A0A077YZU0_TRITR Loading...

protein-tyrosine-phosphatase

AlphaFold DB , UniProt , Accession A0A077YZU0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 654 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.3	Very low	33.7	Very low	224 Å²	224	157 Å²	157	100%	1.103	85%	0.853	S	S	*	*				0	142.3	0	-65.1	165.5	172.4	0	0	107.4
2	S	34.3	Very low	33.8	Very low	125 Å²	125	155.6 Å²	155.6	87%	0.874	85%	0.853	S	S	*	*			trans	-118.3	114.1	173.5	-59.8	0	0	0	0	108.3
3	V	35.5	Very low	34	Very low	132 Å²	132	151.5 Å²	151.5	80%	0.8	84%	0.843	S	S	*	*			trans	-81.3	129	175.3	-177.9	0	0	0	0	108.1	T5	V3-T5 PolarHBondContact O-N 3.5Å
4	P	33.4	Very low	33.9	Very low	111 Å²	111	149.9 Å²	149.9	72%	0.721	84%	0.839	S	S	*	*			trans	-73.9	116.9	-179.7	28.9	-33.6	0	0	0	110.9	R6	P4-R6 PolarHBondContact O-N 3.47Å; P4-R6 VanDerWaalsContact O-N 3.07Å
5	T	34.1	Very low	34.5	Very low	138 Å²	138	153.1 Å²	153.1	85%	0.847	85%	0.845	S	S	*	*			trans	-65.6	103.7	170.4	46.6	0	0	0	0	110.1	V3 F7	V3-T5 PolarHBondContact O-N 3.5Å; T5-F7 PolarHBondContact O-N 3.25Å
6	R	34.7	Very low	34.9	Very low	236 Å²	236	154.3 Å²	154.3	89%	0.891	85%	0.849	S	S	*	*			trans	-71.3	121	167	-78.4	-174.2	176.7	166.2	0.8	109.3	P4 C8	P4-R6 PolarHBondContact O-N 3.47Å; P4-R6 VanDerWaalsContact O-N 3.07Å; R6-C8 PolarHBondContact O-N 3.27Å
7	F	32.6	Very low	35.2	Very low	201 Å²	201	149.6 Å²	149.6	88%	0.882	85%	0.846	S	S	*	*			trans	-77.5	111	168	-132.2	-93.3	0	0	0	108.5	T5 R9	T5-F7 PolarHBondContact O-N 3.25Å; F7-R9 PolarHBondContact O-N 3.47Å
8	C	32.2	Very low	35.4	Very low	115 Å²	115	150.8 Å²	150.8	78%	0.777	85%	0.849	S	S	*	*			trans	-81	111.7	168.6	-68	0	0	0	0	108.4	R6 G10	R6-C8 PolarHBondContact O-N 3.27Å; C8-G10 PolarHBondContact O-N 3.02Å
9	R	34	Very low	36	Very low	233 Å²	233	150.4 Å²	150.4	88%	0.879	85%	0.85	S	S	*	*			trans	-64.4	128.3	162.3	-79.7	-173.5	172.5	-171.9	-2.9	107.9	F7	F7-R9 PolarHBondContact O-N 3.47Å
10	G	31.7	Very low	36.2	Very low	76 Å²	76	150 Å²	150	78%	0.784	85%	0.846	S	S	*	*			trans	-63.7	143.3	163.4	0	0	0	0	0	109.6	C8	C8-G10 PolarHBondContact O-N 3.02Å
11	V	32.3	Very low	36.5	Very low	136 Å²	136	151.1 Å²	151.1	82%	0.824	84%	0.841	S	S	*	*			trans	-115.8	111.1	171.9	-178	0	0	0	0	106.6
12	T	35.7	Very low	36.9	Very low	140 Å²	140	147.1 Å²	147.1	86%	0.859	83%	0.825	S	S	*	*			trans	-91.6	134.2	168	45.2	0	0	0	0	108.6
