A0A087XXG8_POEFO Loading...

Signal peptidase complex subunit 2

Component of the signal peptidase complex (SPC) which catalyzes the cleavage of N-terminal signal sequences from nascent proteins as they are translocated into the lumen of the endoplasmic reticulum. Enhances the enzymatic activity of SPC and facilitates the interactions between different components of the translocation site.

AlphaFold DB , UniProt , Accession A0A087XXG8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 203 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	K	36.6	Very low	40.8	Very low	252 Å²	252	141.7 Å²	141.7	100%	1.096	79%	0.791	S	S	*	*				0	89.4	0	-72.3	179.5	174.9	176.5	0	106.6
2	M	37.3	Very low	41.1	Very low	193 Å²	193	141.9 Å²	141.9	95%	0.951	79%	0.788	S	S	*	*				90	122	97.6	-82.6	-172.8	-177.4	0	0	112.2
3	A	46.6	Very low	41.2	Very low	102 Å²	102	141.3 Å²	141.3	84%	0.843	78%	0.776	S	S	*	*			trans	-64.6	155.8	-179.2	0	0	0	0	0	113.7
4	A	41	Very low	40.8	Very low	99 Å²	99	143.6 Å²	143.6	82%	0.818	77%	0.774	S	S	*	*			trans	-150.7	95.1	152.7	0	0	0	0	0	112.1
5	R	40	Very low	40.2	Very low	242 Å²	242	147.1 Å²	147.1	91%	0.913	77%	0.772	S	S	*	*			trans	60.4	77.9	138.5	-77.6	172.3	137.1	164.6	-6.8	119.1	G7	R5-G7 PolarHBondContact O-N 3.02Å
6	N	42.5	Very low	39.9	Very low	166 Å²	166	150.4 Å²	150.4	89%	0.888	77%	0.771	S	S	*	*			trans	-72	91.9	138.6	-175.4	25.1	0	0	0	108.7
7	G	41.1	Very low	39.9	Very low	60 Å²	60	147.3 Å²	147.3	62%	0.619	76%	0.755	S	S	*	*			trans	-149.2	14.2	-170.5	0	0	0	0	0	116.5	R5	R5-G7 PolarHBondContact O-N 3.02Å
8	K	42	Very low	39.8	Very low	185 Å²	185	147.5 Å²	147.5	80%	0.804	76%	0.758	S	S	*	*	S	Bend	trans	-118.9	-2.3	-178.7	-69.4	-172.8	178.3	-176.7	0	115.1
9	S	41.8	Very low	40.1	Very low	83 Å²	83	145.6 Å²	145.6	58%	0.58	75%	0.745	S	S	*	*	S	Bend	trans	-79.7	-26.6	178.9	-153.1	0	0	0	0	113.6
10	G	34.9	Very low	40.1	Very low	52 Å²	52	146.9 Å²	146.9	54%	0.536	75%	0.745	S	S	.	*	H	α-helix	trans	-81.8	-15.7	-175.6	0	0	0	0	0	115.9
11	L	45.2	Very low	40.5	Very low	125 Å²	125	143.4 Å²	143.4	65%	0.654	73%	0.733	S	S	*	*	H	α-helix	trans	-88.4	-22.8	-176.7	-147.9	140.4	0	0	0	112.3
12	L	44.3	Very low	41.2	Very low	144 Å²	144	136.6 Å²	136.6	75%	0.754	71%	0.712	S	S	*	*	H	α-helix	trans	-84.4	-29.4	172.7	-79.9	163.3	0	0	0	112.5	K14 W15	L12-K14 VanDerWaalsContact C-N 3.25Å; L12-K14 PolarHBondContact O-N 2.97Å; L12-W15 PolarHBondContact O-N 3.29Å
13	E	41.8	Very low	41.9	Very low	134 Å²	134	135.3 Å²	135.3	63%	0.626	70%	0.701	S	S	*	*	H	α-helix	trans	-70.1	-22.7	170.2	-75.9	-168.3	108.7	0	0	112.9	W15 R16	E13-W15 PolarHBondContact O-N 3.24Å; E13-R16 PolarHBondContact O-N 2.63Å
14	K	36	Very low	42.6	Very low	174 Å²	174	131.2 Å²	131.2	76%	0.757	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-6.7	178.8	-162.5	167.3	-177.8	176.6	0	114	L12	L12-K14 VanDerWaalsContact C-N 3.25Å; L12-K14 PolarHBondContact O-N 2.97Å
15	W	32.3	Very low	43.4	Very low	195 Å²	195	132.3 Å²	132.3	74%	0.739	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111	21.4	172.4	-61.5	103.9	0	0	0	112.7	L12 E13 I17	L12-W15 PolarHBondContact O-N 3.29Å; E13-W15 PolarHBondContact O-N 3.24Å; W15-I17 PolarHBondContact O-N 3.43Å
16	R	34.8	Very low	44.3	Very low	201 Å²	201	126.2 Å²	126.2	76%	0.758	64%	0.637	S	S	*	*	S	Bend	trans	-58.8	106.9	147.2	-83.4	-162.9	-172.4	-172.1	4.4	105.2	E13 D18	E13-R16 PolarHBondContact O-N 2.63Å; R16-D18 PolarHBondContact O-N 3.47Å
17	I	40.9	Very low	45.3	Very low	97 Å²	97	129.9 Å²	129.9	50%	0.497	64%	0.639	S	S	.	*			trans	-53.7	98	162.2	-60.8	161.5	0	0	0	103.2	W15 E19	W15-I17 PolarHBondContact O-N 3.43Å; I17-E19 HydrophobicContact CG2-CB 4.27Å; I17-E19 PolarHBondContact O-N 3.26Å
18	D	36.7	Very low	46.6	Very low	151 Å²	151	130.9 Å²	130.9	81%	0.807	63%	0.63	S	S	*	*			trans	-54.4	90.7	150.7	-91.2	-74.7	0	0	0	102.9	R16 K20	R16-D18 PolarHBondContact O-N 3.47Å; D18-K20 PolarHBondContact O-N 3.29Å
19	E	46.5	Very low	47.9	Very low	111 Å²	111	124 Å²	124	52%	0.519	61%	0.611	S	S	.	*			trans	-68.8	61	171.5	-160	170.4	109.6	0	0	105.8	I17 P21 K42 M182	I17-E19 HydrophobicContact CG2-CB 4.27Å; I17-E19 PolarHBondContact O-N 3.26Å; E19-P21 VanDerWaalsContact O-CD 3.3Å; E19-P21 WeakPolarHBondContact O-CD 3.06Å; E19-P21 VanDerWaalsContact O-N 3.14Å; E19-K42 IonicContact OE2-NZ 3Å; E19-K42 PolarHBondContact OE2-NZ 2.73Å; E19-M182 HydrophobicContact CG-CE 4.43Å
20	K	39.3	Very low	49.3	Very low	171 Å²	171	123.3 Å²	123.3	74%	0.743	61%	0.61	S	S	*	*			trans	-67.1	115.2	175.2	-163.4	172.2	-173.7	175	0	102.5	D18 V22	D18-K20 PolarHBondContact O-N 3.29Å; K20-V22 PolarHBondContact O-N 3.45Å
21	P	48.1	Very low	51.1	Low	75 Å²	75	122.4 Å²	122.4	49%	0.487	60%	0.598	S	S	.	*			trans	-53.9	112	-176.3	21.1	-32.1	0	0	0	106.8	E19 K23 T179	E19-P21 VanDerWaalsContact O-CD 3.3Å; E19-P21 WeakPolarHBondContact O-CD 3.06Å; E19-P21 VanDerWaalsContact O-N 3.14Å; P21-K23 VanDerWaalsContact C-N 3.26Å; P21-K23 PolarHBondContact O-N 3.3Å; P21-T179 HydrophobicContact CB-CG2 3.28Å; P21-T179 HydrophobicContact CG-CG2 4.41Å
22	V	51.8	Low	52.5	Low	109 Å²	109	116.7 Å²	116.7	66%	0.661	57%	0.568	S	S	*	*			trans	-66.1	100.7	178.8	-177.5	0	0	0	0	103.5	K20 I24	K20-V22 PolarHBondContact O-N 3.45Å; V22-I24 VanDerWaalsContact C-N 3.26Å; V22-I24 HydrophobicContact CB-CD1 4.36Å; V22-I24 HydrophobicContact CB-CG1 4.39Å; V22-I24 HydrophobicContact CG1-CD1 4.44Å; V22-I24 HydrophobicContact CG1-CG1 3.97Å; V22-I24 WeakPolarHBondContact O-CD1 3.23Å; V22-I24 WeakPolarHBondContact O-CG1 3.44Å; V22-I24 PolarHBondContact O-N 3.39Å
23	K	52.9	Low	53.9	Low	165 Å²	165	112.5 Å²	112.5	72%	0.717	54%	0.544	S	S	*	.			trans	-68.3	94.8	178.1	-168.6	172	-175.4	176.3	0	105.9	P21 S177	P21-K23 VanDerWaalsContact C-N 3.26Å; P21-K23 PolarHBondContact O-N 3.3Å; K23-S177 WeakPolarHBondContact CE-O 3.43Å
24	I	60.7	Low	55.7	Low	16 Å²	16	110.8 Å²	110.8	8%	0.082	54%	0.539	C	S	.	.			trans	-82.6	133.4	-178.4	-64.6	128.6	0	0	0	107.1	V22 K26 A31 V32 S35 F174 G178	V22-I24 VanDerWaalsContact C-N 3.26Å; V22-I24 HydrophobicContact CB-CD1 4.36Å; V22-I24 HydrophobicContact CB-CG1 4.39Å; V22-I24 HydrophobicContact CG1-CD1 4.44Å; V22-I24 HydrophobicContact CG1-CG1 3.97Å; V22-I24 WeakPolarHBondContact O-CD1 3.23Å; V22-I24 WeakPolarHBondContact O-CG1 3.44Å; V22-I24 PolarHBondContact O-N 3.39Å; I24-K26 PolarHBondContact O-N 3.31Å; I24-A31 HydrophobicContact CG2-CB 3.82Å; I24-V32 HydrophobicContact CG2-CG2 3.85Å; I24-S35 VanDerWaalsContact CD1-OG 3.28Å; I24-S35 WeakPolarHBondContact CD1-OG 3.38Å; I24-F174 HydrophobicContact CB-CE1 4.16Å; I24-F174 HydrophobicContact CD1-CE1 3.71Å; I24-F174 HydrophobicContact CD1-CZ 4.22Å; I24-G178 PolarHBondContact N-O 3.12Å
25	D	58.7	Low	57.5	Low	122 Å²	122	103.4 Å²	103.4	65%	0.652	51%	0.509	S	S	*	.			trans	-63.4	109	171.5	-82.2	-59.4	0	0	0	109.1	W27 D28	D25-W27 PolarHBondContact O-N 2.62Å; D25-D28 HydrophobicContact CB-CB 4.41Å; D25-D28 PolarHBondContact O-N 2.8Å
26	K	58.8	Low	59.5	Low	114 Å²	114	94.1 Å²	94.1	50%	0.496	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-15.3	-178.1	-67.4	-178.5	-77.1	-166.2	0	114.3	I24 E176	I24-K26 PolarHBondContact O-N 3.31Å; K26-E176 PolarHBondContact NZ-O 3.4Å
27	W	61.9	Low	61.6	Low	243 Å²	243	84.9 Å²	84.9	92%	0.92	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-14.7	-178	-58.1	84.5	0	0	0	112.8	D25 G29	D25-W27 PolarHBondContact O-N 2.62Å; W27-G29 PolarHBondContact O-N 3.46Å
28	D	70.1	Confident	63.2	Low	82 Å²	82	84.5 Å²	84.5	44%	0.439	44%	0.439	S	S	.	.			trans	-92.5	91.2	172.8	-173.3	2	0	0	0	109.8	D25 A30 A31 V32	D25-D28 HydrophobicContact CB-CB 4.41Å; D25-D28 PolarHBondContact O-N 2.8Å; D28-A30 PolarHBondContact O-N 3.01Å; D28-A30 VanDerWaalsContact O-N 3.11Å; D28-A30 WeakPolarHBondContact OD1-CB 3.15Å; D28-A30 PolarHBondContact OD1-N 3.26Å; D28-A31 HydrophobicContact CB-CB 3.87Å; D28-A31 PolarHBondContact O-N 2.9Å; D28-A31 PolarHBondContact OD1-N 2.96Å; D28-A31 WeakPolarHBondContact OD2-CB 3.24Å; D28-V32 WeakPolarHBondContact O-CG2 3.44Å; D28-V32 PolarHBondContact O-N 3.38Å
29	G	68.4	Low	65	Low	39 Å²	39	77.5 Å²	77.5	40%	0.402	40%	0.402	S	S	.	.	H	α-helix	trans	-56	-26	176.6	0	0	0	0	0	113.4	W27 K33 L140	W27-G29 PolarHBondContact O-N 3.46Å; G29-K33 VanDerWaalsContact O-CB 3.31Å; G29-K33 WeakPolarHBondContact O-CB 3.36Å; G29-K33 PolarHBondContact O-N 3Å; G29-L140 WeakPolarHBondContact O-CD2 3.48Å
30	A	71.3	Confident	66.2	Low	69 Å²	69	72.3 Å²	72.3	57%	0.57	38%	0.378	S	S	*	.	H	α-helix	trans	-73	-43.7	175.1	0	0	0	0	0	111.5	D28 K33 N34	D28-A30 PolarHBondContact O-N 3.01Å; D28-A30 VanDerWaalsContact O-N 3.11Å; D28-A30 WeakPolarHBondContact OD1-CB 3.15Å; D28-A30 PolarHBondContact OD1-N 3.26Å; A30-K33 PolarHBondContact O-N 3.4Å; A30-N34 VanDerWaalsContact O-CB 3.32Å; A30-N34 WeakPolarHBondContact O-CB 3.24Å; A30-N34 PolarHBondContact O-N 2.95Å
31	A	72	Confident	67.6	Low	33 Å²	33	66.4 Å²	66.4	27%	0.273	35%	0.352	S	S	.	.	H	α-helix	trans	-64.6	-42.1	176.1	0	0	0	0	0	112	I24 D28 N34 S35	I24-A31 HydrophobicContact CG2-CB 3.82Å; D28-A31 HydrophobicContact CB-CB 3.87Å; D28-A31 PolarHBondContact O-N 2.9Å; D28-A31 PolarHBondContact OD1-N 2.96Å; D28-A31 WeakPolarHBondContact OD2-CB 3.24Å; A31-N34 PolarHBondContact O-N 2.87Å; A31-S35 WeakPolarHBondContact O-CB 2.98Å; A31-S35 PolarHBondContact O-N 3.44Å; A31-S35 PolarHBondContact O-OG 3.47Å
32	V	74.3	Confident	68.8	Low	5 Å²	5	64.5 Å²	64.5	3%	0.03	34%	0.336	C	S	.	.	H	α-helix	trans	-57.6	-51.9	173.4	167.1	0	0	0	0	110.6	I24 D28 N34 S35 L36 L140 V170 F174	I24-V32 HydrophobicContact CG2-CG2 3.85Å; D28-V32 WeakPolarHBondContact O-CG2 3.44Å; D28-V32 PolarHBondContact O-N 3.38Å; V32-N34 PolarHBondContact O-N 3.2Å; V32-S35 PolarHBondContact O-N 3.26Å; V32-S35 PolarHBondContact O-OG 2.85Å; V32-L36 HydrophobicContact CG1-CD1 4.01Å; V32-L36 WeakPolarHBondContact O-CG 3.41Å; V32-L36 PolarHBondContact O-N 3.06Å; V32-L140 HydrophobicContact CG1-CD2 4.23Å; V32-V170 HydrophobicContact CG1-CB 4.3Å; V32-V170 HydrophobicContact CG1-CG1 3.36Å; V32-V170 HydrophobicContact CG1-CG2 3.89Å; V32-F174 HydrophobicContact CB-CZ 4.47Å; V32-F174 HydrophobicContact CG1-CE2 3.82Å; V32-F174 HydrophobicContact CG1-CZ 4Å; V32-F174 HydrophobicContact CG2-CZ 4.39Å
33	K	75.1	Confident	69.6	Low	56 Å²	56	60 Å²	60	24%	0.243	31%	0.309	C	S	.	.	H	α-helix	trans	-58.2	-50.5	178.8	-171.2	-174.7	178.4	178.1	0	111	G29 A30 S35 L36 D37 S138 L140	G29-K33 VanDerWaalsContact O-CB 3.31Å; G29-K33 WeakPolarHBondContact O-CB 3.36Å; G29-K33 PolarHBondContact O-N 3Å; A30-K33 PolarHBondContact O-N 3.4Å; K33-S35 VanDerWaalsContact C-N 3.25Å; K33-S35 PolarHBondContact O-N 3.29Å; K33-L36 PolarHBondContact O-N 3.07Å; K33-D37 WeakPolarHBondContact O-CB 3.48Å; K33-D37 PolarHBondContact O-N 2.64Å; K33-S138 WeakPolarHBondContact CE-O 3.13Å; K33-S138 WeakPolarHBondContact CE-OG 3.28Å; K33-S138 PolarHBondContact NZ-O 2.74Å; K33-L140 HydrophobicContact CB-CB 4.2Å; K33-L140 HydrophobicContact CB-CD2 3.91Å; K33-L140 HydrophobicContact CD-CB 4.01Å; K33-L140 HydrophobicContact CG-CB 4.05Å
34	N	78.2	Confident	70.3	Confident	99 Å²	99	52.4 Å²	52.4	53%	0.529	28%	0.276	S	S	.	.	H	α-helix	trans	-61.5	-34	-178.4	-169.9	61.6	0	0	0	112.5	A30 A31 V32 D38	A30-N34 VanDerWaalsContact O-CB 3.32Å; A30-N34 WeakPolarHBondContact O-CB 3.24Å; A30-N34 PolarHBondContact O-N 2.95Å; A31-N34 PolarHBondContact O-N 2.87Å; V32-N34 PolarHBondContact O-N 3.2Å; N34-D38 WeakPolarHBondContact O-CB 3.42Å; N34-D38 PolarHBondContact O-N 3.47Å
35	S	74.9	Confident	70.5	Confident	19 Å²	19	54 Å²	54	13%	0.133	29%	0.285	C	S	.	.	H	α-helix	trans	-72.3	-39.5	176.5	68.4	0	0	0	0	114	I24 A31 V32 K33 D37 D38 A39	I24-S35 VanDerWaalsContact CD1-OG 3.28Å; I24-S35 WeakPolarHBondContact CD1-OG 3.38Å; A31-S35 WeakPolarHBondContact O-CB 2.98Å; A31-S35 PolarHBondContact O-N 3.44Å; A31-S35 PolarHBondContact O-OG 3.47Å; V32-S35 PolarHBondContact O-N 3.26Å; V32-S35 PolarHBondContact O-OG 2.85Å; K33-S35 VanDerWaalsContact C-N 3.25Å; K33-S35 PolarHBondContact O-N 3.29Å; S35-D37 VanDerWaalsContact C-N 3.31Å; S35-D38 PolarHBondContact O-N 2.75Å; S35-A39 WeakPolarHBondContact O-CB 3.35Å; S35-A39 PolarHBondContact O-N 2.92Å
36	L	75	Confident	70.8	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-66.2	-39.5	174.4	-73.4	165.9	0	0	0	110.7	V32 K33 A39 A40 Y147 V170 F173 F174 L180 F185	V32-L36 HydrophobicContact CG1-CD1 4.01Å; V32-L36 WeakPolarHBondContact O-CG 3.41Å; V32-L36 PolarHBondContact O-N 3.06Å; K33-L36 PolarHBondContact O-N 3.07Å; L36-A39 PolarHBondContact O-N 2.79Å; L36-A40 WeakPolarHBondContact O-CB 3.24Å; L36-A40 PolarHBondContact O-N 3.35Å; L36-Y147 HydrophobicContact CB-CD2 4.5Å; L36-Y147 HydrophobicContact CB-CE1 4.32Å; L36-Y147 HydrophobicContact CB-CE2 3.93Å; L36-Y147 HydrophobicContact CD1-CD1 4.14Å; L36-Y147 HydrophobicContact CD1-CD2 3.67Å; L36-Y147 HydrophobicContact CD1-CE1 4.4Å; L36-Y147 HydrophobicContact CD1-CE2 3.97Å; L36-Y147 HydrophobicContact CD1-CG 3.76Å; L36-V170 HydrophobicContact CD1-CG2 4.36Å; L36-F173 HydrophobicContact CD2-CB 4.05Å; L36-F173 HydrophobicContact CD2-CD2 4.23Å; L36-F173 HydrophobicContact CD2-CG 4.26Å; L36-F174 HydrophobicContact CD1-CE2 4.15Å; L36-F174 HydrophobicContact CD2-CE2 4.1Å; L36-F174 HydrophobicContact CG-CE2 4.05Å; L36-F174 HydrophobicContact CG-CZ 4.41Å; L36-L180 HydrophobicContact CD2-CD1 3.42Å; L36-L180 VanDerWaalsContact CD2-CD1 3.42Å; L36-L180 HydrophobicContact CG-CD1 4.31Å; L36-F185 HydrophobicContact CB-CE2 4.49Å; L36-F185 HydrophobicContact CB-CZ 4.47Å; L36-F185 HydrophobicContact CD2-CD2 3.8Å; L36-F185 HydrophobicContact CD2-CE2 3.64Å; L36-F185 HydrophobicContact CD2-CZ 4.29Å; L36-F185 WeakPolarHBondContact O-CZ 3.41Å
