			trans	-112.3	101.5	173.9	178.5	0	0	0	0	106.7	S604	S604-V606 PolarHBondContact O-N 2.97Å
607	E	27.6	Very low	28.9	Very low	164 Å²	164	155.6 Å²	155.6	77%	0.766	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-76	127.8	164.1	-65.4	-163.1	135.4	0	0	108.2
608	C	25.3	Very low	28.6	Very low	106 Å²	106	152.8 Å²	152.8	72%	0.716	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-89.4	138.9	-175.7	-63.1	0	0	0	0	110
609	F	26.8	Very low	28.5	Very low	193 Å²	193	147.1 Å²	147.1	85%	0.846	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-59.8	138.8	167.8	-81.5	-106.7	0	0	0	110.2
610	F	28.6	Very low	28.4	Very low	200 Å²	200	145.8 Å²	145.8	88%	0.877	79%	0.789	S	S	*	*			trans	-92.3	114.2	162.9	-101.9	-94.3	0	0	0	108.6	E612	F610-E612 PolarHBondContact O-N 3.39Å
611	D	25.5	Very low	28.4	Very low	152 Å²	152	143.3 Å²	143.3	81%	0.813	79%	0.789	S	S	*	*			trans	-76.1	109.4	162.6	-76.2	-45.6	0	0	0	108.6
612	E	29.4	Very low	28.3	Very low	185 Å²	185	141.4 Å²	141.4	86%	0.864	79%	0.787	S	S	*	*			trans	-91.3	105.1	173.4	-165.1	162	-130	0	0	110.2	F610 V614	F610-E612 PolarHBondContact O-N 3.39Å; E612-V614 PolarHBondContact O-N 3.21Å
613	Q	26.8	Very low	28.1	Very low	169 Å²	169	141.6 Å²	141.6	79%	0.79	79%	0.789	S	S	*	*			trans	-75.4	102.1	-178.4	-68.4	-177.5	-13	0	0	111.2	N615	Q613-N615 PolarHBondContact O-N 3.23Å
614	V	29.8	Very low	28.3	Very low	130 Å²	130	144.4 Å²	144.4	79%	0.788	79%	0.788	S	S	*	*			trans	-73.2	106.1	167.9	-179.1	0	0	0	0	109.3	E612	E612-V614 PolarHBondContact O-N 3.21Å
615	N	27.2	Very low	28.5	Very low	143 Å²	143	145.7 Å²	145.7	77%	0.765	79%	0.787	S	S	*	*			trans	-65.8	133.1	171.1	-78.6	-44.3	0	0	0	110.7	Q613	Q613-N615 PolarHBondContact O-N 3.23Å
616	V	28.3	Very low	28.7	Very low	120 Å²	120	144.3 Å²	144.3	73%	0.727	78%	0.784	S	S	*	*			trans	-94.3	109.8	168	178.2	0	0	0	0	108.2
617	E	30.5	Very low	28.7	Very low	186 Å²	186	147.3 Å²	147.3	87%	0.869	79%	0.791	S	S	*	*			trans	-79.3	125	167.7	-68.4	-165.7	138.6	0	0	109.9
618	N	25.6	Very low	28.9	Very low	142 Å²	142	144 Å²	144	76%	0.759	79%	0.786	S	S	*	*			trans	-83.1	128.6	177.5	-66.7	-48.6	0	0	0	110.6
619	G	29.8	Very low	29.2	Very low	81 Å²	81	148.4 Å²	148.4	84%	0.835	80%	0.796	S	S	*	*			trans	-121	89.5	170.6	0	0	0	0	0	111.4
620	D	26.2	Very low	29.1	Very low	150 Å²	150	148.2 Å²	148.2	80%	0.802	80%	0.795	S	S	*	*			trans	-72	136.8	176.4	-73.6	-58.1	0	0	0	112.7