13	S	35.6	Very low	37.3	Very low	103 Å²	103	149.2 Å²	149.2	72%	0.72	83%	0.826	S	S	*	*			trans	-82.5	138.7	-171.5	-51.2	0	0	0	0	112.9
14	T	32.6	Very low	37.7	Very low	129 Å²	129	147 Å²	147	79%	0.791	82%	0.821	S	S	*	*			trans	40.8	104.3	140.3	57.9	0	0	0	0	119.1
15	E	42.8	Very low	37.9	Very low	198 Å²	198	150.4 Å²	150.4	93%	0.925	83%	0.827	S	S	*	*			trans	-131.6	155.9	134.4	-69	-168.2	123.8	0	0	107.8
16	D	40.8	Very low	38	Very low	171 Å²	171	149 Å²	149	91%	0.914	82%	0.824	S	S	*	*			trans	-87.5	158.4	-162	-54	-85.4	0	0	0	115.2
17	G	40.5	Very low	38.1	Very low	76 Å²	76	143.3 Å²	143.3	78%	0.784	82%	0.815	S	S	*	*			trans	164.5	104.3	169.9	0	0	0	0	0	114.9
18	D	39.4	Very low	38.3	Very low	170 Å²	170	139 Å²	139	91%	0.909	81%	0.81	S	S	*	*			trans	-73.6	146.8	169.3	-65.4	-66.2	0	0	0	112.4
19	V	45.8	Very low	38.4	Very low	144 Å²	144	144.6 Å²	144.6	87%	0.873	82%	0.815	S	S	*	*			trans	-174.2	141.3	137.8	140.9	0	0	0	0	109.3
20	D	41.2	Very low	38.7	Very low	141 Å²	141	137.7 Å²	137.7	75%	0.754	81%	0.808	S	S	*	*			trans	-81.9	172.5	-173	-58.3	-75.2	0	0	0	116.1
21	K	42.9	Very low	39.1	Very low	174 Å²	174	139.9 Å²	139.9	76%	0.757	81%	0.808	S	S	*	*			trans	94.6	114.6	152.1	-71.6	160.7	-176.2	165.8	0	119.4
22	D	42.9	Very low	39.5	Very low	141 Å²	141	142 Å²	142	75%	0.754	81%	0.814	S	S	*	*				38.4	112.4	115.8	-44	-29.1	0	0	0	117.8
23	D	42.9	Very low	39.9	Very low	169 Å²	169	139.5 Å²	139.5	90%	0.904	81%	0.807	S	S	*	*				-166.3	176.9	111.5	-117.4	-34.8	0	0	0	114.5
24	A	44	Very low	39.9	Very low	84 Å²	84	139 Å²	139	69%	0.694	80%	0.804	S	S	*	*			trans	-72	145	-159.6	0	0	0	0	0	119
25	E	37	Very low	40.3	Very low	183 Å²	183	141.5 Å²	141.5	86%	0.855	81%	0.811	S	S	*	*			trans	17.3	106.2	135.6	-169.1	172.9	-173.7	0	0	119
26	S	36.5	Very low	40.5	Very low	110 Å²	110	135.8 Å²	135.8	77%	0.769	79%	0.793	S	S	*	*			trans	-143.2	122.6	149.5	59.2	0	0	0	0	111.7	S28	S26-S28 PolarHBondContact O-N 3.31Å
27	T	36	Very low	41.1	Very low	115 Å²	115	135.4 Å²	135.4	71%	0.706	79%	0.786	S	S	*	*			trans	-90.3	89.6	-178	-62.3	0	0	0	0	110.4
28	S	36.8	Very low	41	Very low	110 Å²	110	136.6 Å²	136.6	77%	0.769	78%	0.78	S	S	*	*			trans	-81.8	125.2	174.3	58.2	0	0	0	0	111.6	S26 A30	S26-S28 PolarHBondContact O-N 3.31Å; S28-A30 PolarHBondContact O-N 3.27Å