37	D	77.5	Confident	70.9	Confident	6 Å²	6	54.8 Å²	54.8	3%	0.032	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-46.4	175.2	-82	-13.5	0	0	0	111.8	K33 S35 A40 K41 F117 S138 Y147	K33-D37 WeakPolarHBondContact O-CB 3.48Å; K33-D37 PolarHBondContact O-N 2.64Å; S35-D37 VanDerWaalsContact C-N 3.31Å; D37-A40 PolarHBondContact O-N 3.01Å; D37-K41 WeakPolarHBondContact O-CB 3.37Å; D37-K41 PolarHBondContact O-N 3.41Å; D37-F117 HydrophobicContact CB-CD1 3.72Å; D37-F117 HydrophobicContact CB-CD2 3.96Å; D37-F117 HydrophobicContact CB-CE1 3.46Å; D37-F117 VanDerWaalsContact CB-CE1 3.46Å; D37-F117 HydrophobicContact CB-CE2 3.68Å; D37-F117 HydrophobicContact CB-CG 4Å; D37-F117 HydrophobicContact CB-CZ 3.45Å; D37-F117 VanDerWaalsContact CB-CZ 3.45Å; D37-F117 WeakPolarHBondContact O-CE1 3.46Å; D37-F117 WeakPolarHBondContact OD2-CD2 3.32Å; D37-S138 WeakPolarHBondContact OD1-CB 3.13Å; D37-S138 PolarHBondContact OD1-OG 2.97Å; D37-S138 PolarHBondContact OD2-OG 3.46Å; D37-S138 VanDerWaalsContact OD2-OG 3.08Å; D37-Y147 PolarHBondContact OD1-OH 3.45Å
38	D	74.4	Confident	70.6	Confident	90 Å²	90	46.1 Å²	46.1	48%	0.481	25%	0.252	S	S	.	.	H	α-helix	trans	-65.1	-40.6	175.6	-167.4	-105.4	0	0	0	111.9	N34 S35 K41 K42	N34-D38 WeakPolarHBondContact O-CB 3.42Å; N34-D38 PolarHBondContact O-N 3.47Å; S35-D38 PolarHBondContact O-N 2.75Å; D38-K41 WeakPolarHBondContact O-CB 3.45Å; D38-K41 PolarHBondContact O-N 2.91Å; D38-K42 VanDerWaalsContact O-CB 3.32Å; D38-K42 WeakPolarHBondContact O-CB 3.49Å; D38-K42 PolarHBondContact O-N 3.31Å
39	A	74.2	Confident	69.8	Low	3 Å²	3	45 Å²	45	3%	0.025	26%	0.26	C	S	.	.	H	α-helix	trans	-64.3	-41.6	174.9	0	0	0	0	0	112.4	S35 L36 K41 K42 V43 L180 F185	S35-A39 WeakPolarHBondContact O-CB 3.35Å; S35-A39 PolarHBondContact O-N 2.92Å; L36-A39 PolarHBondContact O-N 2.79Å; A39-K41 VanDerWaalsContact C-N 3.33Å; A39-K41 PolarHBondContact O-N 3.23Å; A39-K42 PolarHBondContact O-N 3.03Å; A39-V43 VanDerWaalsContact O-CG2 3.32Å; A39-V43 WeakPolarHBondContact O-CG2 3.26Å; A39-V43 PolarHBondContact O-N 2.9Å; A39-L180 HydrophobicContact CB-CD2 3.38Å; A39-F185 HydrophobicContact CB-CD1 4.18Å; A39-F185 HydrophobicContact CB-CE1 4.19Å
40	A	72	Confident	69.5	Low	2 Å²	2	43.9 Å²	43.9	2%	0.017	24%	0.243	C	C	.	.	H	α-helix	trans	-62.4	-43.8	175.7	0	0	0	0	0	111.3	L36 D37 V43 L44 L136 L149 F185	L36-A40 WeakPolarHBondContact O-CB 3.24Å; L36-A40 PolarHBondContact O-N 3.35Å; D37-A40 PolarHBondContact O-N 3.01Å; A40-V43 PolarHBondContact O-N 2.98Å; A40-L44 PolarHBondContact O-N 2.92Å; A40-L44 VanDerWaalsContact O-N 3.09Å; A40-L136 HydrophobicContact CB-CD1 4.3Å; A40-L149 HydrophobicContact CB-CD2 4.43Å; A40-F185 HydrophobicContact CB-CE1 3.76Å; A40-F185 HydrophobicContact CB-CZ 4Å
41	K	69.5	Low	68.7	Low	47 Å²	47	44.5 Å²	44.5	20%	0.204	24%	0.24	C	C	.	.	H	α-helix	trans	-60.6	-46.6	174.4	169.1	175.7	158.6	148.5	0	111.3	D37 D38 A39 V43 L44 L45 E52 L118	D37-K41 WeakPolarHBondContact O-CB 3.37Å; D37-K41 PolarHBondContact O-N 3.41Å; D38-K41 WeakPolarHBondContact O-CB 3.45Å; D38-K41 PolarHBondContact O-N 2.91Å; A39-K41 VanDerWaalsContact C-N 3.33Å; A39-K41 PolarHBondContact O-N 3.23Å; K41-V43 PolarHBondContact O-N 2.84Å; K41-L44 PolarHBondContact O-N 3.15Å; K41-L45 HydrophobicContact CD-CD1 4.31Å; K41-L45 HydrophobicContact CG-CD1 3.52Å; K41-L45 HydrophobicContact CG-CG 4.38Å; K41-L45 WeakPolarHBondContact O-CB 2.74Å; K41-L45 VanDerWaalsContact O-CG 3.26Å; K41-L45 WeakPolarHBondContact O-CG 2.92Å; K41-L45 PolarHBondContact O-N 3.43Å; K41-E52 VanDerWaalsContact CD-OE1 3.23Å; K41-E52 WeakPolarHBondContact CD-OE1 3.34Å; K41-E52 WeakPolarHBondContact CE-OE1 3.38Å; K41-E52 WeakPolarHBondContact CE-OE2 3.32Å; K41-E52 IonicContact NZ-OE1 3.4Å; K41-E52 PolarHBondContact NZ-OE1 3.25Å; K41-E52 IonicContact NZ-OE2 3.05Å; K41-E52 PolarHBondContact NZ-OE2 2.94Å; K41-L118 HydrophobicContact CB-CD2 4.09Å; K41-L118 HydrophobicContact CD-CD1 4.24Å; K41-L118 HydrophobicContact CG-CD1 4.34Å; K41-L118 HydrophobicContact CG-CD2 4.2Å
42	K	72.3	Confident	68	Low	36 Å²	36	44.5 Å²	44.5	16%	0.157	23%	0.234	C	C	.	.	H	α-helix	trans	-58.8	-46.9	177.5	-171.8	-179.2	174.2	-168.1	0	111.8	E19 D38 A39 L44 L45 E46 M182	E19-K42 IonicContact OE2-NZ 3Å; E19-K42 PolarHBondContact OE2-NZ 2.73Å; D38-K42 VanDerWaalsContact O-CB 3.32Å; D38-K42 WeakPolarHBondContact O-CB 3.49Å; D38-K42 PolarHBondContact O-N 3.31Å; A39-K42 PolarHBondContact O-N 3.03Å; K42-L44 VanDerWaalsContact C-N 3.35Å; K42-L44 PolarHBondContact O-N 3.41Å; K42-L45 PolarHBondContact O-N 2.76Å; K42-E46 WeakPolarHBondContact CD-OE2 3.04Å; K42-E46 WeakPolarHBondContact CE-OE2 3.26Å; K42-E46 WeakPolarHBondContact CG-OE2 3.43Å; K42-E46 WeakPolarHBondContact O-CB 3.11Å; K42-E46 PolarHBondContact O-N 2.74Å; K42-M182 HydrophobicContact CD-CE 4.36Å; K42-M182 HydrophobicContact CD-SD 4.47Å
43	V	69.7	Low	67.2	Low	14 Å²	14	46.2 Å²	46.2	9%	0.085	24%	0.243	C	C	.	.	I	π-helix	trans	-59.5	-43.4	176.4	169.8	0	0	0	0	111.4	A39 A40 K41 K47 E186 V189	A39-V43 VanDerWaalsContact O-CG2 3.32Å; A39-V43 WeakPolarHBondContact O-CG2 3.26Å; A39-V43 PolarHBondContact O-N 2.9Å; A40-V43 PolarHBondContact O-N 2.98Å; K41-V43 PolarHBondContact O-N 2.84Å; V43-K47 WeakPolarHBondContact O-CA 3.39Å; V43-K47 WeakPolarHBondContact O-CB 3.32Å; V43-K47 PolarHBondContact O-N 2.66Å; V43-E186 HydrophobicContact CG1-CG 3.97Å; V43-E186 HydrophobicContact CG2-CB 4.18Å; V43-E186 HydrophobicContact CG2-CG 4.09Å; V43-V189 HydrophobicContact CG1-CB 4.5Å; V43-V189 HydrophobicContact CG1-CG1 4.07Å
44	L	67	Low	66.4	Low	6 Å²	6	48.2 Å²	48.2	3%	0.031	25%	0.252	C	S	.	.	I	π-helix	trans	-73.3	-30	-179.8	-79.5	153.7	0	0	0	113.5	A40 K41 K42 Y48 G49 Y50 L136	A40-L44 PolarHBondContact O-N 2.92Å; A40-L44 VanDerWaalsContact O-N 3.09Å; K41-L44 PolarHBondContact O-N 3.15Å; K42-L44 VanDerWaalsContact C-N 3.35Å; K42-L44 PolarHBondContact O-N 3.41Å; L44-Y48 HydrophobicContact CD2-CD2 4.15Å; L44-Y48 WeakPolarHBondContact O-CB 3.43Å; L44-Y48 PolarHBondContact O-N 3.01Å; L44-G49 PolarHBondContact O-N 2.92Å; L44-Y50 HydrophobicContact CB-CD2 4.39Å; L44-Y50 HydrophobicContact CD2-CD2 3.73Å; L44-Y50 HydrophobicContact CD2-CE2 3.69Å; L44-L136 HydrophobicContact CD1-CD1 3.2Å; L44-L136 HydrophobicContact CD1-CD2 3.41Å; L44-L136 VanDerWaalsContact CD1-CD2 3.41Å; L44-L136 HydrophobicContact CD1-CG 3.73Å
45	L	66.1	Low	65.4	Low	49 Å²	49	49.8 Å²	49.8	26%	0.257	26%	0.256	S	S	.	.	I	π-helix	trans	-79.1	-51.8	178.1	-73	167.7	0	0	0	112.9	K41 K42 G49 Y50 E52	K41-L45 HydrophobicContact CD-CD1 4.31Å; K41-L45 HydrophobicContact CG-CD1 3.52Å; K41-L45 HydrophobicContact CG-CG 4.38Å; K41-L45 WeakPolarHBondContact O-CB 2.74Å; K41-L45 VanDerWaalsContact O-CG 3.26Å; K41-L45 WeakPolarHBondContact O-CG 2.92Å; K41-L45 PolarHBondContact O-N 3.43Å; K42-L45 PolarHBondContact O-N 2.76Å; L45-G49 VanDerWaalsContact O-CA 3.24Å; L45-G49 WeakPolarHBondContact O-CA 3.41Å; L45-G49 PolarHBondContact O-N 2.9Å; L45-Y50 WeakPolarHBondContact CD2-O 3.36Å; L45-E52 HydrophobicContact CD1-CG 3.8Å; L45-E52 WeakPolarHBondContact CD1-OE2 3.46Å; L45-E52 HydrophobicContact CD2-CG 3.31Å; L45-E52 HydrophobicContact CG-CG 4Å
46	E	64.8	Low	64.8	Low	128 Å²	128	51.1 Å²	51.1	60%	0.598	26%	0.262	S	S	*	.	I	π-helix	trans	-78.7	-37.2	-175.2	-75	-174.2	96.9	0	0	112.4	K42	K42-E46 WeakPolarHBondContact CD-OE2 3.04Å; K42-E46 WeakPolarHBondContact CE-OE2 3.26Å; K42-E46 WeakPolarHBondContact CG-OE2 3.43Å; K42-E46 WeakPolarHBondContact O-CB 3.11Å; K42-E46 PolarHBondContact O-N 2.74Å
47	K	60.1	Low	64.4	Low	124 Å²	124	54.5 Å²	54.5	54%	0.539	28%	0.283	S	S	.	.	I	π-helix	trans	-88.7	-30.9	-174	-124.7	-103.2	-175.5	124.1	0	112.8	V43 E186	V43-K47 WeakPolarHBondContact O-CA 3.39Å; V43-K47 WeakPolarHBondContact O-CB 3.32Å; V43-K47 PolarHBondContact O-N 2.66Å; K47-E186 WeakPolarHBondContact CE-OE1 3.45Å; K47-E186 IonicContact NZ-OE1 3.09Å; K47-E186 PolarHBondContact NZ-OE1 3.32Å
48	Y	56.4	Low	64.2	Low	62 Å²	62	58 Å²	58	24%	0.243	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-7.2	-177.8	-63.9	-90	0	0	0	114.7	L44 Y50 H193	L44-Y48 HydrophobicContact CD2-CD2 4.15Å; L44-Y48 WeakPolarHBondContact O-CB 3.43Å; L44-Y48 PolarHBondContact O-N 3.01Å; Y48-Y50 HydrophobicContact CD1-CE2 4.27Å; Y48-Y50 HydrophobicContact CG-CD2 4.5Å; Y48-Y50 AromaticContact CG-CE2 3.87Å; Y48-Y50 HydrophobicContact CG-CE2 3.87Å; Y48-Y50 PolarHBondContact O-N 2.87Å; Y48-H193 AromaticContact CD1-CE1 3.81Å; Y48-H193 AromaticContact CD1-NE2 3.89Å; Y48-H193 AromaticContact CE1-CE1 3.35Å; Y48-H193 WeakPolarHBondContact CE1-CE1 3.23Å; Y48-H193 AromaticContact CE1-ND1 3.5Å; Y48-H193 AromaticContact CE1-NE2 3.79Å; Y48-H193 AromaticContact CZ-CG 3.95Å; Y48-H193 AromaticContact CZ-ND1 3.78Å
49	G	52.8	Low	64.2	Low	59 Å²	59	54.3 Å²	54.3	61%	0.608	28%	0.284	S	S	*	.			trans	66.3	21.3	173.7	0	0	0	0	0	114.6	L44 L45	L44-G49 PolarHBondContact O-N 2.92Å; L45-G49 VanDerWaalsContact O-CA 3.24Å; L45-G49 WeakPolarHBondContact O-CA 3.41Å; L45-G49 PolarHBondContact O-N 2.9Å
50	Y	61.3	Low	64.3	Low	14 Å²	14	59.2 Å²	59.2	6%	0.055	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-71.7	144.7	-177.6	-61.3	-38.3	0	0	0	112	L44 L45 Y48 Q122 W134 H193	L44-Y50 HydrophobicContact CB-CD2 4.39Å; L44-Y50 HydrophobicContact CD2-CD2 3.73Å; L44-Y50 HydrophobicContact CD2-CE2 3.69Å; L45-Y50 WeakPolarHBondContact CD2-O 3.36Å; Y48-Y50 HydrophobicContact CD1-CE2 4.27Å; Y48-Y50 HydrophobicContact CG-CD2 4.5Å; Y48-Y50 AromaticContact CG-CE2 3.87Å; Y48-Y50 HydrophobicContact CG-CE2 3.87Å; Y48-Y50 PolarHBondContact O-N 2.87Å; Y50-Q122 HydrophobicContact CD1-CB 3.56Å; Y50-Q122 HydrophobicContact CD1-CG 3.79Å; Y50-Q122 HydrophobicContact CE1-CB 3.44Å; Y50-Q122 VanDerWaalsContact CE1-CB 3.44Å; Y50-Q122 HydrophobicContact CE1-CG 3.32Å; Y50-Q122 PolarHBondContact OH-OE1 3.4Å; Y50-W134 AromaticContact CZ-NE1 3.98Å; Y50-H193 AromaticContact CE2-NE2 3.93Å; Y50-H193 AromaticContact CZ-NE2 3.85Å; Y50-H193 PolarHBondContact OH-NE2 3.28Å
51	V	55.4	Low	64.7	Low	83 Å²	83	64.3 Å²	64.3	50%	0.503	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	120.9	178	178.9	0	0	0	0	108.3	N53 M121	V51-N53 PolarHBondContact O-N 3.46Å; V51-M121 PolarHBondContact N-O 3.24Å; V51-M121 PolarHBondContact O-N 3.49Å
52	E	57.4	Low	65.1	Low	32 Å²	32	67.5 Å²	67.5	15%	0.15	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	132.3	173.5	-57.4	-165.1	79.3	0	0	110.8	K41 L45 F54 L118	K41-E52 VanDerWaalsContact CD-OE1 3.23Å; K41-E52 WeakPolarHBondContact CD-OE1 3.34Å; K41-E52 WeakPolarHBondContact CE-OE1 3.38Å; K41-E52 WeakPolarHBondContact CE-OE2 3.32Å; K41-E52 IonicContact NZ-OE1 3.4Å; K41-E52 PolarHBondContact NZ-OE1 3.25Å; K41-E52 IonicContact NZ-OE2 3.05Å; K41-E52 PolarHBondContact NZ-OE2 2.94Å; L45-E52 HydrophobicContact CD1-CG 3.8Å; L45-E52 WeakPolarHBondContact CD1-OE2 3.46Å; L45-E52 HydrophobicContact CD2-CG 3.31Å; L45-E52 HydrophobicContact CG-CG 4Å; E52-F54 HydrophobicContact CB-CD2 4.26Å; E52-F54 HydrophobicContact CB-CE1 4.32Å; E52-F54 HydrophobicContact CB-CE2 3.77Å; E52-F54 HydrophobicContact CB-CZ 3.8Å; E52-F54 HydrophobicContact CG-CZ 4.3Å; E52-F54 WeakPolarHBondContact OE2-CZ 3.43Å; E52-L118 HydrophobicContact CG-CD1 4.25Å; E52-L118 WeakPolarHBondContact OE1-CD1 3.33Å
53	N	57.7	Low	65.3	Low	41 Å²	41	68.2 Å²	68.2	22%	0.219	35%	0.352	C	S	.	.			trans	-95	98.8	170	-150.7	11.4	0	0	0	108.1	V51 Q55 V119 M121	V51-N53 PolarHBondContact O-N 3.46Å; N53-Q55 PolarHBondContact O-N 3.3Å; N53-Q55 WeakPolarHBondContact OD1-CG 3.26Å; N53-V119 WeakPolarHBondContact CA-O 3.15Å; N53-V119 HydrophobicContact CB-CB 4.17Å; N53-V119 HydrophobicContact CB-CG1 3.99Å; N53-V119 VanDerWaalsContact CB-O 3.26Å; N53-V119 WeakPolarHBondContact CB-O 3.36Å; N53-V119 PolarHBondContact N-O 3.41Å; N53-M121 HydrophobicContact CB-CG 4.4Å; N53-M121 VanDerWaalsContact ND2-CE 3.33Å; N53-M121 WeakPolarHBondContact ND2-CE 3.33Å
54	F	58.2	Low	65.8	Low	98 Å²	98	70.6 Å²	70.6	43%	0.43	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	7.7	-177	-68.1	-79.5	0	0	0	114.5	E52 L56 V57 D58	E52-F54 HydrophobicContact CB-CD2 4.26Å; E52-F54 HydrophobicContact CB-CE1 4.32Å; E52-F54 HydrophobicContact CB-CE2 3.77Å; E52-F54 HydrophobicContact CB-CZ 3.8Å; E52-F54 HydrophobicContact CG-CZ 4.3Å; E52-F54 WeakPolarHBondContact OE2-CZ 3.43Å; F54-L56 PolarHBondContact O-N 2.8Å; F54-V57 PolarHBondContact O-N 3.39Å; F54-D58 WeakPolarHBondContact CB-OD2 3.43Å; F54-D58 PolarHBondContact O-N 3.32Å
55	Q	57	Low	66.6	Low	132 Å²	132	73.5 Å²	73.5	62%	0.617	39%	0.387	S	S	*	.	H	α-helix	trans	-55.6	-28.9	-172.2	-58.4	-152.7	-72.1	0	0	114.5	N53 G59	N53-Q55 PolarHBondContact O-N 3.3Å; N53-Q55 WeakPolarHBondContact OD1-CG 3.26Å; Q55-G59 PolarHBondContact O-N 2.78Å
56	L	63.1	Low	67.4	Low	47 Å²	47	74.5 Å²	74.5	25%	0.246	40%	0.395	C	S	.	.	H	α-helix	trans	-72.2	-42.4	175.9	-70.2	88.2	0	0	0	111.7	F54 R60 E113 I116 V119	F54-L56 PolarHBondContact O-N 2.8Å; L56-R60 PolarHBondContact O-N 3.09Å; L56-E113 HydrophobicContact CD2-CG 4Å; L56-I116 WeakPolarHBondContact CD2-O 3.33Å; L56-V119 HydrophobicContact CD1-CB 4.42Å; L56-V119 HydrophobicContact CD1-CG2 3.78Å
57	V	66.5	Low	68.1	Low	72 Å²	72	70.1 Å²	70.1	44%	0.436	38%	0.379	S	S	.	.	H	α-helix	trans	-69.7	-45.1	176.9	-179.8	0	0	0	0	110.3	F54 G59 R60 L61	F54-V57 PolarHBondContact O-N 3.39Å; V57-G59 VanDerWaalsContact C-N 3.29Å; V57-G59 PolarHBondContact O-N 2.83Å; V57-R60 PolarHBondContact O-N 3.3Å; V57-L61 PolarHBondContact O-N 3.3Å