621	T	31	Very low	29.1	Very low	134 Å²	134	145.4 Å²	145.4	82%	0.822	79%	0.788	S	S	*	*			trans	-170	139.2	137.1	7.3	0	0	0	0	113.5
622	S	30.7	Very low	29.1	Very low	102 Å²	102	145.6 Å²	145.6	71%	0.713	79%	0.788	S	S	*	*			trans	39	106.3	159.2	53.5	0	0	0	0	119
623	S	27	Very low	29.1	Very low	115 Å²	115	144.4 Å²	144.4	80%	0.804	79%	0.787	S	S	*	*				72.3	143.9	59.5	-56.3	0	0	0	0	115.9
624	Q	33.1	Very low	29	Very low	181 Å²	181	145 Å²	145	85%	0.846	79%	0.787	S	S	*	*			trans	78.4	136	-172.4	-59.7	179.7	-34.2	0	0	114.4
625	D	31.6	Very low	28.9	Very low	125 Å²	125	145.8 Å²	145.8	67%	0.668	79%	0.787	S	S	*	*			cis	-159.2	165	-5.1	-124	-31.6	0	0	0	115.7
626	I	33.8	Very low	29	Very low	143 Å²	143	146.3 Å²	146.3	73%	0.733	79%	0.789	S	S	*	*			trans	58.4	95	152.7	-57.4	160.2	0	0	0	121
627	H	29.1	Very low	28.9	Very low	172 Å²	172	149.5 Å²	149.5	80%	0.796	80%	0.796	S	S	*	*				46	133.7	112.5	-141.9	-63.6	0	0	0	123.5
628	S	30.5	Very low	28.9	Very low	96 Å²	96	148.3 Å²	148.3	67%	0.671	79%	0.79	S	S	*	*			trans	85	139.8	162.7	-28.2	0	0	0	0	116.7
629	Q	31.1	Very low	28.9	Very low	198 Å²	198	150.2 Å²	150.2	93%	0.925	80%	0.795	S	S	*	*			cis	-137	172.7	22.3	-65.5	178.1	1.4	0	0	113.4
630	K	26.7	Very low	28.7	Very low	188 Å²	188	153.3 Å²	153.3	82%	0.817	79%	0.787	S	S	*	*			trans	-139	157	177.5	-173.6	-177.1	178	177.5	0	110
631	L	27	Very low	28.7	Very low	141 Å²	141	154.5 Å²	154.5	74%	0.738	79%	0.788	S	S	*	*			trans	87.3	145.7	177.4	-68.3	97.2	0	0	0	117.1
632	L	26.3	Very low	28.7	Very low	157 Å²	157	155.6 Å²	155.6	82%	0.822	78%	0.783	S	S	*	*			trans	70.5	140	171	-59.8	130.7	0	0	0	115
633	L	29.3	Very low	28.5	Very low	159 Å²	159	158.3 Å²	158.3	83%	0.832	79%	0.785	S	S	*	*			cis	-120.2	160.7	4.4	-77.6	86.6	0	0	0	113
634	K	25.6	Very low	28.9	Very low	183 Å²	183	157 Å²	157	80%	0.796	77%	0.773	S	S	*	*			trans	-75.5	170.5	157.1	-70.1	-179.7	174.6	179.5	0	110.2
635	N	26.7	Very low	29.1	Very low	145 Å²	145	156 Å²	156	78%	0.775	77%	0.769	S	S	*	*			trans	77	95.8	168.7	-48.8	-14.3	0	0	0	115.4
636	N	30	Very low	29.4	Very low	154 Å²	154	153.5 Å²	153.5	82%	0.824	76%	0.755	S	S	*	*				-162.2	114.5	108.5	-96.1	-32.3	0	0	0	110.7	H638	N636-H638 PolarHBondContact O-N 3.09Å
637	H	26.4	Very low	29.7	Very low	188 Å²	188	147.3 Å²	147.3	87%	0.87	72%	0.724	S	S	*	*			trans	-75.7	113.4	160.4	-86.8	-36.4	0	0	0	108.2
638	H	29.3	Very low	30	Very low	161 Å²	161	142.2 Å²	142.2	75%	0.745	70%	0.7	S	S	*	*			trans	-125.5	114.4	155.1	-98.2	38.4	0	0	0	108.2	N636 Q640	N636-H638 PolarHBondContact O-N 3.09Å; H638-Q640 VanDerWaalsContact C-N 3.33Å; H638-Q640 PolarHBondContact O-N 3.46Å