29	W	35.9	Very low	41.2	Very low	233 Å²	233	134.5 Å²	134.5	88%	0.883	78%	0.777	S	S	*	*			trans	-83.8	97.6	-178.7	-76.3	54.6	0	0	0	110.5
30	A	39.8	Very low	41.3	Very low	89 Å²	89	134 Å²	134	74%	0.736	77%	0.769	S	S	*	*			trans	-61.5	129.7	169.4	0	0	0	0	0	110.4	S28	S28-A30 PolarHBondContact O-N 3.27Å
31	P	39.2	Very low	41.3	Very low	121 Å²	121	132.3 Å²	132.3	79%	0.786	77%	0.766	S	S	*	*			trans	-59.5	144.9	-179.9	-25.5	34.6	0	0	0	112.9	A33	P31-A33 VanDerWaalsContact C-N 3.3Å; P31-A33 PolarHBondContact O-N 3.17Å
32	L	42.2	Very low	41.6	Very low	182 Å²	182	129.5 Å²	129.5	95%	0.953	76%	0.763	S	S	*	*			trans	-68.6	85.7	174.5	-73.6	172.9	0	0	0	110.9
33	A	42.8	Very low	41.7	Very low	86 Å²	86	126.5 Å²	126.5	71%	0.711	75%	0.753	S	S	*	*			trans	-55.5	137.4	171	0	0	0	0	0	110.7	P31 L35	P31-A33 VanDerWaalsContact C-N 3.3Å; P31-A33 PolarHBondContact O-N 3.17Å; A33-L35 PolarHBondContact O-N 3.43Å
34	S	35.3	Very low	42.2	Very low	93 Å²	93	124 Å²	124	65%	0.65	74%	0.74	S	S	*	*			trans	-53.1	121.3	-174.8	171.8	0	0	0	0	112.4	S36	S34-S36 PolarHBondContact O-N 2.81Å; S34-S36 PolarHBondContact O-OG 2.73Å; S34-S36 PolarHBondContact OG-N 3.06Å; S34-S36 PolarHBondContact OG-OG 3.39Å
35	L	42.6	Very low	43.7	Very low	182 Å²	182	127 Å²	127	95%	0.953	74%	0.743	S	S	*	*			trans	-74.5	38.7	168.1	-69.4	174	0	0	0	112.7	A33	A33-L35 PolarHBondContact O-N 3.43Å
36	S	46.8	Very low	46.3	Very low	78 Å²	78	118.6 Å²	118.6	55%	0.545	71%	0.705	S	S	.	*	P	Polyproline II helix	trans	-63.1	123.7	149.4	37.1	0	0	0	0	107.5	S34	S34-S36 PolarHBondContact O-N 2.81Å; S34-S36 PolarHBondContact O-OG 2.73Å; S34-S36 PolarHBondContact OG-N 3.06Å; S34-S36 PolarHBondContact OG-OG 3.39Å
37	Q	53.8	Low	49.2	Very low	162 Å²	162	113.6 Å²	113.6	76%	0.757	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-52.5	129.8	179.8	-63.9	176.6	-102.5	0	0	109.3	C39	Q37-C39 PolarHBondContact O-N 2.56Å
38	P	38	Very low	52.1	Low	101 Å²	101	109.5 Å²	109.5	66%	0.656	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-58.4	128.7	163.6	26.5	-32.1	0	0	0	106.7	L40	P38-L40 PolarHBondContact O-N 3.23Å
39	C	43.4	Very low	55	Low	127 Å²	127	108.7 Å²	108.7	86%	0.858	63%	0.628	S	S	*	*			trans	-60.3	95.4	159.8	-64.8	0	0	0	0	105.4	Q37 P41	Q37-C39 PolarHBondContact O-N 2.56Å; C39-P41 VanDerWaalsContact O-N 3.1Å