58	D	73.1	Confident	69.1	Low	78 Å²	78	67.9 Å²	67.9	42%	0.417	38%	0.377	S	S	.	.	H	α-helix	trans	-62.1	-37.4	176.8	-66.4	-30	0	0	0	111.4	F54 L61 L62	F54-D58 WeakPolarHBondContact CB-OD2 3.43Å; F54-D58 PolarHBondContact O-N 3.32Å; D58-L61 PolarHBondContact O-N 2.78Å; D58-L62 WeakPolarHBondContact O-CB 3.42Å; D58-L62 VanDerWaalsContact O-CG 3.25Å; D58-L62 WeakPolarHBondContact O-CG 3.4Å; D58-L62 PolarHBondContact O-N 3.41Å
59	G	73	Confident	70.4	Confident	13 Å²	13	69.4 Å²	69.4	13%	0.134	39%	0.389	C	S	.	.	H	α-helix	trans	-59.7	-47	173.9	0	0	0	0	0	112.5	Q55 V57 I63	Q55-G59 PolarHBondContact O-N 2.78Å; V57-G59 VanDerWaalsContact C-N 3.29Å; V57-G59 PolarHBondContact O-N 2.83Å; G59-I63 WeakPolarHBondContact O-CD1 3.27Å; G59-I63 WeakPolarHBondContact O-CG1 3.48Å; G59-I63 PolarHBondContact O-N 3.01Å; G59-I63 VanDerWaalsContact O-N 3.12Å
60	R	76.9	Confident	71.6	Confident	107 Å²	107	72.6 Å²	72.6	40%	0.404	39%	0.387	S	S	.	.	H	α-helix	trans	-63.4	-44	175.6	-68.6	-175.1	-65.2	-165.7	7.2	111.6	L56 V57 L62 I63 C64 T109 E113	L56-R60 PolarHBondContact O-N 3.09Å; V57-R60 PolarHBondContact O-N 3.3Å; R60-L62 PolarHBondContact O-N 3.34Å; R60-I63 PolarHBondContact O-N 3.16Å; R60-C64 PolarHBondContact O-N 3.41Å; R60-C64 PolarHBondContact O-SG 3.09Å; R60-C64 VanDerWaalsContact O-SG 3.4Å; R60-T109 HydrophobicContact CG-CG2 4.42Å; R60-E113 IonicContact CZ-OE1 2.62Å; R60-E113 VanDerWaalsContact CZ-OE1 3.28Å; R60-E113 IonicContact NE-OE1 2.87Å; R60-E113 IonicContact NH1-OE1 3.49Å; R60-E113 PolarHBondContact NH1-OE1 2.8Å
61	L	79.9	Confident	72.2	Confident	109 Å²	109	74.4 Å²	74.4	57%	0.571	41%	0.405	S	S	*	.	H	α-helix	trans	-61.7	-44.5	179.3	-176.6	65.8	0	0	0	112	V57 D58 C64 T65	V57-L61 PolarHBondContact O-N 3.3Å; D58-L61 PolarHBondContact O-N 2.78Å; L61-C64 PolarHBondContact O-N 3.34Å; L61-T65 WeakPolarHBondContact O-CB 3.34Å; L61-T65 PolarHBondContact O-N 3.34Å; L61-T65 PolarHBondContact O-OG1 3.24Å
62	L	78.8	Confident	73.5	Confident	114 Å²	114	75.6 Å²	75.6	60%	0.597	41%	0.406	S	S	*	.	H	α-helix	trans	-62.4	-44.5	177.7	-75.8	171.9	0	0	0	111.5	D58 R60 C64 T65 V66	D58-L62 WeakPolarHBondContact O-CB 3.42Å; D58-L62 VanDerWaalsContact O-CG 3.25Å; D58-L62 WeakPolarHBondContact O-CG 3.4Å; D58-L62 PolarHBondContact O-N 3.41Å; R60-L62 PolarHBondContact O-N 3.34Å; L62-C64 PolarHBondContact O-N 3.4Å; L62-T65 PolarHBondContact O-N 2.82Å; L62-V66 WeakPolarHBondContact O-CG2 3.5Å; L62-V66 PolarHBondContact O-N 3.07Å
63	I	77.3	Confident	74.3	Confident	51 Å²	51	79.3 Å²	79.3	26%	0.262	43%	0.427	S	S	.	.	H	α-helix	trans	-64.9	-43.2	-179.7	-62.7	161.3	0	0	0	111	G59 R60 T65 V66 S67 L105 Y108	G59-I63 WeakPolarHBondContact O-CD1 3.27Å; G59-I63 WeakPolarHBondContact O-CG1 3.48Å; G59-I63 PolarHBondContact O-N 3.01Å; G59-I63 VanDerWaalsContact O-N 3.12Å; R60-I63 PolarHBondContact O-N 3.16Å; I63-T65 VanDerWaalsContact C-N 3.33Å; I63-T65 PolarHBondContact O-N 2.75Å; I63-V66 PolarHBondContact O-N 3.45Å; I63-S67 PolarHBondContact O-N 2.75Å; I63-L105 HydrophobicContact CB-CD1 4.05Å; I63-L105 HydrophobicContact CD1-CD1 3.79Å; I63-L105 HydrophobicContact CG2-CB 4.16Å; I63-L105 HydrophobicContact CG2-CD1 3.67Å; I63-L105 HydrophobicContact CG2-CD2 4.3Å; I63-L105 HydrophobicContact CG2-CG 4.24Å; I63-Y108 HydrophobicContact CD1-CD1 3.87Å; I63-Y108 HydrophobicContact CD1-CE1 4.18Å; I63-Y108 HydrophobicContact CD1-CG 4.44Å
64	C	79.1	Confident	74.9	Confident	63 Å²	63	79 Å²	79	43%	0.426	43%	0.429	S	S	.	.	H	α-helix	trans	-61.5	-42	174.4	-70.9	0	0	0	0	111.9	R60 L61 L62 V66 S67 C68	R60-C64 PolarHBondContact O-N 3.41Å; R60-C64 PolarHBondContact O-SG 3.09Å; R60-C64 VanDerWaalsContact O-SG 3.4Å; L61-C64 PolarHBondContact O-N 3.34Å; L62-C64 PolarHBondContact O-N 3.4Å; C64-V66 PolarHBondContact O-N 3.02Å; C64-S67 WeakPolarHBondContact O-CB 3.29Å; C64-S67 PolarHBondContact O-N 2.81Å; C64-C68 PolarHBondContact O-N 3.12Å; C64-C68 PolarHBondContact O-SG 2.88Å
65	T	84.9	Confident	75.5	Confident	68 Å²	68	80.1 Å²	80.1	42%	0.417	44%	0.439	S	S	.	.	H	α-helix	trans	-62.1	-44.8	178.6	-57	0	0	0	0	111.4	L61 L62 I63 C68 L69	L61-T65 WeakPolarHBondContact O-CB 3.34Å; L61-T65 PolarHBondContact O-N 3.34Å; L61-T65 PolarHBondContact O-OG1 3.24Å; L62-T65 PolarHBondContact O-N 2.82Å; I63-T65 VanDerWaalsContact C-N 3.33Å; I63-T65 PolarHBondContact O-N 2.75Å; T65-C68 PolarHBondContact O-N 2.94Å; T65-L69 HydrophobicContact CG2-CD1 4.42Å; T65-L69 WeakPolarHBondContact O-CG 3.34Å; T65-L69 PolarHBondContact O-N 3.13Å
66	V	82.7	Confident	76.3	Confident	69 Å²	69	78.3 Å²	78.3	42%	0.418	44%	0.437	S	S	.	.	H	α-helix	trans	-61.6	-45.1	175.8	172.1	0	0	0	0	110.5	L62 I63 C64 C68 L69 F70	L62-V66 WeakPolarHBondContact O-CG2 3.5Å; L62-V66 PolarHBondContact O-N 3.07Å; I63-V66 PolarHBondContact O-N 3.45Å; C64-V66 PolarHBondContact O-N 3.02Å; V66-C68 PolarHBondContact O-N 2.73Å; V66-L69 PolarHBondContact O-N 2.62Å; V66-F70 HydrophobicContact CG1-CD2 3.68Å; V66-F70 HydrophobicContact CG1-CE2 3.53Å; V66-F70 VanDerWaalsContact O-CD2 3.22Å; V66-F70 WeakPolarHBondContact O-CD2 3.32Å; V66-F70 PolarHBondContact O-N 3.47Å; V66-F70 VanDerWaalsContact O-N 3.09Å
67	S	78.7	Confident	76.4	Confident	37 Å²	37	83.9 Å²	83.9	26%	0.259	46%	0.455	S	S	.	.	H	α-helix	trans	-58.1	-45.6	177.1	-175.8	0	0	0	0	112.4	I63 C64 L69 F70 A71	I63-S67 PolarHBondContact O-N 2.75Å; C64-S67 WeakPolarHBondContact O-CB 3.29Å; C64-S67 PolarHBondContact O-N 2.81Å; S67-L69 PolarHBondContact O-N 3.49Å; S67-F70 PolarHBondContact O-N 3.34Å; S67-A71 PolarHBondContact O-N 2.96Å
68	C	82	Confident	76.3	Confident	76 Å²	76	84.7 Å²	84.7	51%	0.514	46%	0.457	S	S	.	.	H	α-helix	trans	-63.8	-38.2	177.4	-67.4	0	0	0	0	112.9	C64 T65 V66 A71 M72	C64-C68 PolarHBondContact O-N 3.12Å; C64-C68 PolarHBondContact O-SG 2.88Å; T65-C68 PolarHBondContact O-N 2.94Å; V66-C68 PolarHBondContact O-N 2.73Å; C68-A71 PolarHBondContact O-N 2.78Å; C68-M72 WeakPolarHBondContact O-CG 3.35Å; C68-M72 PolarHBondContact O-N 2.69Å
69	L	83.6	Confident	75.9	Confident	94 Å²	94	90.5 Å²	90.5	49%	0.492	47%	0.474	S	S	.	.	H	α-helix	trans	-62.3	-45.2	175.6	-73.7	168	0	0	0	111.7	T65 V66 S67 A71 M72 L73	T65-L69 HydrophobicContact CG2-CD1 4.42Å; T65-L69 WeakPolarHBondContact O-CG 3.34Å; T65-L69 PolarHBondContact O-N 3.13Å; V66-L69 PolarHBondContact O-N 2.62Å; S67-L69 PolarHBondContact O-N 3.49Å; L69-A71 VanDerWaalsContact C-N 3.34Å; L69-A71 PolarHBondContact O-N 2.93Å; L69-M72 HydrophobicContact CD2-CE 3.87Å; L69-M72 PolarHBondContact O-N 2.85Å; L69-L73 WeakPolarHBondContact O-CG 2.89Å; L69-L73 PolarHBondContact O-N 3.04Å
70	F	76.8	Confident	75.7	Confident	126 Å²	126	95.9 Å²	95.9	55%	0.553	50%	0.499	S	S	*	.	H	α-helix	trans	-64.6	-37.5	176.5	-82	-72.8	0	0	0	112.6	V66 S67 L73 A74	V66-F70 HydrophobicContact CG1-CD2 3.68Å; V66-F70 HydrophobicContact CG1-CE2 3.53Å; V66-F70 VanDerWaalsContact O-CD2 3.22Å; V66-F70 WeakPolarHBondContact O-CD2 3.32Å; V66-F70 PolarHBondContact O-N 3.47Å; V66-F70 VanDerWaalsContact O-N 3.09Å; S67-F70 PolarHBondContact O-N 3.34Å; F70-L73 PolarHBondContact O-N 3Å; F70-A74 PolarHBondContact O-N 3.39Å
71	A	75.1	Confident	74.8	Confident	53 Å²	53	98.2 Å²	98.2	44%	0.438	51%	0.509	S	S	.	.	H	α-helix	trans	-62	-43.3	174.1	0	0	0	0	0	111.9	S67 C68 L69 A74 L75	S67-A71 PolarHBondContact O-N 2.96Å; C68-A71 PolarHBondContact O-N 2.78Å; L69-A71 VanDerWaalsContact C-N 3.34Å; L69-A71 PolarHBondContact O-N 2.93Å; A71-A74 PolarHBondContact O-N 3.22Å; A71-L75 WeakPolarHBondContact O-CG 3.3Å; A71-L75 PolarHBondContact O-N 2.77Å; A71-L75 VanDerWaalsContact O-N 3.1Å
72	M	80.9	Confident	73.9	Confident	107 Å²	107	98 Å²	98	53%	0.527	51%	0.514	S	S	.	.	H	α-helix	trans	-63	-41.6	175.5	-72.8	-172	-73	0	0	112.3	C68 L69 A74 L75 V76	C68-M72 WeakPolarHBondContact O-CG 3.35Å; C68-M72 PolarHBondContact O-N 2.69Å; L69-M72 HydrophobicContact CD2-CE 3.87Å; L69-M72 PolarHBondContact O-N 2.85Å; M72-A74 VanDerWaalsContact C-N 3.34Å; M72-A74 PolarHBondContact O-N 2.89Å; M72-L75 PolarHBondContact O-N 2.98Å; M72-V76 WeakPolarHBondContact O-CG2 3.23Å; M72-V76 PolarHBondContact O-N 2.9Å
73	L	75.4	Confident	72.1	Confident	111 Å²	111	98 Å²	98	58%	0.581	51%	0.51	S	S	*	.	H	α-helix	trans	-63.3	-39.4	176	-71	172.5	0	0	0	112.5	L69 F70 L75 V76 W77	L69-L73 WeakPolarHBondContact O-CG 2.89Å; L69-L73 PolarHBondContact O-N 3.04Å; F70-L73 PolarHBondContact O-N 3Å; L73-L75 VanDerWaalsContact C-N 3.34Å; L73-V76 PolarHBondContact O-N 2.74Å; L73-W77 WeakPolarHBondContact O-CB 3.36Å; L73-W77 PolarHBondContact O-N 3.15Å
74	A	70.6	Confident	70.8	Confident	34 Å²	34	100.3 Å²	100.3	28%	0.281	53%	0.528	S	S	.	.	H	α-helix	trans	-62.2	-42.1	175.5	0	0	0	0	0	111.7	F70 A71 M72 W77 D78	F70-A74 PolarHBondContact O-N 3.39Å; A71-A74 PolarHBondContact O-N 3.22Å; M72-A74 VanDerWaalsContact C-N 3.34Å; M72-A74 PolarHBondContact O-N 2.89Å; A74-W77 PolarHBondContact O-N 2.83Å; A74-D78 WeakPolarHBondContact O-CB 3.37Å; A74-D78 PolarHBondContact O-N 2.72Å
75	L	70.1	Confident	69.7	Low	121 Å²	121	105.9 Å²	105.9	63%	0.634	55%	0.548	S	S	*	.	H	α-helix	trans	-65.4	-39.5	176.2	-67.7	172.7	0	0	0	112.4	A71 M72 L73 W77 D78 Y79	A71-L75 WeakPolarHBondContact O-CG 3.3Å; A71-L75 PolarHBondContact O-N 2.77Å; A71-L75 VanDerWaalsContact O-N 3.1Å; M72-L75 PolarHBondContact O-N 2.98Å; L73-L75 VanDerWaalsContact C-N 3.34Å; L75-W77 VanDerWaalsContact C-N 3.34Å; L75-D78 PolarHBondContact O-N 2.74Å; L75-Y79 PolarHBondContact O-N 2.79Å
76	V	74.3	Confident	68.2	Low	95 Å²	95	104.1 Å²	104.1	58%	0.576	54%	0.539	S	S	*	.	H	α-helix	trans	-65.8	-39.3	176.1	171.6	0	0	0	0	111.1	M72 L73 Y79 L80	M72-V76 WeakPolarHBondContact O-CG2 3.23Å; M72-V76 PolarHBondContact O-N 2.9Å; L73-V76 PolarHBondContact O-N 2.74Å; V76-Y79 PolarHBondContact O-N 2.95Å; V76-L80 PolarHBondContact O-N 2.82Å; V76-L80 VanDerWaalsContact O-N 3.12Å
77	W	64.1	Low	67.1	Low	163 Å²	163	108.7 Å²	108.7	62%	0.617	55%	0.548	S	S	*	.	H	α-helix	trans	-68	-39	177.1	-163.2	-87.5	0	0	0	112.3	L73 A74 L75 Y79 L80 Y81	L73-W77 WeakPolarHBondContact O-CB 3.36Å; L73-W77 PolarHBondContact O-N 3.15Å; A74-W77 PolarHBondContact O-N 2.83Å; L75-W77 VanDerWaalsContact C-N 3.34Å; W77-Y79 VanDerWaalsContact C-N 3.3Å; W77-Y79 PolarHBondContact O-N 2.83Å; W77-L80 PolarHBondContact O-N 2.9Å; W77-Y81 PolarHBondContact O-N 2.86Å
78	D	65.9	Low	66.3	Low	89 Å²	89	111 Å²	111	48%	0.476	56%	0.562	S	S	.	*	H	α-helix	trans	-63	-36.4	173.9	-165.8	62.6	0	0	0	111.7	A74 L75	A74-D78 WeakPolarHBondContact O-CB 3.37Å; A74-D78 PolarHBondContact O-N 2.72Å; L75-D78 PolarHBondContact O-N 2.74Å
79	Y	64.8	Low	65.4	Low	201 Å²	201	112.6 Å²	112.6	79%	0.788	57%	0.569	S	S	*	*	H	α-helix	trans	-69.4	-36.8	175.5	-175.6	-103.2	0	0	0	113.4	L75 V76 W77	L75-Y79 PolarHBondContact O-N 2.79Å; V76-Y79 PolarHBondContact O-N 2.95Å; W77-Y79 VanDerWaalsContact C-N 3.3Å; W77-Y79 PolarHBondContact O-N 2.83Å
80	L	67.6	Low	64.5	Low	126 Å²	126	109.8 Å²	109.8	66%	0.66	56%	0.555	S	S	*	*	H	α-helix	trans	-79.5	-24.9	-176.3	-164.9	65.9	0	0	0	113.3	V76 W77 P82	V76-L80 PolarHBondContact O-N 2.82Å; V76-L80 VanDerWaalsContact O-N 3.12Å; W77-L80 PolarHBondContact O-N 2.9Å; L80-P82 VanDerWaalsContact C-CD 3.49Å; L80-P82 WeakPolarHBondContact O-CD 3.48Å
81	Y	59.1	Low	63.9	Low	155 Å²	155	106 Å²	106	61%	0.608	55%	0.546	S	S	*	.	S	Bend	trans	-123.5	74.6	-178.7	-105.5	-88.9	0	0	0	113	W77	W77-Y81 PolarHBondContact O-N 2.86Å
82	P	60.2	Low	63.4	Low	104 Å²	104	107.5 Å²	107.5	68%	0.675	55%	0.553	S	S	*	*			trans	-79.8	128.8	176.8	29.1	-31.4	0	0	0	113.2	L80	L80-P82 VanDerWaalsContact C-CD 3.49Å; L80-P82 WeakPolarHBondContact O-CD 3.48Å
83	F	40.5	Very low	62.6	Low	115 Å²	115	105.4 Å²	105.4	50%	0.504	55%	0.548	S	S	.	.	S	Bend	trans	43.3	119.2	156.2	-118.7	-92.9	0	0	0	120.6	R87	F83-R87 HydrophobicContact CE2-CG 3.55Å; F83-R87 VanDerWaalsContact CZ-CD 3.41Å; F83-R87 HydrophobicContact CZ-CG 3.67Å; F83-R87 VanDerWaalsContact CZ-NH1 3.33Å
84	P	50.6	Low	62.4	Low	100 Å²	100	103.3 Å²	103.3	65%	0.649	54%	0.54	S	S	*	.	S	Bend	cis	-134.3	-4.4	31.9	28.4	-5.1	0	0	0	118.7
85	E	55.5	Low	62.3	Low	179 Å²	179	107.2 Å²	107.2	84%	0.836	56%	0.555	S	S	*	*	S	Bend	trans	-85.5	-17.4	-174.7	-92.2	-154	132.1	0	0	115.2
86	S	53.9	Low	62.3	Low	32 Å²	32	104 Å²	104	22%	0.224	54%	0.542	C	S	.	.	S	Bend	trans	-86.5	-14.4	-167.4	50.7	0	0	0	0	115.4	V89 L90	S86-V89 PolarHBondContact O-N 2.91Å; S86-L90 WeakPolarHBondContact O-CB 3.5Å; S86-L90 PolarHBondContact O-N 3.06Å
87	R	60.5	Low	62	Low	165 Å²	165	106.4 Å²	106.4	62%	0.623	54%	0.542	S	S	*	.	H	α-helix	trans	-50.6	-52	-174.6	-82.8	-162.6	172.9	142	15.6	115.3	F83 A91	F83-R87 HydrophobicContact CE2-CG 3.55Å; F83-R87 VanDerWaalsContact CZ-CD 3.41Å; F83-R87 HydrophobicContact CZ-CG 3.67Å; F83-R87 VanDerWaalsContact CZ-NH1 3.33Å; R87-A91 VanDerWaalsContact O-CB 3.26Å; R87-A91 WeakPolarHBondContact O-CB 3.08Å; R87-A91 PolarHBondContact O-N 2.91Å
88	P	61.3	Low	62.4	Low	85 Å²	85	103.5 Å²	103.5	55%	0.552	54%	0.535	S	S	*	.	H	α-helix	trans	-73.6	-32.7	-176.2	27.4	-32.9	0	0	0	112.1	C92	P88-C92 VanDerWaalsContact O-CB 3.23Å; P88-C92 WeakPolarHBondContact O-CB 3.34Å; P88-C92 PolarHBondContact O-N 2.93Å; P88-C92 PolarHBondContact O-SG 3.46Å
89	V	62.2	Low	62.8	Low	109 Å²	109	107 Å²	107	66%	0.661	55%	0.546	S	S	*	.	H	α-helix	trans	-70.6	-41.3	179	178.6	0	0	0	0	110.8	S86 C93	S86-V89 PolarHBondContact O-N 2.91Å; V89-C93 WeakPolarHBondContact O-CB 3.3Å; V89-C93 PolarHBondContact O-N 3.22Å
90	L	64.3	Low	63.5	Low	35 Å²	35	102.2 Å²	102.2	18%	0.183	53%	0.533	C	S	.	.	H	α-helix	trans	-68.3	-43.6	175.6	-121.3	143.8	0	0	0	111.6	S86 C93 V94	S86-L90 WeakPolarHBondContact O-CB 3.5Å; S86-L90 PolarHBondContact O-N 3.06Å; L90-C93 PolarHBondContact O-N 3.28Å; L90-V94 HydrophobicContact CD2-CG2 4.34Å; L90-V94 WeakPolarHBondContact O-CG2 3.5Å; L90-V94 PolarHBondContact O-N 2.67Å