639	Q	25.5	Very low	30.4	Very low	182 Å²	182	141.8 Å²	141.8	85%	0.85	69%	0.693	S	S	*	*			trans	-74.5	87.8	171.8	-70.9	176.9	-22.7	0	0	108.6	Q641	Q639-Q641 PolarHBondContact O-N 2.97Å
640	Q	27.1	Very low	30.7	Very low	145 Å²	145	135.1 Å²	135.1	68%	0.678	67%	0.668	S	S	*	*			trans	-75.8	105.5	164.9	-69.6	-167.1	-0.2	0	0	108.6	H638 H642	H638-Q640 VanDerWaalsContact C-N 3.33Å; H638-Q640 PolarHBondContact O-N 3.46Å; Q640-H642 PolarHBondContact O-N 3.33Å
641	Q	25.9	Very low	31.1	Very low	175 Å²	175	129.8 Å²	129.8	82%	0.818	65%	0.648	S	S	*	*			trans	-71.6	93.7	170.1	-69.6	-177.3	-9.9	0	0	108.8	Q639 Q643	Q639-Q641 PolarHBondContact O-N 2.97Å; Q641-Q643 PolarHBondContact O-N 3.02Å
642	H	30.1	Very low	31.5	Very low	157 Å²	157	124.8 Å²	124.8	73%	0.727	62%	0.62	S	S	*	*			trans	-67.7	98.7	170.5	-72.6	-79	0	0	0	109.7	Q640	Q640-H642 PolarHBondContact O-N 3.33Å
643	Q	27.2	Very low	31.6	Very low	160 Å²	160	124.1 Å²	124.1	75%	0.748	61%	0.61	S	S	*	*			trans	-68.2	134.4	165	-70.4	-177.6	-21.8	0	0	109.2	Q641 Q645	Q641-Q643 PolarHBondContact O-N 3.02Å; Q643-Q645 PolarHBondContact O-N 3.27Å; Q643-Q645 VanDerWaalsContact O-N 3.16Å
644	P	35.5	Very low	31.5	Very low	86 Å²	86	121.6 Å²	121.6	56%	0.558	61%	0.606	S	S	*	*			trans	-69.2	111.9	174.2	28.1	-32.8	0	0	0	109.3
645	Q	37.6	Very low	31.5	Very low	160 Å²	160	117.6 Å²	117.6	75%	0.748	60%	0.602	S	S	*	*			trans	-80.1	127.5	172.5	-65.7	-160.5	4.9	0	0	109.8	Q643 S647	Q643-Q645 PolarHBondContact O-N 3.27Å; Q643-Q645 VanDerWaalsContact O-N 3.16Å; Q645-S647 PolarHBondContact O-N 3.09Å
646	I	37.4	Very low	31.5	Very low	73 Å²	73	118.8 Å²	118.8	37%	0.374	60%	0.602	S	S	.	*			trans	-79.3	101.7	-172.2	-57.4	170.8	0	0	0	109.9	K648 T683	I646-K648 HydrophobicContact CG2-CG 4.34Å; I646-K648 PolarHBondContact O-N 2.91Å; I646-T683 HydrophobicContact CD1-CG2 4.42Å
647	S	40.1	Very low	31.4	Very low	14 Å²	14	118.9 Å²	118.9	10%	0.098	60%	0.601	C	S	.	*			trans	-74.7	116.9	167.9	47	0	0	0	0	111.4	T54 T64 Q645	T54-S647 WeakPolarHBondContact O-CB 3.39Å; T64-S647 PolarHBondContact O-OG 2.89Å; Q645-S647 PolarHBondContact O-N 3.09Å
648	K	35.1	Very low	31.2	Very low	65 Å²	65	117.4 Å²	117.4	28%	0.283	60%	0.599	S	S	.	*			trans	-131.3	140	165.6	15.7	160.1	171.3	161.7	0	107.6	D66 I646 T683	D66-K648 HydrophobicContact CB-CB 4.18Å; I646-K648 HydrophobicContact CG2-CG 4.34Å; I646-K648 PolarHBondContact O-N 2.91Å; K648-T683 VanDerWaalsContact CE-OG1 3.3Å; K648-T683 WeakPolarHBondContact CE-OG1 3.49Å; K648-T683 PolarHBondContact NZ-OG1 2.77Å