91	A	66.1	Low	63.6	Low	46 Å²	46	100.6 Å²	100.6	38%	0.38	52%	0.524	S	S	.	.	H	α-helix	trans	-63.2	-45.4	175.6	0	0	0	0	0	111.9	R87 C93 I95	R87-A91 VanDerWaalsContact O-CB 3.26Å; R87-A91 WeakPolarHBondContact O-CB 3.08Å; R87-A91 PolarHBondContact O-N 2.91Å; A91-C93 VanDerWaalsContact C-N 3.35Å; A91-I95 VanDerWaalsContact O-CB 3.24Å; A91-I95 WeakPolarHBondContact O-CB 3.41Å; A91-I95 WeakPolarHBondContact O-CD1 3.49Å; A91-I95 WeakPolarHBondContact O-CG1 3.44Å; A91-I95 PolarHBondContact O-N 3.27Å
92	C	64.4	Low	64.5	Low	85 Å²	85	96.4 Å²	96.4	57%	0.574	51%	0.51	S	S	*	.	H	α-helix	trans	-63.1	-41.4	173.9	-82.8	0	0	0	0	111.5	P88 S96	P88-C92 VanDerWaalsContact O-CB 3.23Å; P88-C92 WeakPolarHBondContact O-CB 3.34Å; P88-C92 PolarHBondContact O-N 2.93Å; P88-C92 PolarHBondContact O-SG 3.46Å; C92-S96 WeakPolarHBondContact O-CB 3.28Å; C92-S96 PolarHBondContact O-N 3.41Å; C92-S96 PolarHBondContact O-OG 2.93Å
93	C	63.8	Low	65.3	Low	64 Å²	64	92.9 Å²	92.9	43%	0.432	49%	0.493	S	S	.	.	H	α-helix	trans	-62.8	-51	179.1	-171.3	0	0	0	0	111.1	V89 L90 A91 S96 Y97	V89-C93 WeakPolarHBondContact O-CB 3.3Å; V89-C93 PolarHBondContact O-N 3.22Å; L90-C93 PolarHBondContact O-N 3.28Å; A91-C93 VanDerWaalsContact C-N 3.35Å; C93-S96 PolarHBondContact O-OG 3.26Å; C93-Y97 VanDerWaalsContact O-CB 3.25Å; C93-Y97 WeakPolarHBondContact O-CB 3.46Å; C93-Y97 PolarHBondContact O-N 3.4Å
94	V	69.9	Low	67.1	Low	66 Å²	66	91.4 Å²	91.4	40%	0.4	49%	0.489	S	S	.	.	H	α-helix	trans	-66.2	-45.9	-179.8	175.6	0	0	0	0	111.2	L90 H98	L90-V94 HydrophobicContact CD2-CG2 4.34Å; L90-V94 WeakPolarHBondContact O-CG2 3.5Å; L90-V94 PolarHBondContact O-N 2.67Å; V94-H98 WeakPolarHBondContact O-CA 3.32Å; V94-H98 WeakPolarHBondContact O-CB 3.35Å; V94-H98 PolarHBondContact O-N 3.34Å
95	I	70.1	Confident	68	Low	117 Å²	117	88.1 Å²	88.1	60%	0.6	47%	0.466	S	S	*	.	H	α-helix	trans	-66.5	-46.3	-178.8	-65.3	167.4	0	0	0	110.2	A91 F99	A91-I95 VanDerWaalsContact O-CB 3.24Å; A91-I95 WeakPolarHBondContact O-CB 3.41Å; A91-I95 WeakPolarHBondContact O-CD1 3.49Å; A91-I95 WeakPolarHBondContact O-CG1 3.44Å; A91-I95 PolarHBondContact O-N 3.27Å; I95-F99 WeakPolarHBondContact O-CB 3.48Å; I95-F99 PolarHBondContact O-N 3.21Å
96	S	68.3	Low	68.8	Low	52 Å²	52	83.9 Å²	83.9	36%	0.364	45%	0.453	S	S	.	.	H	α-helix	trans	-67.2	-50.1	179.5	61.7	0	0	0	0	111.4	C92 C93 I100	C92-S96 WeakPolarHBondContact O-CB 3.28Å; C92-S96 PolarHBondContact O-N 3.41Å; C92-S96 PolarHBondContact O-OG 2.93Å; C93-S96 PolarHBondContact O-OG 3.26Å; S96-I100 WeakPolarHBondContact O-CB 3.49Å; S96-I100 VanDerWaalsContact O-CD1 3.23Å; S96-I100 WeakPolarHBondContact O-CD1 3.33Å; S96-I100 WeakPolarHBondContact O-CG1 3.39Å; S96-I100 PolarHBondContact O-N 3.26Å
97	Y	68.9	Low	69.5	Low	146 Å²	146	87.5 Å²	87.5	57%	0.573	47%	0.469	S	S	*	.	H	α-helix	trans	-67.5	-43.6	-179.4	-94.7	-93.9	0	0	0	112.8	C93 M101	C93-Y97 VanDerWaalsContact O-CB 3.25Å; C93-Y97 WeakPolarHBondContact O-CB 3.46Å; C93-Y97 PolarHBondContact O-N 3.4Å; Y97-M101 WeakPolarHBondContact O-CB 3.37Å; Y97-M101 WeakPolarHBondContact O-CG 3.25Å; Y97-M101 PolarHBondContact O-N 2.87Å
98	H	73.1	Confident	69.8	Low	102 Å²	102	84.5 Å²	84.5	47%	0.472	46%	0.458	S	S	.	.	H	α-helix	trans	-68.2	-42.9	179.9	-171.5	-84.7	0	0	0	111	V94 M102	V94-H98 WeakPolarHBondContact O-CA 3.32Å; V94-H98 WeakPolarHBondContact O-CB 3.35Å; V94-H98 PolarHBondContact O-N 3.34Å; H98-M102 VanDerWaalsContact CE1-CG 3.45Å; H98-M102 WeakPolarHBondContact CE1-CG 3.28Å; H98-M102 WeakPolarHBondContact NE2-CE 3.36Å; H98-M102 WeakPolarHBondContact O-CB 3.42Å; H98-M102 WeakPolarHBondContact O-CG 3.19Å; H98-M102 PolarHBondContact O-N 2.97Å
99	F	73.9	Confident	69.9	Low	163 Å²	163	82.2 Å²	82.2	72%	0.715	44%	0.443	S	S	*	.	H	α-helix	trans	-72.5	-36	-179.5	-155	-95.1	0	0	0	112	I95 G103	I95-F99 WeakPolarHBondContact O-CB 3.48Å; I95-F99 PolarHBondContact O-N 3.21Å; F99-G103 WeakPolarHBondContact O-CA 3.41Å; F99-G103 PolarHBondContact O-N 2.89Å
100	I	78.9	Confident	69.8	Low	100 Å²	100	80.2 Å²	80.2	51%	0.513	43%	0.434	S	S	.	.	H	α-helix	trans	-68.2	-47.4	173.6	-67.4	165.6	0	0	0	110.3	S96 G103 I104	S96-I100 WeakPolarHBondContact O-CB 3.49Å; S96-I100 VanDerWaalsContact O-CD1 3.23Å; S96-I100 WeakPolarHBondContact O-CD1 3.33Å; S96-I100 WeakPolarHBondContact O-CG1 3.39Å; S96-I100 PolarHBondContact O-N 3.26Å; I100-G103 PolarHBondContact O-N 3.21Å; I100-I104 HydrophobicContact CG2-CD1 3.66Å; I100-I104 HydrophobicContact CG2-CG1 4.38Å; I100-I104 WeakPolarHBondContact O-CB 2.98Å; I100-I104 WeakPolarHBondContact O-CG1 3.21Å; I100-I104 PolarHBondContact O-N 3.29Å
101	M	69.8	Low	69.5	Low	93 Å²	93	87 Å²	87	46%	0.458	46%	0.458	S	S	.	.	H	α-helix	trans	-69.2	-40.3	179.5	-79.8	-70.5	140.5	0	0	112.9	Y97 G103 I104 L105	Y97-M101 WeakPolarHBondContact O-CB 3.37Å; Y97-M101 WeakPolarHBondContact O-CG 3.25Å; Y97-M101 PolarHBondContact O-N 2.87Å; M101-G103 VanDerWaalsContact C-N 3.31Å; M101-I104 HydrophobicContact CE-CD1 3.87Å; M101-I104 PolarHBondContact O-N 3.24Å; M101-L105 WeakPolarHBondContact O-CB 3.28Å; M101-L105 PolarHBondContact O-N 3.08Å
102	M	77.8	Confident	68.9	Low	67 Å²	67	91.5 Å²	91.5	33%	0.33	47%	0.469	S	S	.	.	H	α-helix	trans	-66.6	-35.3	172.9	-71.5	-63.7	178.2	0	0	111.5	H98 L105 T106	H98-M102 VanDerWaalsContact CE1-CG 3.45Å; H98-M102 WeakPolarHBondContact CE1-CG 3.28Å; H98-M102 WeakPolarHBondContact NE2-CE 3.36Å; H98-M102 WeakPolarHBondContact O-CB 3.42Å; H98-M102 WeakPolarHBondContact O-CG 3.19Å; H98-M102 PolarHBondContact O-N 2.97Å; M102-L105 PolarHBondContact O-N 2.54Å; M102-L105 HydrophobicContact SD-CD2 4.16Å; M102-T106 WeakPolarHBondContact O-CB 3.36Å; M102-T106 PolarHBondContact O-N 3.06Å; M102-T106 PolarHBondContact O-OG1 2.91Å
103	G	77.5	Confident	68.3	Low	30 Å²	30	89.9 Å²	89.9	31%	0.309	45%	0.453	S	S	.	.	H	α-helix	trans	-64.8	-44.7	172.5	0	0	0	0	0	112.2	F99 I100 M101 T106 L107	F99-G103 WeakPolarHBondContact O-CA 3.41Å; F99-G103 PolarHBondContact O-N 2.89Å; I100-G103 PolarHBondContact O-N 3.21Å; M101-G103 VanDerWaalsContact C-N 3.31Å; G103-T106 PolarHBondContact O-N 2.72Å; G103-L107 VanDerWaalsContact O-CB 3.32Å; G103-L107 WeakPolarHBondContact O-CB 2.91Å; G103-L107 PolarHBondContact O-N 2.91Å
104	I	77.4	Confident	67.7	Low	84 Å²	84	93.4 Å²	93.4	43%	0.431	46%	0.461	S	S	.	.	H	α-helix	trans	-65.1	-40.1	174.6	-69.8	164	0	0	0	110.6	I100 M101 L107 Y108	I100-I104 HydrophobicContact CG2-CD1 3.66Å; I100-I104 HydrophobicContact CG2-CG1 4.38Å; I100-I104 WeakPolarHBondContact O-CB 2.98Å; I100-I104 WeakPolarHBondContact O-CG1 3.21Å; I100-I104 PolarHBondContact O-N 3.29Å; M101-I104 HydrophobicContact CE-CD1 3.87Å; M101-I104 PolarHBondContact O-N 3.24Å; I104-L107 CarbonylContact O-C 3.42Å; I104-L107 PolarHBondContact O-N 2.97Å; I104-Y108 WeakPolarHBondContact O-CA 3.13Å; I104-Y108 WeakPolarHBondContact O-CB 3.46Å; I104-Y108 PolarHBondContact O-N 3.02Å
105	L	70.6	Confident	66.8	Low	31 Å²	31	92.8 Å²	92.8	16%	0.162	46%	0.455	C	S	.	.	H	α-helix	trans	-62.3	-49.4	174.4	172.5	64.6	0	0	0	110	I63 M101 M102 L107 Y108 T109	I63-L105 HydrophobicContact CB-CD1 4.05Å; I63-L105 HydrophobicContact CD1-CD1 3.79Å; I63-L105 HydrophobicContact CG2-CB 4.16Å; I63-L105 HydrophobicContact CG2-CD1 3.67Å; I63-L105 HydrophobicContact CG2-CD2 4.3Å; I63-L105 HydrophobicContact CG2-CG 4.24Å; M101-L105 WeakPolarHBondContact O-CB 3.28Å; M101-L105 PolarHBondContact O-N 3.08Å; M102-L105 PolarHBondContact O-N 2.54Å; M102-L105 HydrophobicContact SD-CD2 4.16Å; L105-L107 VanDerWaalsContact C-N 3.27Å; L105-L107 PolarHBondContact O-N 3.07Å; L105-Y108 PolarHBondContact O-N 2.98Å; L105-Y108 VanDerWaalsContact O-N 3.09Å; L105-T109 HydrophobicContact CD1-CG2 3.77Å; L105-T109 HydrophobicContact CG-CG2 4.29Å; L105-T109 VanDerWaalsContact O-CG2 3.26Å; L105-T109 WeakPolarHBondContact O-CG2 3.37Å; L105-T109 PolarHBondContact O-N 2.93Å; L105-T109 PolarHBondContact O-OG1 3.34Å; L105-T109 VanDerWaalsContact O-OG1 3.08Å
106	T	71.4	Confident	66.1	Low	90 Å²	90	89 Å²	89	55%	0.552	44%	0.436	S	S	*	.	H	α-helix	trans	-61.6	-38.2	178.9	-55.5	0	0	0	0	111.3	M102 G103 T109 S110	M102-T106 WeakPolarHBondContact O-CB 3.36Å; M102-T106 PolarHBondContact O-N 3.06Å; M102-T106 PolarHBondContact O-OG1 2.91Å; G103-T106 PolarHBondContact O-N 2.72Å; T106-T109 PolarHBondContact O-OG1 2.61Å; T106-S110 WeakPolarHBondContact O-CB 3.39Å; T106-S110 PolarHBondContact O-N 3.41Å
107	L	69.9	Low	65.4	Low	107 Å²	107	90.2 Å²	90.2	56%	0.56	44%	0.435	S	S	*	.	H	α-helix	trans	-68.2	-44.6	172.2	-86.7	160.4	0	0	0	111	G103 I104 L105 S110 Y111	G103-L107 VanDerWaalsContact O-CB 3.32Å; G103-L107 WeakPolarHBondContact O-CB 2.91Å; G103-L107 PolarHBondContact O-N 2.91Å; I104-L107 CarbonylContact O-C 3.42Å; I104-L107 PolarHBondContact O-N 2.97Å; L105-L107 VanDerWaalsContact C-N 3.27Å; L105-L107 PolarHBondContact O-N 3.07Å; L107-S110 CarbonylContact O-C 3.57Å; L107-S110 PolarHBondContact O-N 2.8Å; L107-Y111 WeakPolarHBondContact O-CA 3.37Å; L107-Y111 WeakPolarHBondContact O-CB 3.32Å; L107-Y111 PolarHBondContact O-N 3.39Å
108	Y	66.8	Low	64.6	Low	103 Å²	103	83.8 Å²	83.8	40%	0.404	41%	0.411	S	S	.	.	H	α-helix	trans	-62.8	-48.4	-178.6	-175	-94	0	0	0	110.8	I63 I104 L105 S110 Y111 K112	I63-Y108 HydrophobicContact CD1-CD1 3.87Å; I63-Y108 HydrophobicContact CD1-CE1 4.18Å; I63-Y108 HydrophobicContact CD1-CG 4.44Å; I104-Y108 WeakPolarHBondContact O-CA 3.13Å; I104-Y108 WeakPolarHBondContact O-CB 3.46Å; I104-Y108 PolarHBondContact O-N 3.02Å; L105-Y108 PolarHBondContact O-N 2.98Å; L105-Y108 VanDerWaalsContact O-N 3.09Å; Y108-S110 VanDerWaalsContact C-N 3.32Å; Y108-S110 PolarHBondContact O-N 2.85Å; Y108-Y111 PolarHBondContact O-N 2.9Å; Y108-K112 HydrophobicContact CD2-CG 4.13Å; Y108-K112 HydrophobicContact CE1-CB 4.46Å; Y108-K112 HydrophobicContact CE2-CG 3.8Å; Y108-K112 VanDerWaalsContact O-CB 3.28Å; Y108-K112 WeakPolarHBondContact O-CB 3.04Å; Y108-K112 PolarHBondContact O-N 2.82Å
109	T	62.8	Low	63.7	Low	36 Å²	36	79.8 Å²	79.8	22%	0.221	39%	0.393	C	S	.	.	H	α-helix	trans	-59.4	-45.8	173.1	60.8	0	0	0	0	109.8	R60 L105 T106 Y111 E113	R60-T109 HydrophobicContact CG-CG2 4.42Å; L105-T109 HydrophobicContact CD1-CG2 3.77Å; L105-T109 HydrophobicContact CG-CG2 4.29Å; L105-T109 VanDerWaalsContact O-CG2 3.26Å; L105-T109 WeakPolarHBondContact O-CG2 3.37Å; L105-T109 PolarHBondContact O-N 2.93Å; L105-T109 PolarHBondContact O-OG1 3.34Å; L105-T109 VanDerWaalsContact O-OG1 3.08Å; T106-T109 PolarHBondContact O-OG1 2.61Å; T109-Y111 PolarHBondContact O-N 3.49Å; T109-E113 WeakPolarHBondContact CA-OE2 3.39Å; T109-E113 WeakPolarHBondContact CB-OE2 3.39Å; T109-E113 WeakPolarHBondContact CG2-OE2 3.32Å; T109-E113 VanDerWaalsContact O-CA 3.31Å; T109-E113 WeakPolarHBondContact O-CA 3.4Å; T109-E113 WeakPolarHBondContact O-CB 3.38Å; T109-E113 PolarHBondContact O-N 3.05Å
110	S	60.5	Low	62.9	Low	68 Å²	68	72.1 Å²	72.1	48%	0.476	36%	0.36	S	S	.	.	H	α-helix	trans	-74.5	-21.2	-178.3	-159.5	0	0	0	0	115.3	T106 L107 Y108 K114	T106-S110 WeakPolarHBondContact O-CB 3.39Å; T106-S110 PolarHBondContact O-N 3.41Å; L107-S110 CarbonylContact O-C 3.57Å; L107-S110 PolarHBondContact O-N 2.8Å; Y108-S110 VanDerWaalsContact C-N 3.32Å; Y108-S110 PolarHBondContact O-N 2.85Å; S110-K114 VanDerWaalsContact O-CD 3.27Å; S110-K114 WeakPolarHBondContact O-CD 3.49Å; S110-K114 WeakPolarHBondContact O-CE 3.29Å; S110-K114 WeakPolarHBondContact O-CG 3.46Å
111	Y	58.3	Low	61.5	Low	178 Å²	178	70.2 Å²	70.2	70%	0.698	35%	0.35	S	S	*	.	H	α-helix	trans	-101.5	-33.6	-178.2	-129.6	-94.3	0	0	0	112.6	L107 Y108 T109	L107-Y111 WeakPolarHBondContact O-CA 3.37Å; L107-Y111 WeakPolarHBondContact O-CB 3.32Å; L107-Y111 PolarHBondContact O-N 3.39Å; Y108-Y111 PolarHBondContact O-N 2.9Å; T109-Y111 PolarHBondContact O-N 3.49Å
112	K	52.2	Low	60.5	Low	139 Å²	139	68.2 Å²	68.2	60%	0.604	34%	0.339	S	S	*	.	H	α-helix	trans	-96.3	-38	177.8	-76.8	-78.9	-158	172.2	0	113.2	Y108 K114	Y108-K112 HydrophobicContact CD2-CG 4.13Å; Y108-K112 HydrophobicContact CE1-CB 4.46Å; Y108-K112 HydrophobicContact CE2-CG 3.8Å; Y108-K112 VanDerWaalsContact O-CB 3.28Å; Y108-K112 WeakPolarHBondContact O-CB 3.04Å; Y108-K112 PolarHBondContact O-N 2.82Å; K112-K114 PolarHBondContact O-N 2.93Å
113	E	52.1	Low	58.9	Low	51 Å²	51	72.4 Å²	72.4	24%	0.238	36%	0.355	C	S	.	.	S	Bend	trans	-86.6	20.5	173.5	-60.1	167.3	87.2	0	0	112	L56 R60 T109 N115	L56-E113 HydrophobicContact CD2-CG 4Å; R60-E113 IonicContact CZ-OE1 2.62Å; R60-E113 VanDerWaalsContact CZ-OE1 3.28Å; R60-E113 IonicContact NE-OE1 2.87Å; R60-E113 IonicContact NH1-OE1 3.49Å; R60-E113 PolarHBondContact NH1-OE1 2.8Å; T109-E113 WeakPolarHBondContact CA-OE2 3.39Å; T109-E113 WeakPolarHBondContact CB-OE2 3.39Å; T109-E113 WeakPolarHBondContact CG2-OE2 3.32Å; T109-E113 VanDerWaalsContact O-CA 3.31Å; T109-E113 WeakPolarHBondContact O-CA 3.4Å; T109-E113 WeakPolarHBondContact O-CB 3.38Å; T109-E113 PolarHBondContact O-N 3.05Å; E113-N115 PolarHBondContact O-N 2.66Å
114	K	51.5	Low	57.2	Low	139 Å²	139	73.5 Å²	73.5	60%	0.604	35%	0.354	S	S	*	.	S	Bend	trans	-65.6	86.5	177.1	-128.9	172.9	-159.4	-174.9	0	108.8	S110 K112 I116	S110-K114 VanDerWaalsContact O-CD 3.27Å; S110-K114 WeakPolarHBondContact O-CD 3.49Å; S110-K114 WeakPolarHBondContact O-CE 3.29Å; S110-K114 WeakPolarHBondContact O-CG 3.46Å; K112-K114 PolarHBondContact O-N 2.93Å; K114-I116 PolarHBondContact O-N 3.44Å
115	N	51.6	Low	55.5	Low	52 Å²	52	76 Å²	76	28%	0.278	38%	0.375	S	S	.	.	S	Bend	trans	81	-20	175.1	-143.7	-91.5	0	0	0	117	E113 F117 S137 S138 S139	E113-N115 PolarHBondContact O-N 2.66Å; N115-F117 PolarHBondContact O-N 2.84Å; N115-S137 WeakPolarHBondContact CB-OG 3.46Å; N115-S137 CarbonylContact O-C 3.56Å; N115-S137 VanDerWaalsContact O-C 3.27Å; N115-S137 WeakPolarHBondContact O-CA 3.4Å; N115-S137 WeakPolarHBondContact O-CB 3.49Å; N115-S137 PolarHBondContact O-OG 3.02Å; N115-S137 PolarHBondContact OD1-O 3.4Å; N115-S137 PolarHBondContact OD1-OG 3.35Å; N115-S138 VanDerWaalsContact CG-O 3.24Å; N115-S138 PolarHBondContact ND2-O 2.59Å; N115-S138 PolarHBondContact O-N 3.27Å; N115-S138 WeakPolarHBondContact OD1-CA 3.45Å; N115-S138 PolarHBondContact OD1-N 2.77Å; N115-S138 PolarHBondContact OD1-O 2.64Å; N115-S139 WeakPolarHBondContact ND2-CB 3.47Å; N115-S139 PolarHBondContact ND2-OG 2.82Å
116	I	55.2	Low	54.1	Low	39 Å²	39	78.2 Å²	78.2	20%	0.2	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	99	-178.8	-56.3	162.5	0	0	0	111.1	L56 K114 V119 Q135 L136	L56-I116 WeakPolarHBondContact CD2-O 3.33Å; K114-I116 PolarHBondContact O-N 3.44Å; I116-V119 HydrophobicContact CG2-CG2 3.67Å; I116-Q135 HydrophobicContact CG2-CB 3.98Å; I116-L136 CarbonylContact C-O 3.49Å; I116-L136 VanDerWaalsContact CA-O 3.3Å; I116-L136 WeakPolarHBondContact CA-O 3Å; I116-L136 WeakPolarHBondContact CG2-O 3.12Å
117	F	53.8	Low	52.9	Low	77 Å²	77	77.6 Å²	77.6	34%	0.338	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-30.4	-179.2	177.6	-96.9	0	0	0	112.6	D37 N115 L136	D37-F117 HydrophobicContact CB-CD1 3.72Å; D37-F117 HydrophobicContact CB-CD2 3.96Å; D37-F117 HydrophobicContact CB-CE1 3.46Å; D37-F117 VanDerWaalsContact CB-CE1 3.46Å; D37-F117 HydrophobicContact CB-CE2 3.68Å; D37-F117 HydrophobicContact CB-CG 4Å; D37-F117 HydrophobicContact CB-CZ 3.45Å; D37-F117 VanDerWaalsContact CB-CZ 3.45Å; D37-F117 WeakPolarHBondContact O-CE1 3.46Å; D37-F117 WeakPolarHBondContact OD2-CD2 3.32Å; N115-F117 PolarHBondContact O-N 2.84Å; F117-L136 PolarHBondContact N-O 3.46Å
118	L	50.9	Low	51.8	Low	11 Å²	11	80.2 Å²	80.2	6%	0.058	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	136.5	-178.8	-173.5	69.7	0	0	0	110.3	K41 E52 A120 Q135 L136	K41-L118 HydrophobicContact CB-CD2 4.09Å; K41-L118 HydrophobicContact CD-CD1 4.24Å; K41-L118 HydrophobicContact CG-CD1 4.34Å; K41-L118 HydrophobicContact CG-CD2 4.2Å; E52-L118 HydrophobicContact CG-CD1 4.25Å; E52-L118 WeakPolarHBondContact OE1-CD1 3.33Å; L118-A120 HydrophobicContact CD2-CB 4.3Å; L118-Q135 CarbonylContact O-C 3.52Å; L118-Q135 VanDerWaalsContact O-CA 3.28Å; L118-Q135 WeakPolarHBondContact O-CA 3.31Å; L118-L136 HydrophobicContact CB-CB 4Å; L118-L136 HydrophobicContact CB-CD1 3.86Å; L118-L136 HydrophobicContact CB-CG 4.04Å; L118-L136 HydrophobicContact CD2-CD1 3.53Å; L118-L136 HydrophobicContact CD2-CG 4.19Å; L118-L136 HydrophobicContact CG-CD1 4.28Å; L118-L136 PolarHBondContact N-O 3.05Å; L118-L136 VanDerWaalsContact N-O 3.15Å; L118-L136 PolarHBondContact O-N 3.5Å
119	V	54.8	Low	50.8	Low	17 Å²	17	78.9 Å²	78.9	10%	0.103	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	111.7	163.1	177.8	0	0	0	0	106.3	N53 L56 I116 V133 W134 Q135	N53-V119 WeakPolarHBondContact CA-O 3.15Å; N53-V119 HydrophobicContact CB-CB 4.17Å; N53-V119 HydrophobicContact CB-CG1 3.99Å; N53-V119 VanDerWaalsContact CB-O 3.26Å; N53-V119 WeakPolarHBondContact CB-O 3.36Å; N53-V119 PolarHBondContact N-O 3.41Å; L56-V119 HydrophobicContact CD1-CB 4.42Å; L56-V119 HydrophobicContact CD1-CG2 3.78Å; I116-V119 HydrophobicContact CG2-CG2 3.67Å; V119-V133 HydrophobicContact CG1-CG1 3.66Å; V119-W134 CarbonylContact C-O 3.51Å; V119-W134 WeakPolarHBondContact CA-O 3.21Å; V119-Q135 HydrophobicContact CG1-CG 4.25Å; V119-Q135 HydrophobicContact CG2-CB 4.2Å; V119-Q135 HydrophobicContact CG2-CG 4.08Å
120	A	56.6	Low	50.2	Low	2 Å²	2	79.9 Å²	79.9	2%	0.017	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.2	176.9	0	0	0	0	0	108.6	L118 W134	L118-A120 HydrophobicContact CD2-CB 4.3Å; A120-W134 HydrophobicContact CB-CB 4.42Å; A120-W134 PolarHBondContact N-O 2.96Å; A120-W134 WeakPolarHBondContact O-CA 3.35Å; A120-W134 WeakPolarHBondContact O-CB 3.35Å; A120-W134 PolarHBondContact O-N 2.71Å
121	M	51.2	Low	49.9	Very low	61 Å²	61	80.2 Å²	80.2	30%	0.3	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.5	172.9	-75.8	-174.5	164.9	0	0	109	V51 N53 K123 V133	V51-M121 PolarHBondContact N-O 3.24Å; V51-M121 PolarHBondContact O-N 3.49Å; N53-M121 HydrophobicContact CB-CG 4.4Å; N53-M121 VanDerWaalsContact ND2-CE 3.33Å; N53-M121 WeakPolarHBondContact ND2-CE 3.33Å; M121-K123 PolarHBondContact O-N 2.91Å; M121-V133 HydrophobicContact CE-CG2 4.02Å; M121-V133 HydrophobicContact CG-CG2 4.38Å
122	Q	48.2	Very low	50.2	Low	50 Å²	50	72.6 Å²	72.6	23%	0.234	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	101.6	167.6	176.2	167.2	15.9	0	0	107.6	Y50 D124 H132	Y50-Q122 HydrophobicContact CD1-CB 3.56Å; Y50-Q122 HydrophobicContact CD1-CG 3.79Å; Y50-Q122 HydrophobicContact CE1-CB 3.44Å; Y50-Q122 VanDerWaalsContact CE1-CB 3.44Å; Y50-Q122 HydrophobicContact CE1-CG 3.32Å; Y50-Q122 PolarHBondContact OH-OE1 3.4Å; Q122-D124 PolarHBondContact O-N 3.45Å; Q122-H132 HydrophobicContact CB-CB 4.22Å; Q122-H132 PolarHBondContact N-O 2.71Å
123	K	44	Very low	50.8	Low	156 Å²	156	67.3 Å²	67.3	68%	0.678	38%	0.375	S	S	*	.			trans	-82	112.5	173.9	-140.8	169.5	-171.4	166.9	0	108	M121	M121-K123 PolarHBondContact O-N 2.91Å
124	D	41	Very low	51.6	Low	53 Å²	53	65.2 Å²	65.2	28%	0.283	37%	0.365	S	S	.	.			trans	-64.9	128.7	179.8	-96.6	-68.3	0	0	0	110.5	Q122 A126 G127 H132	Q122-D124 PolarHBondContact O-N 3.45Å; D124-A126 PolarHBondContact O-N 3.4Å; D124-G127 PolarHBondContact O-N 2.95Å; D124-H132 IonicContact OD2-CD2 3.58Å
125	P	42.3	Very low	52.4	Low	135 Å²	135	60.9 Å²	60.9	88%	0.877	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-4.5	-177.4	25.7	-33.3	0	0	0	114
126	A	40.4	Very low	53.3	Low	78 Å²	78	58.6 Å²	58.6	65%	0.645	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-7	-178.9	0	0	0	0	0	114.3	D124 M128	D124-A126 PolarHBondContact O-N 3.4Å; A126-M128 PolarHBondContact O-N 3.02Å
127	G	47.5	Very low	54.2	Low	77 Å²	77	56.9 Å²	56.9	79%	0.794	33%	0.326	S	S	*	.	S	Bend	trans	57.9	18.3	174.7	0	0	0	0	0	116.4	D124	D124-G127 PolarHBondContact O-N 2.95Å
128	M	46.2	Very low	55.2	Low	163 Å²	163	53.3 Å²	53.3	80%	0.803	31%	0.31	S	S	*	.			trans	-110.7	-10.6	-170.2	-142	-158.1	-62.8	0	0	114.4	A126	A126-M128 PolarHBondContact O-N 3.02Å
129	D	44.9	Very low	56.2	Low	74 Å²	74	55.1 Å²	55.1	40%	0.396	32%	0.324	S	S	.	.	S	Bend	trans	-133.7	149.1	-176.9	-85	-51.1	0	0	0	112.1	K157	D129-K157 WeakPolarHBondContact OD1-CD 3.17Å; D129-K157 WeakPolarHBondContact OD1-CE 3.32Å; D129-K157 IonicContact OD1-NZ 2.63Å; D129-K157 PolarHBondContact OD1-NZ 3.04Å; D129-K157 IonicContact OD2-NZ 3.43Å; D129-K157 PolarHBondContact OD2-NZ 3.01Å
130	P	50.6	Low	57.1	Low	57 Å²	57	55.7 Å²	55.7	37%	0.37	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-63.4	134.7	-174.8	24.4	-34.2	0	0	0	112.4	H132 G156 K157	P130-H132 PolarHBondContact O-N 2.93Å; P130-G156 WeakPolarHBondContact CB-O 3.41Å; P130-G156 VanDerWaalsContact CG-O 3.24Å; P130-G156 WeakPolarHBondContact CG-O 3.34Å; P130-K157 HydrophobicContact CG-CB 3.79Å; P130-K157 HydrophobicContact CG-CG 4.01Å
131	D	55.3	Low	57.8	Low	76 Å²	76	62.9 Å²	62.9	41%	0.406	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-52	128	-172	-62.2	-64.1	0	0	0	112.8
132	H	63.3	Low	58.3	Low	17 Å²	17	70.1 Å²	70.1	8%	0.079	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	126.1	172.6	-68.5	-56.3	0	0	0	109.8	Q122 D124 P130 F153 D155 G156 K200	Q122-H132 HydrophobicContact CB-CB 4.22Å; Q122-H132 PolarHBondContact N-O 2.71Å; D124-H132 IonicContact OD2-CD2 3.58Å; P130-H132 PolarHBondContact O-N 2.93Å; H132-F153 HydrophobicContact CB-CE2 3.84Å; H132-F153 HydrophobicContact CB-CZ 4.22Å; H132-F153 AromaticContact CG-CZ 3.96Å; H132-F153 AromaticContact ND1-CZ 3.7Å; H132-D155 VanDerWaalsContact CE1-CG 3.5Å; H132-D155 IonicContact CE1-OD1 2.82Å; H132-D155 IonicContact CE1-OD2 3.6Å; H132-D155 PolarHBondContact CE1-OD2 3.38Å; H132-D155 IonicContact ND1-OD2 3.52Å; H132-G156 PolarHBondContact ND1-N 3.48Å; H132-K200 PolarHBondContact CE1-NZ 3.24Å; H132-K200 PolarHBondContact NE2-NZ 3.47Å; H132-K200 VanDerWaalsContact NE2-NZ 3.12Å
133	V	65.4	Low	59	Low	28 Å²	28	77.2 Å²	77.2	17%	0.17	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	117.8	-178.3	-175.6	0	0	0	0	109.2	V119 M121 Q135 T154	V119-V133 HydrophobicContact CG1-CG1 3.66Å; M121-V133 HydrophobicContact CE-CG2 4.02Å; M121-V133 HydrophobicContact CG-CG2 4.38Å; V133-Q135 HydrophobicContact CG1-CG 3.98Å; V133-T154 PolarHBondContact N-O 2.93Å; V133-T154 PolarHBondContact O-N 3.12Å
134	W	68.4	Low	60.3	Low	7 Å²	7	72.5 Å²	72.5	3%	0.027	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	133.5	169.3	-66.2	82	0	0	0	108.9	Y50 V119 A120 V151 F152 F153 H193 L196	Y50-W134 AromaticContact CZ-NE1 3.98Å; V119-W134 CarbonylContact C-O 3.51Å; V119-W134 WeakPolarHBondContact CA-O 3.21Å; A120-W134 HydrophobicContact CB-CB 4.42Å; A120-W134 PolarHBondContact N-O 2.96Å; A120-W134 WeakPolarHBondContact O-CA 3.35Å; A120-W134 WeakPolarHBondContact O-CB 3.35Å; A120-W134 PolarHBondContact O-N 2.71Å; W134-V151 HydrophobicContact CE3-CG1 3.59Å; W134-V151 HydrophobicContact CZ3-CG1 3.87Å; W134-F152 CarbonylContact C-O 3.48Å; W134-F152 WeakPolarHBondContact CA-O 3.26Å; W134-F153 AromaticContact CD2-CD2 3.66Å; W134-F153 HydrophobicContact CD2-CD2 3.66Å; W134-F153 HydrophobicContact CD2-CE2 4.39Å; W134-F153 AromaticContact CE2-CD2 3.27Å; W134-F153 AromaticContact CE2-CE2 3.6Å; W134-F153 HydrophobicContact CE3-CB 4.26Å; W134-F153 HydrophobicContact CE3-CD2 4.09Å; W134-F153 HydrophobicContact CG-CD2 4.22Å; W134-F153 HydrophobicContact CH2-CB 4.48Å; W134-F153 AromaticContact CH2-CD2 3.87Å; W134-F153 HydrophobicContact CH2-CD2 3.87Å; W134-F153 HydrophobicContact CH2-CE2 4.45Å; W134-F153 HydrophobicContact CH2-CG 4.37Å; W134-F153 AromaticContact CZ2-CD2 3.39Å; W134-F153 HydrophobicContact CZ2-CD2 3.39Å; W134-F153 AromaticContact CZ2-CE2 3.64Å; W134-F153 HydrophobicContact CZ2-CE2 3.64Å; W134-F153 HydrophobicContact CZ2-CG 4.3Å; W134-F153 HydrophobicContact CZ3-CB 4.22Å; W134-F153 HydrophobicContact CZ3-CD2 4.19Å; W134-F153 AromaticContact NE1-CD2 3.64Å; W134-F153 AromaticContact NE1-CE2 3.61Å; W134-H193 AromaticContact CE2-NE2 3.95Å; W134-H193 AromaticContact CH2-CD2 3.34Å; W134-H193 WeakPolarHBondContact CH2-CD2 2.94Å; W134-H193 AromaticContact CH2-CG 3.99Å; W134-H193 AromaticContact CH2-NE2 3.45Å; W134-H193 WeakPolarHBondContact CH2-NE2 3.14Å; W134-H193 AromaticContact CZ2-CD2 3.74Å; W134-H193 AromaticContact CZ2-NE2 3.37Å; W134-H193 WeakPolarHBondContact CZ2-NE2 3.23Å; W134-H193 AromaticContact CZ3-CD2 3.54Å; W134-L196 HydrophobicContact CH2-CB 4.01Å; W134-L196 HydrophobicContact CZ3-CB 4.05Å; W134-L196 HydrophobicContact CZ3-CD1 3.83Å
135	Q	69.3	Low	61.9	Low	49 Å²	49	74.4 Å²	74.4	23%	0.229	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	118.7	175	-38.4	178.6	14.2	0	0	108.3	I116 L118 V119 V133 V151 F152	I116-Q135 HydrophobicContact CG2-CB 3.98Å; L118-Q135 CarbonylContact O-C 3.52Å; L118-Q135 VanDerWaalsContact O-CA 3.28Å; L118-Q135 WeakPolarHBondContact O-CA 3.31Å; V119-Q135 HydrophobicContact CG1-CG 4.25Å; V119-Q135 HydrophobicContact CG2-CB 4.2Å; V119-Q135 HydrophobicContact CG2-CG 4.08Å; V133-Q135 HydrophobicContact CG1-CG 3.98Å; Q135-V151 CarbonylContact O-C 3.38Å; Q135-V151 WeakPolarHBondContact O-CA 3.16Å; Q135-F152 HydrophobicContact CB-CB 4.04Å; Q135-F152 HydrophobicContact CB-CD2 4.48Å; Q135-F152 HydrophobicContact CG-CB 4.44Å; Q135-F152 PolarHBondContact N-O 2.9Å; Q135-F152 PolarHBondContact O-N 3.36Å
136	L	70.1	Confident	63.8	Low	3 Å²	3	72.9 Å²	72.9	2%	0.016	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	142.8	171.2	-48.4	177.9	0	0	0	109.5	A40 L44 I116 F117 L118 R150 V151	A40-L136 HydrophobicContact CB-CD1 4.3Å; L44-L136 HydrophobicContact CD1-CD1 3.2Å; L44-L136 HydrophobicContact CD1-CD2 3.41Å; L44-L136 VanDerWaalsContact CD1-CD2 3.41Å; L44-L136 HydrophobicContact CD1-CG 3.73Å; I116-L136 CarbonylContact C-O 3.49Å; I116-L136 VanDerWaalsContact CA-O 3.3Å; I116-L136 WeakPolarHBondContact CA-O 3Å; I116-L136 WeakPolarHBondContact CG2-O 3.12Å; F117-L136 PolarHBondContact N-O 3.46Å; L118-L136 HydrophobicContact CB-CB 4Å; L118-L136 HydrophobicContact CB-CD1 3.86Å; L118-L136 HydrophobicContact CB-CG 4.04Å; L118-L136 HydrophobicContact CD2-CD1 3.53Å; L118-L136 HydrophobicContact CD2-CG 4.19Å; L118-L136 HydrophobicContact CG-CD1 4.28Å; L118-L136 PolarHBondContact N-O 3.05Å; L118-L136 VanDerWaalsContact N-O 3.15Å; L118-L136 PolarHBondContact O-N 3.5Å; L136-R150 CarbonylContact C-O 3.56Å; L136-R150 WeakPolarHBondContact CA-O 3.11Å; L136-V151 HydrophobicContact CD2-CB 4.17Å; L136-V151 HydrophobicContact CD2-CG1 3.89Å; L136-V151 HydrophobicContact CD2-CG2 3.42Å; L136-V151 VanDerWaalsContact CD2-CG2 3.42Å
137	S	73.6	Confident	65.7	Low	4 Å²	4	69.1 Å²	69.1	3%	0.028	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	118.1	-176.9	175.8	0	0	0	0	109.7	N115 R150	N115-S137 WeakPolarHBondContact CB-OG 3.46Å; N115-S137 CarbonylContact O-C 3.56Å; N115-S137 VanDerWaalsContact O-C 3.27Å; N115-S137 WeakPolarHBondContact O-CA 3.4Å; N115-S137 WeakPolarHBondContact O-CB 3.49Å; N115-S137 PolarHBondContact O-OG 3.02Å; N115-S137 PolarHBondContact OD1-O 3.4Å; N115-S137 PolarHBondContact OD1-OG 3.35Å; S137-R150 PolarHBondContact N-O 3.49Å; S137-R150 WeakPolarHBondContact O-CA 3.28Å; S137-R150 PolarHBondContact O-N 2.71Å