649	V	38.5	Very low	31.2	Very low	87 Å²	87	114.7 Å²	114.7	53%	0.527	60%	0.598	S	S	.	*			trans	-166.2	141	152.2	123.5	0	0	0	0	114.9	L53	L53-V649 WeakPolarHBondContact CD2-O 3.22Å
650	S	38.3	Very low	31.1	Very low	57 Å²	57	110.7 Å²	110.7	40%	0.399	60%	0.596	S	S	.	*			trans	70.5	147.4	159.9	76.7	0	0	0	0	121.4	L53	L53-S650 WeakPolarHBondContact CD2-OG 3.38Å
651	I	34.6	Very low	31.1	Very low	76 Å²	76	111 Å²	111	39%	0.39	60%	0.603	S	S	.	*	B	Isolated β-bridge	trans	-98.2	130.8	-178.4	-61.1	177.8	0	0	0	109	E68 K653	E68-I651 VanDerWaalsContact OE1-CG2 3.3Å; E68-I651 WeakPolarHBondContact OE1-CG2 3.41Å; E68-I651 WeakPolarHBondContact OE2-CG1 3.44Å; I651-K653 HydrophobicContact CG2-CB 4.35Å; I651-K653 HydrophobicContact CG2-CD 3.67Å; I651-K653 HydrophobicContact CG2-CG 3.78Å; I651-K653 PolarHBondContact O-N 3.21Å
652	F	36.1	Very low	31.2	Very low	36 Å²	36	114 Å²	114	16%	0.158	61%	0.606	C	S	.	*			trans	-74.3	85.8	172.7	-81	-79.2	0	0	0	112.6	L45 R49 L53 I74	L45-F652 HydrophobicContact CD1-CE2 4.47Å; L45-F652 HydrophobicContact CD1-CZ 3.88Å; R49-F652 HydrophobicContact CG-CE1 4.47Å; R49-F652 HydrophobicContact CG-CZ 4.18Å; L53-F652 HydrophobicContact CD1-CE2 4.06Å; L53-F652 HydrophobicContact CD1-CZ 3.93Å; I74-F652 HydrophobicContact CD1-CB 4.42Å; I74-F652 HydrophobicContact CD1-CD1 3.27Å; I74-F652 HydrophobicContact CD1-CE1 3.5Å; I74-F652 VanDerWaalsContact CD1-CE1 3.5Å; I74-F652 HydrophobicContact CD1-CG 3.89Å; I74-F652 HydrophobicContact CD1-CZ 4.28Å
653	K	26.4	Very low	31.2	Very low	143 Å²	143	113.4 Å²	113.4	62%	0.622	61%	0.608	S	S	*	*			trans	-128	80.9	170.8	-77.2	172.5	178.3	80.9	0	110.1	E68 I651	E68-K653 IonicContact OE1-NZ 3.61Å; E68-K653 PolarHBondContact OE1-NZ 3.05Å; I651-K653 HydrophobicContact CG2-CB 4.35Å; I651-K653 HydrophobicContact CG2-CD 3.67Å; I651-K653 HydrophobicContact CG2-CG 3.78Å; I651-K653 PolarHBondContact O-N 3.21Å
654	S	27.9	Very low	31.2	Very low	107 Å²	107	112.3 Å²	112.3	75%	0.748	61%	0.607	S	S	*	*			trans	-62.2	150.6	171.5	54.8	0	0	0	0	111.4
655	S	26	Very low	31	Very low	99 Å²	99	120.3 Å²	120.3	69%	0.692	63%	0.626	S	S	*	*			trans	-114.4	133.6	-169	57.1	0	0	0	0	112.8
656	H	25.5	Very low	30.6	Very low	169 Å²	169	118.1 Å²	118.1	78%	0.782	62%	0.619	S	S	*	*			trans	53.1	87	160.2	-63.1	-68.7	0	0	0	118.2