138	S	76.2	Confident	67.3	Low	1 Å²	1	66.3 Å²	66.3	1%	0.007	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	139.6	-176.1	73.1	0	0	0	0	113.1	K33 D37 N115 S148	K33-S138 WeakPolarHBondContact CE-O 3.13Å; K33-S138 WeakPolarHBondContact CE-OG 3.28Å; K33-S138 PolarHBondContact NZ-O 2.74Å; D37-S138 WeakPolarHBondContact OD1-CB 3.13Å; D37-S138 PolarHBondContact OD1-OG 2.97Å; D37-S138 PolarHBondContact OD2-OG 3.46Å; D37-S138 VanDerWaalsContact OD2-OG 3.08Å; N115-S138 VanDerWaalsContact CG-O 3.24Å; N115-S138 PolarHBondContact ND2-O 2.59Å; N115-S138 PolarHBondContact O-N 3.27Å; N115-S138 WeakPolarHBondContact OD1-CA 3.45Å; N115-S138 PolarHBondContact OD1-N 2.77Å; N115-S138 PolarHBondContact OD1-O 2.64Å; S138-S148 CarbonylContact C-O 3.48Å; S138-S148 WeakPolarHBondContact CA-O 3.36Å
139	S	71.3	Confident	68.9	Low	49 Å²	49	58.7 Å²	58.7	34%	0.343	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	126.9	177	-152.4	0	0	0	0	110.5	N115 S148	N115-S139 WeakPolarHBondContact ND2-CB 3.47Å; N115-S139 PolarHBondContact ND2-OG 2.82Å; S139-S148 PolarHBondContact N-O 2.93Å; S139-S148 PolarHBondContact O-N 3.38Å
140	L	72.4	Confident	70.6	Confident	29 Å²	29	59.4 Å²	59.4	15%	0.152	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	117.7	165.4	-173.8	69.8	0	0	0	106.1	G29 V32 K33 Q146 Y147 V170	G29-L140 WeakPolarHBondContact O-CD2 3.48Å; V32-L140 HydrophobicContact CG1-CD2 4.23Å; K33-L140 HydrophobicContact CB-CB 4.2Å; K33-L140 HydrophobicContact CB-CD2 3.91Å; K33-L140 HydrophobicContact CD-CB 4.01Å; K33-L140 HydrophobicContact CG-CB 4.05Å; L140-Q146 WeakPolarHBondContact CD1-O 3.31Å; L140-Y147 HydrophobicContact CB-CD2 4.41Å; L140-V170 HydrophobicContact CD1-CG2 3.73Å; L140-V170 HydrophobicContact CD2-CG2 4.42Å
141	K	71.9	Confident	71.9	Confident	153 Å²	153	57 Å²	57	67%	0.665	27%	0.266	S	S	*	.			trans	-78.7	143.4	-178.7	-174.2	176.3	-176.2	-178.4	0	109.1	F143 D144	K141-F143 PolarHBondContact O-N 3.02Å; K141-D144 HydrophobicContact CB-CB 3.66Å; K141-D144 HydrophobicContact CG-CB 4.34Å; K141-D144 WeakPolarHBondContact O-CB 3.15Å; K141-D144 PolarHBondContact O-N 3.18Å
142	R	61.4	Low	72.7	Confident	214 Å²	214	56 Å²	56	81%	0.808	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	126.4	179.6	-157.2	175.5	-177.9	169.9	0.5	108.5	D144	R142-D144 VanDerWaalsContact C-N 3.25Å; R142-D144 PolarHBondContact O-N 2.81Å
143	F	62.6	Low	73.3	Confident	198 Å²	198	55.7 Å²	55.7	87%	0.868	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	10.6	-175.1	-41.4	-73.1	0	0	0	116	K141	K141-F143 PolarHBondContact O-N 3.02Å
144	D	72.4	Confident	73.5	Confident	58 Å²	58	55.8 Å²	55.8	31%	0.31	26%	0.257	S	S	.	.			trans	-104.4	140.5	173.1	-157	-31.4	0	0	0	108.8	K141 R142 Q146	K141-D144 HydrophobicContact CB-CB 3.66Å; K141-D144 HydrophobicContact CG-CB 4.34Å; K141-D144 WeakPolarHBondContact O-CB 3.15Å; K141-D144 PolarHBondContact O-N 3.18Å; R142-D144 VanDerWaalsContact C-N 3.25Å; R142-D144 PolarHBondContact O-N 2.81Å; D144-Q146 VanDerWaalsContact C-N 3.33Å; D144-Q146 WeakPolarHBondContact OD1-CB 3.22Å; D144-Q146 WeakPolarHBondContact OD1-CG 3.3Å; D144-Q146 PolarHBondContact OD1-N 3.43Å
145	D	74.7	Confident	73.5	Confident	92 Å²	92	56.1 Å²	56.1	49%	0.492	26%	0.26	S	S	.	.			trans	-88.8	-4.2	175.9	70.6	-58.7	0	0	0	112	Y147 S169 V170	D145-Y147 PolarHBondContact O-N 3.03Å; D145-S169 CarbonylContact O-C 3.47Å; D145-S169 VanDerWaalsContact O-CA 3.28Å; D145-S169 WeakPolarHBondContact O-CA 3.33Å; D145-S169 WeakPolarHBondContact OD2-CB 3.34Å; D145-S169 PolarHBondContact OD2-OG 3.35Å; D145-V170 WeakPolarHBondContact O-CG2 3.43Å; D145-V170 PolarHBondContact O-N 2.8Å
146	Q	81	Confident	73.2	Confident	103 Å²	103	55.4 Å²	55.4	48%	0.481	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	109.1	-179.7	-63	-168.6	7.1	0	0	113.1	L140 D144 T167	L140-Q146 WeakPolarHBondContact CD1-O 3.31Å; D144-Q146 VanDerWaalsContact C-N 3.33Å; D144-Q146 WeakPolarHBondContact OD1-CB 3.22Å; D144-Q146 WeakPolarHBondContact OD1-CG 3.3Å; D144-Q146 PolarHBondContact OD1-N 3.43Å; Q146-T167 HydrophobicContact CB-CG2 4.02Å
147	Y	80.8	Confident	72.6	Confident	0 Å²	0	62 Å²	62	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	124.1	168.5	-179.6	-106.7	0	0	0	110.4	L36 D37 L140 D145 L149 F166 T167 K168 F173 F185	L36-Y147 HydrophobicContact CB-CD2 4.5Å; L36-Y147 HydrophobicContact CB-CE1 4.32Å; L36-Y147 HydrophobicContact CB-CE2 3.93Å; L36-Y147 HydrophobicContact CD1-CD1 4.14Å; L36-Y147 HydrophobicContact CD1-CD2 3.67Å; L36-Y147 HydrophobicContact CD1-CE1 4.4Å; L36-Y147 HydrophobicContact CD1-CE2 3.97Å; L36-Y147 HydrophobicContact CD1-CG 3.76Å; D37-Y147 PolarHBondContact OD1-OH 3.45Å; L140-Y147 HydrophobicContact CB-CD2 4.41Å; D145-Y147 PolarHBondContact O-N 3.03Å; Y147-L149 HydrophobicContact CE1-CB 3.74Å; Y147-F166 HydrophobicContact CD1-CE2 4.14Å; Y147-F166 HydrophobicContact CD1-CZ 4.49Å; Y147-F166 HydrophobicContact CE1-CE2 4.34Å; Y147-F166 HydrophobicContact CE1-CZ 4.25Å; Y147-T167 WeakPolarHBondContact O-CA 3.49Å; Y147-K168 PolarHBondContact N-O 2.97Å; Y147-K168 PolarHBondContact O-N 2.84Å; Y147-K168 VanDerWaalsContact O-O 3.1Å; Y147-F173 HydrophobicContact CD1-CE2 4.4Å; Y147-F185 HydrophobicContact CD1-CE2 4.5Å; Y147-F185 AromaticContact CE1-CE2 3.88Å; Y147-F185 HydrophobicContact CE1-CE2 3.88Å; Y147-F185 HydrophobicContact CE1-CZ 4.2Å
148	S	81	Confident	71.9	Confident	18 Å²	18	65.7 Å²	65.7	13%	0.126	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	122.5	173.7	-55.7	0	0	0	0	110.2	S138 S139 F166 T167	S138-S148 CarbonylContact C-O 3.48Å; S138-S148 WeakPolarHBondContact CA-O 3.36Å; S139-S148 PolarHBondContact N-O 2.93Å; S139-S148 PolarHBondContact O-N 3.38Å; S148-F166 CarbonylContact C-O 3.58Å; S148-F166 VanDerWaalsContact CA-O 3.29Å; S148-F166 WeakPolarHBondContact CA-O 3.49Å; S148-T167 VanDerWaalsContact OG-CG2 3.3Å; S148-T167 WeakPolarHBondContact OG-CG2 3.35Å; S148-T167 PolarHBondContact OG-OG1 3.25Å
149	L	80.6	Confident	71.3	Confident	2 Å²	2	76.5 Å²	76.5	1%	0.01	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.4	173	-175.8	67.3	0	0	0	109.3	A40 Y147 V151 E165 F166 F185 V189	A40-L149 HydrophobicContact CB-CD2 4.43Å; Y147-L149 HydrophobicContact CE1-CB 3.74Å; L149-V151 HydrophobicContact CG-CG2 4.47Å; L149-E165 WeakPolarHBondContact O-CA 3.27Å; L149-F166 HydrophobicContact CB-CD1 4.1Å; L149-F166 HydrophobicContact CB-CE1 3.63Å; L149-F166 HydrophobicContact CB-CE2 4.25Å; L149-F166 HydrophobicContact CB-CZ 3.69Å; L149-F166 HydrophobicContact CD2-CE1 3.58Å; L149-F166 HydrophobicContact CD2-CZ 3.9Å; L149-F166 HydrophobicContact CG-CE1 4.1Å; L149-F166 HydrophobicContact CG-CZ 4.42Å; L149-F166 PolarHBondContact N-O 3.41Å; L149-F166 PolarHBondContact O-N 2.96Å; L149-F185 HydrophobicContact CD2-CZ 4.42Å; L149-V189 HydrophobicContact CD2-CG2 4.08Å
150	R	79.8	Confident	71	Confident	89 Å²	89	78.6 Å²	78.6	34%	0.336	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	138.2	172.3	-72.3	-175.5	179.4	-131.6	-5	110	L136 S137 F152 A164 E165	L136-R150 CarbonylContact C-O 3.56Å; L136-R150 WeakPolarHBondContact CA-O 3.11Å; S137-R150 PolarHBondContact N-O 3.49Å; S137-R150 WeakPolarHBondContact O-CA 3.28Å; S137-R150 PolarHBondContact O-N 2.71Å; R150-F152 HydrophobicContact CB-CE2 4.03Å; R150-F152 HydrophobicContact CB-CZ 4.48Å; R150-A164 CarbonylContact C-O 3.56Å; R150-A164 VanDerWaalsContact CA-O 3.32Å; R150-A164 WeakPolarHBondContact CA-O 3.44Å; R150-E165 HydrophobicContact CG-CB 3.74Å; R150-E165 VanDerWaalsContact CG-CD 3.49Å; R150-E165 HydrophobicContact CG-CG 3.52Å; R150-E165 WeakPolarHBondContact CG-OE1 3.22Å; R150-E165 IonicContact CZ-OE1 3.57Å; R150-E165 IonicContact CZ-OE2 2.64Å; R150-E165 IonicContact NE-OE1 3.28Å; R150-E165 PolarHBondContact NE-OE1 3.02Å; R150-E165 IonicContact NE-OE2 2.66Å; R150-E165 PolarHBondContact NE-OE2 2.69Å; R150-E165 IonicContact NH2-OE1 2.66Å; R150-E165 PolarHBondContact NH2-OE1 3.42Å; R150-E165 IonicContact NH2-OE2 2.71Å; R150-E165 PolarHBondContact NH2-OE2 3.37Å
151	V	77.9	Confident	70.8	Confident	7 Å²	7	81 Å²	81	4%	0.042	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	116.6	174.4	179.3	0	0	0	0	107.9	W134 Q135 L136 L149 D163 A164 L192 L196	W134-V151 HydrophobicContact CE3-CG1 3.59Å; W134-V151 HydrophobicContact CZ3-CG1 3.87Å; Q135-V151 CarbonylContact O-C 3.38Å; Q135-V151 WeakPolarHBondContact O-CA 3.16Å; L136-V151 HydrophobicContact CD2-CB 4.17Å; L136-V151 HydrophobicContact CD2-CG1 3.89Å; L136-V151 HydrophobicContact CD2-CG2 3.42Å; L136-V151 VanDerWaalsContact CD2-CG2 3.42Å; L149-V151 HydrophobicContact CG-CG2 4.47Å; V151-D163 VanDerWaalsContact O-CA 3.29Å; V151-D163 WeakPolarHBondContact O-CA 3.47Å; V151-A164 PolarHBondContact N-O 3.29Å; V151-A164 PolarHBondContact O-N 2.94Å; V151-L192 HydrophobicContact CB-CD2 3.64Å; V151-L192 HydrophobicContact CG2-CD2 3.28Å; V151-L196 HydrophobicContact CB-CD1 3.88Å; V151-L196 HydrophobicContact CG1-CD1 3.66Å; V151-L196 WeakPolarHBondContact O-CD1 3.23Å
152	F	73.6	Confident	71	Confident	54 Å²	54	77.1 Å²	77.1	24%	0.237	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	128.5	173.7	-60.3	-89.6	0	0	0	108.9	W134 Q135 R150 R162 D163	W134-F152 CarbonylContact C-O 3.48Å; W134-F152 WeakPolarHBondContact CA-O 3.26Å; Q135-F152 HydrophobicContact CB-CB 4.04Å; Q135-F152 HydrophobicContact CB-CD2 4.48Å; Q135-F152 HydrophobicContact CG-CB 4.44Å; Q135-F152 PolarHBondContact N-O 2.9Å; Q135-F152 PolarHBondContact O-N 3.36Å; R150-F152 HydrophobicContact CB-CE2 4.03Å; R150-F152 HydrophobicContact CB-CZ 4.48Å; F152-R162 CarbonylContact C-O 3.27Å; F152-R162 VanDerWaalsContact CA-O 3.32Å; F152-R162 WeakPolarHBondContact CA-O 3.36Å; F152-D163 HydrophobicContact CD1-CB 3.5Å; F152-D163 HydrophobicContact CE1-CB 3.61Å; F152-D163 HydrophobicContact CG-CB 4.28Å; F152-D163 HydrophobicContact CZ-CB 4.49Å
153	F	74.1	Confident	71.7	Confident	12 Å²	12	71.4 Å²	71.4	5%	0.053	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	117.4	171.5	175.6	-104.9	0	0	0	108.6	H132 W134 D155 S161 R162	H132-F153 HydrophobicContact CB-CE2 3.84Å; H132-F153 HydrophobicContact CB-CZ 4.22Å; H132-F153 AromaticContact CG-CZ 3.96Å; H132-F153 AromaticContact ND1-CZ 3.7Å; W134-F153 AromaticContact CD2-CD2 3.66Å; W134-F153 HydrophobicContact CD2-CD2 3.66Å; W134-F153 HydrophobicContact CD2-CE2 4.39Å; W134-F153 AromaticContact CE2-CD2 3.27Å; W134-F153 AromaticContact CE2-CE2 3.6Å; W134-F153 HydrophobicContact CE3-CB 4.26Å; W134-F153 HydrophobicContact CE3-CD2 4.09Å; W134-F153 HydrophobicContact CG-CD2 4.22Å; W134-F153 HydrophobicContact CH2-CB 4.48Å; W134-F153 AromaticContact CH2-CD2 3.87Å; W134-F153 HydrophobicContact CH2-CD2 3.87Å; W134-F153 HydrophobicContact CH2-CE2 4.45Å; W134-F153 HydrophobicContact CH2-CG 4.37Å; W134-F153 AromaticContact CZ2-CD2 3.39Å; W134-F153 HydrophobicContact CZ2-CD2 3.39Å; W134-F153 AromaticContact CZ2-CE2 3.64Å; W134-F153 HydrophobicContact CZ2-CE2 3.64Å; W134-F153 HydrophobicContact CZ2-CG 4.3Å; W134-F153 HydrophobicContact CZ3-CB 4.22Å; W134-F153 HydrophobicContact CZ3-CD2 4.19Å; W134-F153 AromaticContact NE1-CD2 3.64Å; W134-F153 AromaticContact NE1-CE2 3.61Å; F153-D155 HydrophobicContact CE1-CB 3.99Å; F153-D155 HydrophobicContact CZ-CB 4.48Å; F153-S161 CarbonylContact O-C 3.48Å; F153-S161 WeakPolarHBondContact O-CA 3Å; F153-R162 PolarHBondContact N-O 3.46Å; F153-R162 PolarHBondContact O-N 3.09Å
154	T	71.1	Confident	72.5	Confident	29 Å²	29	62.7 Å²	62.7	18%	0.178	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	117.8	173.3	-58.1	0	0	0	0	109.4	V133 S161	V133-T154 PolarHBondContact N-O 2.93Å; V133-T154 PolarHBondContact O-N 3.12Å; T154-S161 PolarHBondContact OG1-OG 3.24Å; T154-S161 VanDerWaalsContact OG1-OG 3.12Å
155	D	68.9	Low	73	Confident	15 Å²	15	63.7 Å²	63.7	8%	0.08	32%	0.318	C	S	.	.			trans	-78.1	122.1	179.1	-173.1	-81.4	0	0	0	110.6	H132 F153 K157 T158 R159 N160 K200	H132-D155 VanDerWaalsContact CE1-CG 3.5Å; H132-D155 IonicContact CE1-OD1 2.82Å; H132-D155 IonicContact CE1-OD2 3.6Å; H132-D155 PolarHBondContact CE1-OD2 3.38Å; H132-D155 IonicContact ND1-OD2 3.52Å; F153-D155 HydrophobicContact CE1-CB 3.99Å; F153-D155 HydrophobicContact CZ-CB 4.48Å; D155-K157 PolarHBondContact O-N 3.31Å; D155-K157 WeakPolarHBondContact OD1-CB 3.42Å; D155-K157 PolarHBondContact OD1-N 3.45Å; D155-T158 WeakPolarHBondContact CB-OG1 3.4Å; D155-T158 PolarHBondContact OD1-N 3.04Å; D155-T158 PolarHBondContact OD1-OG1 3.36Å; D155-R159 VanDerWaalsContact O-CA 3.26Å; D155-R159 WeakPolarHBondContact O-CA 3.2Å; D155-R159 PolarHBondContact O-N 3.07Å; D155-N160 PolarHBondContact N-O 3.4Å; D155-K200 WeakPolarHBondContact OD2-CE 3.26Å; D155-K200 IonicContact OD2-NZ 3.96Å; D155-K200 PolarHBondContact OD2-NZ 3.28Å
156	G	61.1	Low	73.2	Confident	34 Å²	34	60.2 Å²	60.2	35%	0.351	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.3	-177.3	0	0	0	0	0	114.4	P130 H132	P130-G156 WeakPolarHBondContact CB-O 3.41Å; P130-G156 VanDerWaalsContact CG-O 3.24Å; P130-G156 WeakPolarHBondContact CG-O 3.34Å; H132-G156 PolarHBondContact ND1-N 3.48Å
157	K	58.1	Low	73.3	Confident	142 Å²	142	58.2 Å²	58.2	62%	0.617	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-34.4	-172.4	-149.3	168.8	-177.8	171.4	0	111.9	D129 P130 D155	D129-K157 WeakPolarHBondContact OD1-CD 3.17Å; D129-K157 WeakPolarHBondContact OD1-CE 3.32Å; D129-K157 IonicContact OD1-NZ 2.63Å; D129-K157 PolarHBondContact OD1-NZ 3.04Å; D129-K157 IonicContact OD2-NZ 3.43Å; D129-K157 PolarHBondContact OD2-NZ 3.01Å; P130-K157 HydrophobicContact CG-CB 3.79Å; P130-K157 HydrophobicContact CG-CG 4.01Å; D155-K157 PolarHBondContact O-N 3.31Å; D155-K157 WeakPolarHBondContact OD1-CB 3.42Å; D155-K157 PolarHBondContact OD1-N 3.45Å
158	T	59.8	Low	73.5	Confident	81 Å²	81	62.6 Å²	62.6	50%	0.497	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-7.8	-178.8	59.2	0	0	0	0	114	D155 N160	D155-T158 WeakPolarHBondContact CB-OG1 3.4Å; D155-T158 PolarHBondContact OD1-N 3.04Å; D155-T158 PolarHBondContact OD1-OG1 3.36Å; T158-N160 PolarHBondContact O-N 3.11Å; T158-N160 PolarHBondContact OG1-ND2 3.33Å
159	R	63.1	Low	73.5	Confident	227 Å²	227	62.9 Å²	62.9	86%	0.857	32%	0.315	S	S	*	.			trans	55.8	16	-175.9	-137.2	177.4	-168.8	174.4	3.3	113.6	D155	D155-R159 VanDerWaalsContact O-CA 3.26Å; D155-R159 WeakPolarHBondContact O-CA 3.2Å; D155-R159 PolarHBondContact O-N 3.07Å
160	N	65.2	Low	73.3	Confident	93 Å²	93	63.8 Å²	63.8	50%	0.497	32%	0.32	S	S	.	.			trans	-80.9	128.9	177	-74.4	-37.9	0	0	0	108.9	D155 T158	D155-N160 PolarHBondContact N-O 3.4Å; T158-N160 PolarHBondContact O-N 3.11Å; T158-N160 PolarHBondContact OG1-ND2 3.33Å
161	S	68.7	Low	73	Confident	81 Å²	81	63.7 Å²	63.7	57%	0.566	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	134.1	171.6	-61.7	0	0	0	0	109.3	F153 T154	F153-S161 CarbonylContact O-C 3.48Å; F153-S161 WeakPolarHBondContact O-CA 3Å; T154-S161 PolarHBondContact OG1-OG 3.24Å; T154-S161 VanDerWaalsContact OG1-OG 3.12Å
162	R	75.8	Confident	72.9	Confident	71 Å²	71	65.7 Å²	65.7	27%	0.268	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146	172.4	-61.2	-178	-176.6	-175.5	-5	108.2	F152 F153 L196 E199	F152-R162 CarbonylContact C-O 3.27Å; F152-R162 VanDerWaalsContact CA-O 3.32Å; F152-R162 WeakPolarHBondContact CA-O 3.36Å; F153-R162 PolarHBondContact N-O 3.46Å; F153-R162 PolarHBondContact O-N 3.09Å; R162-L196 HydrophobicContact CB-CD2 3.95Å; R162-E199 PolarHBondContact NH1-O 3.48Å
163	D	76.1	Confident	72.9	Confident	93 Å²	93	63.1 Å²	63.1	50%	0.497	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	141.9	177	63.9	-71.7	0	0	0	111.3	V151 F152	V151-D163 VanDerWaalsContact O-CA 3.29Å; V151-D163 WeakPolarHBondContact O-CA 3.47Å; F152-D163 HydrophobicContact CD1-CB 3.5Å; F152-D163 HydrophobicContact CE1-CB 3.61Å; F152-D163 HydrophobicContact CG-CB 4.28Å; F152-D163 HydrophobicContact CZ-CB 4.49Å
164	A	79.6	Confident	72.9	Confident	16 Å²	16	63.5 Å²	63.5	13%	0.132	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	143.1	170	0	0	0	0	0	108.9	R150 V151 L192 L196	R150-A164 CarbonylContact C-O 3.56Å; R150-A164 VanDerWaalsContact CA-O 3.32Å; R150-A164 WeakPolarHBondContact CA-O 3.44Å; V151-A164 PolarHBondContact N-O 3.29Å; V151-A164 PolarHBondContact O-N 2.94Å; A164-L192 HydrophobicContact CB-CD1 3.85Å; A164-L192 HydrophobicContact CB-CD2 4.25Å; A164-L192 HydrophobicContact CB-CG 3.79Å; A164-L196 HydrophobicContact CB-CD1 3.83Å; A164-L196 HydrophobicContact CB-CD2 3.86Å; A164-L196 HydrophobicContact CB-CG 3.74Å
165	E	81.4	Confident	73.2	Confident	78 Å²	78	66.3 Å²	66.3	36%	0.364	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	143.7	179.4	-173.8	168.2	-144.9	0	0	110.4	L149 R150	L149-E165 WeakPolarHBondContact O-CA 3.27Å; R150-E165 HydrophobicContact CG-CB 3.74Å; R150-E165 VanDerWaalsContact CG-CD 3.49Å; R150-E165 HydrophobicContact CG-CG 3.52Å; R150-E165 WeakPolarHBondContact CG-OE1 3.22Å; R150-E165 IonicContact CZ-OE1 3.57Å; R150-E165 IonicContact CZ-OE2 2.64Å; R150-E165 IonicContact NE-OE1 3.28Å; R150-E165 PolarHBondContact NE-OE1 3.02Å; R150-E165 IonicContact NE-OE2 2.66Å; R150-E165 PolarHBondContact NE-OE2 2.69Å; R150-E165 IonicContact NH2-OE1 2.66Å; R150-E165 PolarHBondContact NH2-OE1 3.42Å; R150-E165 IonicContact NH2-OE2 2.71Å; R150-E165 PolarHBondContact NH2-OE2 3.37Å
166	F	80.8	Confident	73.2	Confident	20 Å²	20	74.7 Å²	74.7	9%	0.088	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	142.6	156.3	75.2	-100.4	0	0	0	110.7	Y147 S148 L149 K168 F173 F185 L192	Y147-F166 HydrophobicContact CD1-CE2 4.14Å; Y147-F166 HydrophobicContact CD1-CZ 4.49Å; Y147-F166 HydrophobicContact CE1-CE2 4.34Å; Y147-F166 HydrophobicContact CE1-CZ 4.25Å; S148-F166 CarbonylContact C-O 3.58Å; S148-F166 VanDerWaalsContact CA-O 3.29Å; S148-F166 WeakPolarHBondContact CA-O 3.49Å; L149-F166 HydrophobicContact CB-CD1 4.1Å; L149-F166 HydrophobicContact CB-CE1 3.63Å; L149-F166 HydrophobicContact CB-CE2 4.25Å; L149-F166 HydrophobicContact CB-CZ 3.69Å; L149-F166 HydrophobicContact CD2-CE1 3.58Å; L149-F166 HydrophobicContact CD2-CZ 3.9Å; L149-F166 HydrophobicContact CG-CE1 4.1Å; L149-F166 HydrophobicContact CG-CZ 4.42Å; L149-F166 PolarHBondContact N-O 3.41Å; L149-F166 PolarHBondContact O-N 2.96Å; F166-K168 HydrophobicContact CD2-CB 4.35Å; F166-K168 HydrophobicContact CD2-CG 4.1Å; F166-F173 HydrophobicContact CE2-CE2 4.27Å; F166-F173 AromaticContact CE2-CZ 3.77Å; F166-F173 HydrophobicContact CE2-CZ 3.77Å; F166-F173 HydrophobicContact CZ-CZ 4.45Å; F166-F185 HydrophobicContact CZ-CE2 4.14Å; F166-L192 HydrophobicContact CB-CD1 4.26Å; F166-L192 HydrophobicContact CD1-CD1 4.05Å; F166-L192 HydrophobicContact CD1-CD2 4.27Å
167	T	82.6	Confident	73.2	Confident	60 Å²	60	76 Å²	76	37%	0.368	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	122	170.9	-56.5	0	0	0	0	108.9	Q146 Y147 S148	Q146-T167 HydrophobicContact CB-CG2 4.02Å; Y147-T167 WeakPolarHBondContact O-CA 3.49Å; S148-T167 VanDerWaalsContact OG-CG2 3.3Å; S148-T167 WeakPolarHBondContact OG-CG2 3.35Å; S148-T167 PolarHBondContact OG-OG1 3.25Å
168	K	83.6	Confident	73.5	Confident	93 Å²	93	69.3 Å²	69.3	40%	0.404	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	153.5	179.6	-72.2	-62.7	175.9	-171	0	111.3	Y147 F166 F173	Y147-K168 PolarHBondContact N-O 2.97Å; Y147-K168 PolarHBondContact O-N 2.84Å; Y147-K168 VanDerWaalsContact O-O 3.1Å; F166-K168 HydrophobicContact CD2-CB 4.35Å; F166-K168 HydrophobicContact CD2-CG 4.1Å; K168-F173 HydrophobicContact CB-CE2 3.7Å; K168-F173 HydrophobicContact CB-CZ 3.65Å; K168-F173 HydrophobicContact CG-CZ 4.22Å
169	S	81.1	Confident	74	Confident	23 Å²	23	66.9 Å²	66.9	16%	0.161	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	137.1	175.6	-178.7	0	0	0	0	109.7	D145 S171 T172	D145-S169 CarbonylContact O-C 3.47Å; D145-S169 VanDerWaalsContact O-CA 3.28Å; D145-S169 WeakPolarHBondContact O-CA 3.33Å; D145-S169 WeakPolarHBondContact OD2-CB 3.34Å; D145-S169 PolarHBondContact OD2-OG 3.35Å; S169-S171 WeakPolarHBondContact CB-OG 3.37Å; S169-S171 PolarHBondContact O-N 3.08Å; S169-S171 PolarHBondContact OG-N 3.09Å; S169-S171 PolarHBondContact OG-OG 3.36Å; S169-T172 VanDerWaalsContact O-CB 3.28Å; S169-T172 WeakPolarHBondContact O-CB 3.38Å; S169-T172 PolarHBondContact O-N 3.04Å; S169-T172 PolarHBondContact O-OG1 2.85Å
170	V	76.6	Confident	74.4	Confident	22 Å²	22	57.1 Å²	57.1	13%	0.133	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-52.2	-37.2	171.8	170.5	0	0	0	0	110.1	V32 L36 L140 D145 T172 F173 F174	V32-V170 HydrophobicContact CG1-CB 4.3Å; V32-V170 HydrophobicContact CG1-CG1 3.36Å; V32-V170 HydrophobicContact CG1-CG2 3.89Å; L36-V170 HydrophobicContact CD1-CG2 4.36Å; L140-V170 HydrophobicContact CD1-CG2 3.73Å; L140-V170 HydrophobicContact CD2-CG2 4.42Å; D145-V170 WeakPolarHBondContact O-CG2 3.43Å; D145-V170 PolarHBondContact O-N 2.8Å; V170-T172 PolarHBondContact O-N 3.01Å; V170-F173 PolarHBondContact O-N 3.45Å; V170-F174 HydrophobicContact CG1-CD2 3.45Å; V170-F174 VanDerWaalsContact CG1-CD2 3.45Å; V170-F174 HydrophobicContact CG1-CE2 3.59Å; V170-F174 HydrophobicContact CG1-CG 4.44Å; V170-F174 WeakPolarHBondContact O-CD2 3.25Å; V170-F174 PolarHBondContact O-N 2.68Å
171	S	74.4	Confident	75	Confident	86 Å²	86	54.3 Å²	54.3	60%	0.601	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-56.3	-23.7	177.7	62.8	0	0	0	0	114.1	S169 F173	S169-S171 WeakPolarHBondContact CB-OG 3.37Å; S169-S171 PolarHBondContact O-N 3.08Å; S169-S171 PolarHBondContact OG-N 3.09Å; S169-S171 PolarHBondContact OG-OG 3.36Å; S171-F173 VanDerWaalsContact C-N 3.29Å
172	T	76	Confident	75.1	Confident	49 Å²	49	53.3 Å²	53.3	30%	0.301	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-74.4	-20.5	176.8	-51.8	0	0	0	0	112.4	S169 V170 Q184	S169-T172 VanDerWaalsContact O-CB 3.28Å; S169-T172 WeakPolarHBondContact O-CB 3.38Å; S169-T172 PolarHBondContact O-N 3.04Å; S169-T172 PolarHBondContact O-OG1 2.85Å; V170-T172 PolarHBondContact O-N 3.01Å; T172-Q184 PolarHBondContact O-OE1 3.25Å
173	F	72.3	Confident	75	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-7.6	-176.1	-54.3	-63.1	0	0	0	113.4	L36 Y147 F166 K168 V170 S171 L180 V181 F185 Y188	L36-F173 HydrophobicContact CD2-CB 4.05Å; L36-F173 HydrophobicContact CD2-CD2 4.23Å; L36-F173 HydrophobicContact CD2-CG 4.26Å; Y147-F173 HydrophobicContact CD1-CE2 4.4Å; F166-F173 HydrophobicContact CE2-CE2 4.27Å; F166-F173 AromaticContact CE2-CZ 3.77Å; F166-F173 HydrophobicContact CE2-CZ 3.77Å; F166-F173 HydrophobicContact CZ-CZ 4.45Å; K168-F173 HydrophobicContact CB-CE2 3.7Å; K168-F173 HydrophobicContact CB-CZ 3.65Å; K168-F173 HydrophobicContact CG-CZ 4.22Å; V170-F173 PolarHBondContact O-N 3.45Å; S171-F173 VanDerWaalsContact C-N 3.29Å; F173-L180 HydrophobicContact CB-CD1 3.99Å; F173-L180 WeakPolarHBondContact O-CA 3.12Å; F173-V181 PolarHBondContact O-N 3.03Å; F173-F185 HydrophobicContact CD1-CB 4.19Å; F173-F185 AromaticContact CD1-CD2 3.74Å; F173-F185 HydrophobicContact CD1-CD2 3.74Å; F173-F185 HydrophobicContact CD1-CG 4.48Å; F173-F185 HydrophobicContact CD2-CD2 4.47Å; F173-F185 AromaticContact CE1-CD2 3.89Å; F173-F185 HydrophobicContact CE1-CD2 3.89Å; F173-F185 HydrophobicContact CG-CD2 4.05Å; F173-F185 HydrophobicContact CZ-CD2 4.32Å; F173-Y188 AromaticContact CE1-CD2 3.63Å; F173-Y188 HydrophobicContact CE1-CD2 3.63Å; F173-Y188 HydrophobicContact CE1-CE2 4.02Å; F173-Y188 HydrophobicContact CE1-CG 4.32Å; F173-Y188 HydrophobicContact CZ-CD2 4.36Å
174	F	74.2	Confident	75	Confident	21 Å²	21	55.8 Å²	55.8	9%	0.092	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-120	129.1	-175.5	-75.4	-94.3	0	0	0	111.5	I24 V32 L36 V170 T179 L180	I24-F174 HydrophobicContact CB-CE1 4.16Å; I24-F174 HydrophobicContact CD1-CE1 3.71Å; I24-F174 HydrophobicContact CD1-CZ 4.22Å; V32-F174 HydrophobicContact CB-CZ 4.47Å; V32-F174 HydrophobicContact CG1-CE2 3.82Å; V32-F174 HydrophobicContact CG1-CZ 4Å; V32-F174 HydrophobicContact CG2-CZ 4.39Å; L36-F174 HydrophobicContact CD1-CE2 4.15Å; L36-F174 HydrophobicContact CD2-CE2 4.1Å; L36-F174 HydrophobicContact CG-CE2 4.05Å; L36-F174 HydrophobicContact CG-CZ 4.41Å; V170-F174 HydrophobicContact CG1-CD2 3.45Å; V170-F174 VanDerWaalsContact CG1-CD2 3.45Å; V170-F174 HydrophobicContact CG1-CE2 3.59Å; V170-F174 HydrophobicContact CG1-CG 4.44Å; V170-F174 WeakPolarHBondContact O-CD2 3.25Å; V170-F174 PolarHBondContact O-N 2.68Å; F174-T179 WeakPolarHBondContact CA-O 3.15Å; F174-L180 HydrophobicContact CD2-CD1 4.31Å; F174-L180 HydrophobicContact CE1-CB 4.22Å; F174-L180 HydrophobicContact CE1-CD1 4.33Å; F174-L180 HydrophobicContact CE2-CD1 3.85Å; F174-L180 HydrophobicContact CZ-CD1 3.88Å
175	D	76.9	Confident	74.8	Confident	87 Å²	87	55.1 Å²	55.1	47%	0.465	30%	0.296	S	S	.	.			trans	-72.9	166.3	173	-77.5	-31.2	0	0	0	112.2	S177 G178 T179 V181	D175-S177 PolarHBondContact O-N 3.19Å; D175-G178 PolarHBondContact O-N 2.8Å; D175-T179 PolarHBondContact N-O 3Å; D175-V181 HydrophobicContact CB-CG2 4.44Å; D175-V181 VanDerWaalsContact CG-CG2 3.4Å; D175-V181 WeakPolarHBondContact OD1-CG2 3.33Å; D175-V181 WeakPolarHBondContact OD2-CG2 3.09Å
176	E	69	Low	74.5	Confident	192 Å²	192	53.7 Å²	53.7	90%	0.897	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-26.5	176.1	-63	-170.1	144.2	0	0	112.9	K26 G178	K26-E176 PolarHBondContact NZ-O 3.4Å; E176-G178 VanDerWaalsContact C-N 3.32Å; E176-G178 PolarHBondContact O-N 2.99Å
177	S	61.7	Low	74.3	Confident	61 Å²	61	55.6 Å²	55.6	43%	0.427	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-9.5	177.2	65	0	0	0	0	115	K23 D175 T179	K23-S177 WeakPolarHBondContact CE-O 3.43Å; D175-S177 PolarHBondContact O-N 3.19Å; S177-T179 WeakPolarHBondContact OG-CB 3.19Å; S177-T179 PolarHBondContact OG-OG1 3.34Å
178	G	64.3	Low	74.1	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.01	31%	0.306	C	S	.	.	S	Bend	trans	78.7	21.7	-171.6	0	0	0	0	0	113.3	I24 D175 E176	I24-G178 PolarHBondContact N-O 3.12Å; D175-G178 PolarHBondContact O-N 2.8Å; E176-G178 VanDerWaalsContact C-N 3.32Å; E176-G178 PolarHBondContact O-N 2.99Å
179	T	69.7	Low	73.7	Confident	31 Å²	31	52.2 Å²	52.2	19%	0.19	29%	0.288	C	S	.	.			trans	-95.3	134.2	177.2	-56.7	0	0	0	0	109.7	P21 F174 D175 S177	P21-T179 HydrophobicContact CB-CG2 3.28Å; P21-T179 HydrophobicContact CG-CG2 4.41Å; F174-T179 WeakPolarHBondContact CA-O 3.15Å; D175-T179 PolarHBondContact N-O 3Å; S177-T179 WeakPolarHBondContact OG-CB 3.19Å; S177-T179 PolarHBondContact OG-OG1 3.34Å
180	L	72.7	Confident	73.5	Confident	21 Å²	21	51.9 Å²	51.9	11%	0.11	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-72.6	124.1	173.1	-177.3	76	0	0	0	110.2	L36 A39 F173 F174 M182	L36-L180 HydrophobicContact CD2-CD1 3.42Å; L36-L180 VanDerWaalsContact CD2-CD1 3.42Å; L36-L180 HydrophobicContact CG-CD1 4.31Å; A39-L180 HydrophobicContact CB-CD2 3.38Å; F173-L180 HydrophobicContact CB-CD1 3.99Å; F173-L180 WeakPolarHBondContact O-CA 3.12Å; F174-L180 HydrophobicContact CD2-CD1 4.31Å; F174-L180 HydrophobicContact CE1-CB 4.22Å; F174-L180 HydrophobicContact CE1-CD1 4.33Å; F174-L180 HydrophobicContact CE2-CD1 3.85Å; F174-L180 HydrophobicContact CZ-CD1 3.88Å; L180-M182 HydrophobicContact CD2-CG 4.38Å; L180-M182 PolarHBondContact O-N 3.34Å; L180-M182 VanDerWaalsContact O-N 3.13Å