657	I	28.7	Very low	30.4	Very low	157 Å²	157	122.3 Å²	122.3	81%	0.805	64%	0.637	S	S	*	*			trans	-122.3	115	136	-61.4	179.5	0	0	0	107.8
658	N	23.1	Very low	30	Very low	156 Å²	156	127.7 Å²	127.7	83%	0.834	68%	0.675	S	S	*	*			trans	-78.4	118.5	167.9	-82.6	-19.2	0	0	0	108.2
659	S	28.1	Very low	29.7	Very low	104 Å²	104	128 Å²	128	73%	0.727	70%	0.696	S	S	*	*			trans	-146.6	90.7	172.4	-78.5	0	0	0	0	109.9	N661	S659-N661 PolarHBondContact O-N 3.48Å
660	A	24.5	Very low	29.3	Very low	98 Å²	98	131.9 Å²	131.9	81%	0.81	71%	0.714	S	S	*	*			trans	-79.6	109	177.7	0	0	0	0	0	110.3
661	N	26.4	Very low	28.8	Very low	151 Å²	151	138.5 Å²	138.5	81%	0.807	74%	0.736	S	S	*	*			trans	-169.2	153.8	156.1	-100.5	-41.2	0	0	0	111.4	S659	S659-N661 PolarHBondContact O-N 3.48Å
662	R	28.4	Very low	28.6	Very low	238 Å²	238	140 Å²	140	90%	0.898	74%	0.744	S	S	*	*			trans	76.5	91.5	-168.3	-57.3	177.1	171.7	170.9	-2.8	112.9
663	I	30.2	Very low	28.1	Very low	146 Å²	146	143.1 Å²	143.1	75%	0.749	78%	0.776	S	S	*	*				72.4	98.9	54.5	-51.2	171	0	0	0	113
664	N	27	Very low	28.3	Very low	136 Å²	136	142.3 Å²	142.3	73%	0.727	78%	0.778	S	S	*	*			trans	32.5	105.9	148.5	-56.1	-1.3	0	0	0	119.8
665	R	32.1	Very low	28.2	Very low	254 Å²	254	145 Å²	145	96%	0.958	78%	0.776	S	S	*	*			trans	-136.5	91.6	131.9	-80.7	-164.5	174	148.6	-0.3	111.4
666	N	28.8	Very low	28.2	Very low	115 Å²	115	148.6 Å²	148.6	62%	0.615	78%	0.78	S	S	*	*			trans	-65.9	157.7	147.3	39.2	-40.2	0	0	0	109.3
667	E	31.9	Very low	28.2	Very low	160 Å²	160	147 Å²	147	75%	0.748	78%	0.782	S	S	*	*			cis	-157.9	167.6	22.2	-142.8	150.3	-95.9	0	0	113.5
668	S	31.7	Very low	28.2	Very low	127 Å²	127	148.8 Å²	148.8	89%	0.888	78%	0.784	S	S	*	*			trans	68.4	146.6	174.8	79.7	0	0	0	0	117.5
669	G	29.1	Very low	28.4	Very low	71 Å²	71	144.8 Å²	144.8	73%	0.732	77%	0.768	S	S	*	*			trans	147.2	-2.5	173.8	0	0	0	0	0	119.9
670	N	31.1	Very low	28.5	Very low	170 Å²	170	142.9 Å²	142.9	91%	0.909	76%	0.755	S	S	*	*			trans	70	147.2	-176.7	-61.9	-29.2	0	0	0	116.9
671	K	27.8	Very low	28.8	Very low	195 Å²	195	143.8 Å²	143.8	85%	0.848	75%	0.746	S	S	*	*			trans	-113.6	139.7	-173.4	-57.1	165.7	-178.7	171.5	0	110.1
672	L	28.9	Very low	29.1	Very low	109 Å²	109	139 Å²	139	57%	0.571	73%	0.725	S	S	*	*			trans	-168.1	94.2	131	-109.3	162.8	0	0	0	110.9	L426 L674	L426-L672 HydrophobicContact CD1-CD1 3.86Å; L426-L672 HydrophobicContact CD2-CD1 4.32Å; L426-L672 HydrophobicContact CG-CD1 4.11Å; L672-L674 HydrophobicContact CD2-CD1 4.07Å; L672-L674 HydrophobicContact CD2-CG 4.09Å