181	V	77.3	Confident	73.8	Confident	35 Å²	35	57.6 Å²	57.6	21%	0.212	31%	0.309	C	S	.	.			trans	-81.6	89.5	174.7	-173.1	0	0	0	0	108.8	F173 D175 D183 Q184 F185	F173-V181 PolarHBondContact O-N 3.03Å; D175-V181 HydrophobicContact CB-CG2 4.44Å; D175-V181 VanDerWaalsContact CG-CG2 3.4Å; D175-V181 WeakPolarHBondContact OD1-CG2 3.33Å; D175-V181 WeakPolarHBondContact OD2-CG2 3.09Å; V181-D183 VanDerWaalsContact C-N 3.29Å; V181-D183 PolarHBondContact O-N 3.29Å; V181-Q184 HydrophobicContact CB-CB 4.33Å; V181-Q184 HydrophobicContact CG1-CB 3.9Å; V181-Q184 PolarHBondContact O-N 3.33Å; V181-F185 PolarHBondContact O-N 2.81Å
182	M	71.4	Confident	74	Confident	60 Å²	60	54.3 Å²	54.3	30%	0.296	29%	0.285	S	S	.	.	H	α-helix	trans	-57.2	-40	-176.6	-71.5	-155.4	178	0	0	112.7	E19 K42 L180 Q184 F185 E186	E19-M182 HydrophobicContact CG-CE 4.43Å; K42-M182 HydrophobicContact CD-CE 4.36Å; K42-M182 HydrophobicContact CD-SD 4.47Å; L180-M182 HydrophobicContact CD2-CG 4.38Å; L180-M182 PolarHBondContact O-N 3.34Å; L180-M182 VanDerWaalsContact O-N 3.13Å; M182-Q184 PolarHBondContact O-N 2.98Å; M182-F185 PolarHBondContact O-N 3.29Å; M182-E186 VanDerWaalsContact O-CB 3.23Å; M182-E186 WeakPolarHBondContact O-CB 3.36Å; M182-E186 PolarHBondContact O-N 3.48Å
183	D	72.8	Confident	74	Confident	135 Å²	135	52.9 Å²	52.9	72%	0.722	28%	0.275	S	S	*	.	H	α-helix	trans	-57.6	-46.2	-179.5	-122	-85.7	0	0	0	112.8	V181 A187	V181-D183 VanDerWaalsContact C-N 3.29Å; V181-D183 PolarHBondContact O-N 3.29Å; D183-A187 PolarHBondContact O-N 3.1Å; D183-A187 VanDerWaalsContact O-N 3.09Å
184	Q	75.8	Confident	74.3	Confident	81 Å²	81	57 Å²	57	38%	0.379	30%	0.296	S	S	.	.	H	α-helix	trans	-70.1	-43.4	-178.9	-168.2	170.3	30.1	0	0	110.5	T172 V181 M182 A187 Y188	T172-Q184 PolarHBondContact O-OE1 3.25Å; V181-Q184 HydrophobicContact CB-CB 4.33Å; V181-Q184 HydrophobicContact CG1-CB 3.9Å; V181-Q184 PolarHBondContact O-N 3.33Å; M182-Q184 PolarHBondContact O-N 2.98Å; Q184-A187 PolarHBondContact O-N 2.86Å; Q184-Y188 HydrophobicContact CG-CD2 4.42Å; Q184-Y188 HydrophobicContact CG-CE2 4.03Å; Q184-Y188 WeakPolarHBondContact O-CD2 3.45Å; Q184-Y188 PolarHBondContact O-N 3.12Å
185	F	75.6	Confident	74.6	Confident	1 Å²	1	59.4 Å²	59.4	0%	0.004	31%	0.313	C	S	.	.	H	α-helix	trans	-63.3	-42.2	177	-171.9	-102.2	0	0	0	111.8	L36 A39 A40 Y147 L149 F166 F173 V181 M182 A187 Y188 V189	L36-F185 HydrophobicContact CB-CE2 4.49Å; L36-F185 HydrophobicContact CB-CZ 4.47Å; L36-F185 HydrophobicContact CD2-CD2 3.8Å; L36-F185 HydrophobicContact CD2-CE2 3.64Å; L36-F185 HydrophobicContact CD2-CZ 4.29Å; L36-F185 WeakPolarHBondContact O-CZ 3.41Å; A39-F185 HydrophobicContact CB-CD1 4.18Å; A39-F185 HydrophobicContact CB-CE1 4.19Å; A40-F185 HydrophobicContact CB-CE1 3.76Å; A40-F185 HydrophobicContact CB-CZ 4Å; Y147-F185 HydrophobicContact CD1-CE2 4.5Å; Y147-F185 AromaticContact CE1-CE2 3.88Å; Y147-F185 HydrophobicContact CE1-CE2 3.88Å; Y147-F185 HydrophobicContact CE1-CZ 4.2Å; L149-F185 HydrophobicContact CD2-CZ 4.42Å; F166-F185 HydrophobicContact CZ-CE2 4.14Å; F173-F185 HydrophobicContact CD1-CB 4.19Å; F173-F185 AromaticContact CD1-CD2 3.74Å; F173-F185 HydrophobicContact CD1-CD2 3.74Å; F173-F185 HydrophobicContact CD1-CG 4.48Å; F173-F185 HydrophobicContact CD2-CD2 4.47Å; F173-F185 AromaticContact CE1-CD2 3.89Å; F173-F185 HydrophobicContact CE1-CD2 3.89Å; F173-F185 HydrophobicContact CG-CD2 4.05Å; F173-F185 HydrophobicContact CZ-CD2 4.32Å; V181-F185 PolarHBondContact O-N 2.81Å; M182-F185 PolarHBondContact O-N 3.29Å; F185-A187 VanDerWaalsContact C-N 3.33Å; F185-A187 PolarHBondContact O-N 2.84Å; F185-Y188 PolarHBondContact O-N 3.45Å; F185-Y188 VanDerWaalsContact O-N 3.16Å; F185-V189 HydrophobicContact CD1-CG2 3.99Å; F185-V189 HydrophobicContact CE1-CG2 3.65Å; F185-V189 HydrophobicContact CZ-CG2 4Å; F185-V189 WeakPolarHBondContact O-CG2 3.44Å; F185-V189 PolarHBondContact O-N 2.73Å
186	E	74.8	Confident	74.4	Confident	49 Å²	49	55.3 Å²	55.3	23%	0.229	29%	0.291	C	S	.	.	H	α-helix	trans	-60.1	-41.1	176.4	-174.8	179.9	158.9	0	0	111.8	V43 K47 M182 Y188 V189 S190	V43-E186 HydrophobicContact CG1-CG 3.97Å; V43-E186 HydrophobicContact CG2-CB 4.18Å; V43-E186 HydrophobicContact CG2-CG 4.09Å; K47-E186 WeakPolarHBondContact CE-OE1 3.45Å; K47-E186 IonicContact NZ-OE1 3.09Å; K47-E186 PolarHBondContact NZ-OE1 3.32Å; M182-E186 VanDerWaalsContact O-CB 3.23Å; M182-E186 WeakPolarHBondContact O-CB 3.36Å; M182-E186 PolarHBondContact O-N 3.48Å; E186-Y188 VanDerWaalsContact C-N 3.31Å; E186-Y188 PolarHBondContact O-N 3.36Å; E186-V189 PolarHBondContact O-N 2.79Å; E186-S190 VanDerWaalsContact O-CB 3.24Å; E186-S190 WeakPolarHBondContact O-CB 3.14Å; E186-S190 PolarHBondContact O-N 2.79Å; E186-S190 PolarHBondContact O-OG 3.04Å
187	A	78.3	Confident	74.4	Confident	60 Å²	60	48.2 Å²	48.2	50%	0.496	27%	0.265	S	S	.	.	H	α-helix	trans	-61.2	-38.6	176.5	0	0	0	0	0	112.4	D183 Q184 F185 K191	D183-A187 PolarHBondContact O-N 3.1Å; D183-A187 VanDerWaalsContact O-N 3.09Å; Q184-A187 PolarHBondContact O-N 2.86Å; F185-A187 VanDerWaalsContact C-N 3.33Å; F185-A187 PolarHBondContact O-N 2.84Å; A187-K191 VanDerWaalsContact O-CB 3.27Å; A187-K191 WeakPolarHBondContact O-CB 2.91Å; A187-K191 PolarHBondContact O-N 3.43Å
188	Y	78.1	Confident	74.4	Confident	75 Å²	75	49.1 Å²	49.1	29%	0.294	27%	0.268	S	S	.	.	H	α-helix	trans	-69.8	-43.9	176	-78.5	-76.6	0	0	0	112.4	F173 Q184 F185 E186 K191 L192	F173-Y188 AromaticContact CE1-CD2 3.63Å; F173-Y188 HydrophobicContact CE1-CD2 3.63Å; F173-Y188 HydrophobicContact CE1-CE2 4.02Å; F173-Y188 HydrophobicContact CE1-CG 4.32Å; F173-Y188 HydrophobicContact CZ-CD2 4.36Å; Q184-Y188 HydrophobicContact CG-CD2 4.42Å; Q184-Y188 HydrophobicContact CG-CE2 4.03Å; Q184-Y188 WeakPolarHBondContact O-CD2 3.45Å; Q184-Y188 PolarHBondContact O-N 3.12Å; F185-Y188 PolarHBondContact O-N 3.45Å; F185-Y188 VanDerWaalsContact O-N 3.16Å; E186-Y188 VanDerWaalsContact C-N 3.31Å; E186-Y188 PolarHBondContact O-N 3.36Å; Y188-K191 PolarHBondContact O-N 3.33Å; Y188-L192 WeakPolarHBondContact O-CB 3.41Å; Y188-L192 PolarHBondContact O-N 2.94Å
189	V	75.7	Confident	74	Confident	6 Å²	6	54.2 Å²	54.2	4%	0.036	29%	0.292	C	S	.	.	H	α-helix	trans	-64	-44.6	177.3	175.4	0	0	0	0	110.8	V43 L149 F185 E186 L192 H193	V43-V189 HydrophobicContact CG1-CB 4.5Å; V43-V189 HydrophobicContact CG1-CG1 4.07Å; L149-V189 HydrophobicContact CD2-CG2 4.08Å; F185-V189 HydrophobicContact CD1-CG2 3.99Å; F185-V189 HydrophobicContact CE1-CG2 3.65Å; F185-V189 HydrophobicContact CZ-CG2 4Å; F185-V189 WeakPolarHBondContact O-CG2 3.44Å; F185-V189 PolarHBondContact O-N 2.73Å; E186-V189 PolarHBondContact O-N 2.79Å; V189-L192 PolarHBondContact O-N 3.35Å; V189-H193 PolarHBondContact O-N 2.84Å
190	S	76.9	Confident	73.1	Confident	16 Å²	16	57.7 Å²	57.7	11%	0.112	30%	0.304	C	S	.	.	H	α-helix	trans	-62.4	-44.5	177.9	-56.9	0	0	0	0	111.2	E186 L192 H193 D194	E186-S190 VanDerWaalsContact O-CB 3.24Å; E186-S190 WeakPolarHBondContact O-CB 3.14Å; E186-S190 PolarHBondContact O-N 2.79Å; E186-S190 PolarHBondContact O-OG 3.04Å; S190-L192 VanDerWaalsContact C-N 3.29Å; S190-L192 PolarHBondContact O-N 3.35Å; S190-H193 PolarHBondContact O-N 3.47Å; S190-D194 WeakPolarHBondContact O-CB 3Å; S190-D194 VanDerWaalsContact O-CG 3.28Å; S190-D194 PolarHBondContact O-N 2.91Å
191	K	81.8	Confident	71.7	Confident	143 Å²	143	65.5 Å²	65.5	62%	0.622	34%	0.337	S	S	*	.	H	α-helix	trans	-61.1	-38.7	176.5	-174.6	178.6	-178.7	178.6	0	112.5	A187 Y188 T195	A187-K191 VanDerWaalsContact O-CB 3.27Å; A187-K191 WeakPolarHBondContact O-CB 2.91Å; A187-K191 PolarHBondContact O-N 3.43Å; Y188-K191 PolarHBondContact O-N 3.33Å; K191-T195 WeakPolarHBondContact O-CB 3.44Å; K191-T195 PolarHBondContact O-N 2.88Å; K191-T195 PolarHBondContact O-OG1 2.95Å
192	L	78.8	Confident	69.8	Low	17 Å²	17	69.9 Å²	69.9	9%	0.089	36%	0.364	C	S	.	.	H	α-helix	trans	-68.3	-42.3	178.1	-156.7	89.6	0	0	0	111.1	V151 A164 F166 Y188 V189 S190 T195 L196	V151-L192 HydrophobicContact CB-CD2 3.64Å; V151-L192 HydrophobicContact CG2-CD2 3.28Å; A164-L192 HydrophobicContact CB-CD1 3.85Å; A164-L192 HydrophobicContact CB-CD2 4.25Å; A164-L192 HydrophobicContact CB-CG 3.79Å; F166-L192 HydrophobicContact CB-CD1 4.26Å; F166-L192 HydrophobicContact CD1-CD1 4.05Å; F166-L192 HydrophobicContact CD1-CD2 4.27Å; Y188-L192 WeakPolarHBondContact O-CB 3.41Å; Y188-L192 PolarHBondContact O-N 2.94Å; V189-L192 PolarHBondContact O-N 3.35Å; S190-L192 VanDerWaalsContact C-N 3.29Å; S190-L192 PolarHBondContact O-N 3.35Å; L192-T195 PolarHBondContact O-N 3.32Å; L192-L196 PolarHBondContact O-N 2.81Å
193	H	75.5	Confident	68	Low	18 Å²	18	79.2 Å²	79.2	8%	0.083	40%	0.404	C	S	.	.	H	α-helix	trans	-61.8	-48.5	173.8	-178.9	-82.8	0	0	0	111.9	Y48 Y50 W134 V189 S190 T195 L196 A197	Y48-H193 AromaticContact CD1-CE1 3.81Å; Y48-H193 AromaticContact CD1-NE2 3.89Å; Y48-H193 AromaticContact CE1-CE1 3.35Å; Y48-H193 WeakPolarHBondContact CE1-CE1 3.23Å; Y48-H193 AromaticContact CE1-ND1 3.5Å; Y48-H193 AromaticContact CE1-NE2 3.79Å; Y48-H193 AromaticContact CZ-CG 3.95Å; Y48-H193 AromaticContact CZ-ND1 3.78Å; Y50-H193 AromaticContact CE2-NE2 3.93Å; Y50-H193 AromaticContact CZ-NE2 3.85Å; Y50-H193 PolarHBondContact OH-NE2 3.28Å; W134-H193 AromaticContact CE2-NE2 3.95Å; W134-H193 AromaticContact CH2-CD2 3.34Å; W134-H193 WeakPolarHBondContact CH2-CD2 2.94Å; W134-H193 AromaticContact CH2-CG 3.99Å; W134-H193 AromaticContact CH2-NE2 3.45Å; W134-H193 WeakPolarHBondContact CH2-NE2 3.14Å; W134-H193 AromaticContact CZ2-CD2 3.74Å; W134-H193 AromaticContact CZ2-NE2 3.37Å; W134-H193 WeakPolarHBondContact CZ2-NE2 3.23Å; W134-H193 AromaticContact CZ3-CD2 3.54Å; V189-H193 PolarHBondContact O-N 2.84Å; S190-H193 PolarHBondContact O-N 3.47Å; H193-T195 VanDerWaalsContact C-N 3.27Å; H193-T195 PolarHBondContact O-N 2.93Å; H193-L196 PolarHBondContact O-N 2.85Å; H193-L196 VanDerWaalsContact O-N 3.15Å; H193-A197 WeakPolarHBondContact O-CB 3.41Å; H193-A197 PolarHBondContact O-N 2.57Å
194	D	78.3	Confident	67.7	Low	86 Å²	86	76.5 Å²	76.5	46%	0.46	39%	0.388	S	S	.	.	H	α-helix	trans	-60.4	-37.1	178.4	-74.7	-26.2	0	0	0	111.6	S190 A197 T198	S190-D194 WeakPolarHBondContact O-CB 3Å; S190-D194 VanDerWaalsContact O-CG 3.28Å; S190-D194 PolarHBondContact O-N 2.91Å; D194-A197 PolarHBondContact O-N 2.87Å; D194-T198 WeakPolarHBondContact O-CB 3.24Å; D194-T198 PolarHBondContact O-N 2.95Å; D194-T198 PolarHBondContact O-OG1 3.26Å
195	T	80.4	Confident	67.3	Low	72 Å²	72	76.2 Å²	76.2	44%	0.442	39%	0.388	S	S	.	.	H	α-helix	trans	-61.7	-48.4	176.1	-57	0	0	0	0	110.8	K191 L192 H193 T198 E199	K191-T195 WeakPolarHBondContact O-CB 3.44Å; K191-T195 PolarHBondContact O-N 2.88Å; K191-T195 PolarHBondContact O-OG1 2.95Å; L192-T195 PolarHBondContact O-N 3.32Å; H193-T195 VanDerWaalsContact C-N 3.27Å; H193-T195 PolarHBondContact O-N 2.93Å; T195-T198 PolarHBondContact O-N 2.84Å; T195-E199 PolarHBondContact O-N 3.48Å
196	L	74.3	Confident	66.9	Low	2 Å²	2	80.4 Å²	80.4	1%	0.01	41%	0.409	C	S	.	.	H	α-helix	trans	-67.1	-36.2	178.7	-71.8	168	0	0	0	112.4	W134 V151 R162 A164 L192 H193	W134-L196 HydrophobicContact CH2-CB 4.01Å; W134-L196 HydrophobicContact CZ3-CB 4.05Å; W134-L196 HydrophobicContact CZ3-CD1 3.83Å; V151-L196 HydrophobicContact CB-CD1 3.88Å; V151-L196 HydrophobicContact CG1-CD1 3.66Å; V151-L196 WeakPolarHBondContact O-CD1 3.23Å; R162-L196 HydrophobicContact CB-CD2 3.95Å; A164-L196 HydrophobicContact CB-CD1 3.83Å; A164-L196 HydrophobicContact CB-CD2 3.86Å; A164-L196 HydrophobicContact CB-CG 3.74Å; L192-L196 PolarHBondContact O-N 2.81Å; H193-L196 PolarHBondContact O-N 2.85Å; H193-L196 VanDerWaalsContact O-N 3.15Å
197	A	67.6	Low	66.4	Low	42 Å²	42	82.2 Å²	82.2	35%	0.347	42%	0.42	S	S	.	.	H	α-helix	trans	-73.9	-37.2	177.6	0	0	0	0	0	112.7	H193 D194 K200	H193-A197 WeakPolarHBondContact O-CB 3.41Å; H193-A197 PolarHBondContact O-N 2.57Å; D194-A197 PolarHBondContact O-N 2.87Å; A197-K200 VanDerWaalsContact O-CB 3.23Å; A197-K200 WeakPolarHBondContact O-CB 3.15Å; A197-K200 PolarHBondContact O-N 3.21Å
198	T	62.8	Low	65.7	Low	80 Å²	80	83.6 Å²	83.6	49%	0.491	42%	0.415	S	S	.	.	H	α-helix	trans	-78.3	-30.1	-175.5	-51.9	0	0	0	0	112.4	D194 T195 K200 K201	D194-T198 WeakPolarHBondContact O-CB 3.24Å; D194-T198 PolarHBondContact O-N 2.95Å; D194-T198 PolarHBondContact O-OG1 3.26Å; T195-T198 PolarHBondContact O-N 2.84Å; T198-K200 PolarHBondContact O-N 2.86Å; T198-K201 PolarHBondContact O-N 3.03Å
199	E	55.6	Low	64.8	Low	108 Å²	108	84.2 Å²	84.2	51%	0.505	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-8.4	169.7	-87.7	-166	104	0	0	113.3	R162 T195	R162-E199 PolarHBondContact NH1-O 3.48Å; T195-E199 PolarHBondContact O-N 3.48Å
200	K	50.4	Low	64	Low	104 Å²	104	89.8 Å²	89.8	45%	0.452	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-18.1	170.8	-145.8	179.3	-173	-179.2	0	112.6	H132 D155 A197 T198	H132-K200 PolarHBondContact CE1-NZ 3.24Å; H132-K200 PolarHBondContact NE2-NZ 3.47Å; H132-K200 VanDerWaalsContact NE2-NZ 3.12Å; D155-K200 WeakPolarHBondContact OD2-CE 3.26Å; D155-K200 IonicContact OD2-NZ 3.96Å; D155-K200 PolarHBondContact OD2-NZ 3.28Å; A197-K200 VanDerWaalsContact O-CB 3.23Å; A197-K200 WeakPolarHBondContact O-CB 3.15Å; A197-K200 PolarHBondContact O-N 3.21Å; T198-K200 PolarHBondContact O-N 2.86Å
201	K	44	Very low	63.1	Low	185 Å²	185	95.5 Å²	95.5	80%	0.804	48%	0.477	S	S	*	.	S	Bend	trans	-93.3	-11.8	-177	-76	-171.3	176.7	178.4	0	115.3	T198	T198-K201 PolarHBondContact O-N 3.03Å
202	T	36.6	Very low	61.5	Low	127 Å²	127	91.5 Å²	91.5	78%	0.779	47%	0.465	S	S	*	.			trans	-101.9	19.8	-174	-35.6	0	0	0	0	113.6
203	K	33.6	Very low	59.9	Low	257 Å²	257	98.3 Å²	98.3	100%	1.117	50%	0.499	S	S	*	.			trans	-130.2	0	174	-123.1	-172.5	-177.6	-173.7	0	112.3

Retrieved 203 of 203 residues in 99.2 ms (Link to these results)

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