673	A	26.3	Very low	29.2	Very low	100 Å²	100	130.5 Å²	130.5	83%	0.826	70%	0.699	S	S	*	*			trans	-111.8	119	165.3	0	0	0	0	0	108.3
674	L	30.8	Very low	29.5	Very low	127 Å²	127	129 Å²	129	67%	0.665	69%	0.692	S	S	*	*			trans	-117.3	162.4	172.3	-74.8	176.5	0	0	0	110.4	L672	L672-L674 HydrophobicContact CD2-CD1 4.07Å; L672-L674 HydrophobicContact CD2-CG 4.09Å
675	K	25.2	Very low	29.7	Very low	163 Å²	163	130 Å²	130	71%	0.709	69%	0.692	S	S	*	*			trans	-134.8	143.2	-143.8	-161.2	177.7	-179.7	178.6	0	111.8
676	F	26.1	Very low	29.6	Very low	175 Å²	175	122.3 Å²	122.3	77%	0.768	68%	0.675	S	S	*	*			trans	69.6	154.5	-179.8	-38.6	-74.3	0	0	0	113.7
677	T	27.1	Very low	30	Very low	136 Å²	136	124.3 Å²	124.3	83%	0.834	69%	0.685	S	S	*	*			cis	-141.7	-176.8	23.2	52.2	0	0	0	0	113.3
678	K	26.9	Very low	29.9	Very low	194 Å²	194	122.3 Å²	122.3	84%	0.843	69%	0.686	S	S	*	*			trans	-84.3	144	173.1	-65.2	177.8	174.8	-179.3	0	112.5
679	S	29	Very low	30.2	Very low	71 Å²	71	122 Å²	122	50%	0.497	68%	0.683	S	S	.	*			trans	172.7	114.6	133.1	40.1	0	0	0	0	115.9	K411	K411-S679 PolarHBondContact NZ-O 2.89Å; K411-S679 PolarHBondContact NZ-OG 3.35Å
680	S	29.9	Very low	30.7	Very low	64 Å²	64	127.9 Å²	127.9	45%	0.448	69%	0.689	S	S	.	*			trans	45.1	133.7	135.6	63.3	0	0	0	0	124.4	Y408	Y408-S680 WeakPolarHBondContact CE1-O 3.35Å; Y408-S680 PolarHBondContact OH-O 3.22Å; Y408-S680 PolarHBondContact OH-OG 3.29Å
681	N	29.7	Very low	30.8	Very low	117 Å²	117	125.3 Å²	125.3	63%	0.626	68%	0.681	S	S	*	*				66	98.2	129.8	-60.7	1.3	0	0	0	124.7	Y408	Y408-N681 WeakPolarHBondContact CE2-O 3.37Å
682	S	33.9	Very low	31.1	Very low	52 Å²	52	124.5 Å²	124.5	36%	0.364	69%	0.685	S	S	.	*			trans	-166.1	100.3	145.7	45.2	0	0	0	0	111.7	R90	R90-S682 PolarHBondContact NH1-O 3.33Å
683	T	29.7	Very low	31.7	Very low	58 Å²	58	124.2 Å²	124.2	36%	0.356	69%	0.688	S	S	.	*				22.9	115.8	101.4	-52.5	0	0	0	0	114.5	I646 K648	I646-T683 HydrophobicContact CD1-CG2 4.42Å; K648-T683 VanDerWaalsContact CE-OG1 3.3Å; K648-T683 WeakPolarHBondContact CE-OG1 3.49Å; K648-T683 PolarHBondContact NZ-OG1 2.77Å
684	I	36.3	Very low	32	Very low	116 Å²	116	128.9 Å²	128.9	60%	0.595	69%	0.689	S	S	*	*			trans	-131.2	141.7	152.6	-61.9	-167.4	0	0	0	106.7
685	Q	31.1	Very low	32.4	Very low	156 Å²	156	131.2 Å²	131.2	73%	0.729	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-93.4	149.6	178.5	-64.5	-173.2	5.4	0	0	111.2
686	P	31.5	Very low	32.6	Very low	92 Å²	92	132 Å²	132	60%	0.597	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-68.9	146.8	172.3	30	-34.9	0	0	0	111.6
687	L	35.4	Very low	33.1	Very low	158 Å²	158	135.4 Å²	135.4	83%	0.827	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-70.7	140.8	174.7	-80.3	154.7	0	0	0	111	S689	L687-S689 PolarHBondContact O-N 3.15Å; L687-S689 VanDerWaalsContact O-N 3.09Å
688	P	31.3	Very low	33.4	Very low	118 Å²	118	135.4 Å²	135.4	77%	0.766	72%	0.724	S	S	*	*			trans	-78.9	97.2	-177.5	30.5	-34.3	0	0	0	111.9	K690	P688-K690 PolarHBondContact O-N 3.12Å
689	S	37.3	Very low	33.8	Very low	119 Å²	119	132.3 Å²	132.3	83%	0.832	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-62.1	124.9	169.2	52.8	0	0	0	0	111	L687	L687-S689 PolarHBondContact O-N 3.15Å; L687-S689 VanDerWaalsContact O-N 3.09Å
690	K	39.3	Very low	34	Very low	196 Å²	196	135.7 Å²	135.7	85%	0.852	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-85.7	134	-179.1	-66.7	175.8	-176.4	168.5	0	110.5	P688	P688-K690 PolarHBondContact O-N 3.12Å
691	P	34.3	Very low	34.3	Very low	116 Å²	116	139.9 Å²	139.9	75%	0.753	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-71.3	134.2	172.4	29.4	-33.8	0	0	0	111.3	V693	P691-V693 PolarHBondContact O-N 3.35Å; P691-V693 VanDerWaalsContact O-N 3.17Å
692	L	34	Very low	34.6	Very low	177 Å²	177	141.4 Å²	141.4	93%	0.927	75%	0.754	S	S	*	*			trans	-72.9	99.4	169.3	-93	161.6	0	0	0	110	K694	L692-K694 PolarHBondContact O-N 3.48Å
693	V	39.8	Very low	34.6	Very low	103 Å²	103	147.3 Å²	147.3	62%	0.624	78%	0.78	S	S	*	*			trans	-75	110.1	170.2	179.7	0	0	0	0	109	P691	P691-V693 PolarHBondContact O-N 3.35Å; P691-V693 VanDerWaalsContact O-N 3.17Å
694	K	34	Very low	35	Very low	198 Å²	198	153.7 Å²	153.7	86%	0.861	81%	0.81	S	S	*	*			trans	-67.2	127.7	158.8	-67.4	-179.2	179	180	0	108.1	L692	L692-K694 PolarHBondContact O-N 3.48Å
695	H	37.7	Very low	34.9	Very low	177 Å²	177	156.6 Å²	156.6	82%	0.819	83%	0.827	S	S	*	*			trans	-113.1	127.8	162.3	-100.5	-70.1	0	0	0	108.9
696	E	30.3	Very low	35.2	Very low	180 Å²	180	156.7 Å²	156.7	84%	0.841	84%	0.835	S	S	*	*			trans	-85.1	130.1	170.2	-62.3	171.3	135.2	0	0	109.1
697	N	37.2	Very low	35.5	Very low	246 Å²	246	162.5 Å²	162.5	100%	1.316	86%	0.856	S	S	*	*			trans	-178.8	0	154.5	-92.5	-32.6	0	0	0	108.9

Retrieved 697 of 697 residues in 134.3 ms (Link to these results)

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