40	L	48.1	Very low	57.9	Low	133 Å²	133	97.6 Å²	97.6	70%	0.696	59%	0.586	S	S	*	*			trans	-50.7	124.3	174.5	-71.6	176.5	0	0	0	105.8	P38 V42	P38-L40 PolarHBondContact O-N 3.23Å; L40-V42 PolarHBondContact O-N 3.45Å
41	P	39.8	Very low	60.6	Low	106 Å²	106	93.9 Å²	93.9	69%	0.688	55%	0.553	S	S	*	*			trans	-54	132.5	-177.5	22.1	-32.6	0	0	0	107.2	C39 S43	C39-P41 VanDerWaalsContact O-N 3.1Å; P41-S43 PolarHBondContact O-N 3.47Å; P41-S43 PolarHBondContact O-OG 3.24Å
42	V	50.4	Low	63.1	Low	115 Å²	115	90.6 Å²	90.6	70%	0.697	53%	0.532	S	S	*	.			trans	-74.5	70.3	172.1	-173.2	0	0	0	0	106.5	L40 N44	L40-V42 PolarHBondContact O-N 3.45Å; V42-N44 PolarHBondContact O-N 3.42Å; V42-N44 VanDerWaalsContact O-N 3.11Å
43	S	44.7	Very low	65.5	Low	77 Å²	77	82.1 Å²	82.1	54%	0.538	49%	0.488	S	S	.	.			trans	-61.4	111.5	166.5	44.4	0	0	0	0	106	P41 L45	P41-S43 PolarHBondContact O-N 3.47Å; P41-S43 PolarHBondContact O-OG 3.24Å; S43-L45 WeakPolarHBondContact O-CD1 3.4Å; S43-L45 PolarHBondContact O-N 2.92Å; S43-L45 WeakPolarHBondContact OG-CD1 3.24Å
44	N	53.7	Low	68.1	Low	118 Å²	118	78 Å²	78	63%	0.631	45%	0.454	S	S	*	.			trans	-71	76.4	-179.1	-69.4	-31.1	0	0	0	109.1	V42 G46	V42-N44 PolarHBondContact O-N 3.42Å; V42-N44 VanDerWaalsContact O-N 3.11Å; N44-G46 PolarHBondContact O-N 2.85Å
45	L	75.8	Confident	71.1	Confident	146 Å²	146	74.3 Å²	74.3	76%	0.764	43%	0.426	S	S	*	.			trans	-72.3	33.9	170.5	-87.7	70.7	0	0	0	111.4	S43	S43-L45 WeakPolarHBondContact O-CD1 3.4Å; S43-L45 PolarHBondContact O-N 2.92Å; S43-L45 WeakPolarHBondContact OG-CD1 3.24Å
46	G	91	Very high	73.7	Confident	6 Å²	6	65.7 Å²	65.7	6%	0.062	38%	0.38	C	S	.	.			trans	59.9	-158.7	178.8	0	0	0	0	0	116	N44 T48 D61 R171	N44-G46 PolarHBondContact O-N 2.85Å; G46-T48 PolarHBondContact O-N 3.07Å; G46-D61 VanDerWaalsContact CA-OD1 3.23Å; G46-D61 WeakPolarHBondContact CA-OD1 3.29Å; G46-R171 PolarHBondContact O-NH1 3.35Å
47	P	96.7	Very high	76.1	Confident	5 Å²	5	62 Å²	62	3%	0.032	35%	0.354	C	S	.	.	S	Bend	trans	-72.2	128.3	176.8	30.9	-34.8	0	0	0	110.7	Y55 L56 D61 L67 I73 L134	P47-Y55 HydrophobicContact CB-CD1 4.23Å; P47-Y55 HydrophobicContact CG-CD1 4.21Å; P47-Y55 WeakPolarHBondContact O-CD1 3.46Å; P47-L56 CarbonylContact C-O 3.59Å; P47-D61 HydrophobicContact CB-CB 4.11Å; P47-D61 HydrophobicContact CG-CB 4.48Å; P47-L67 HydrophobicContact CG-CG 4.43Å; P47-I73 HydrophobicContact CG-CD1 3.93Å; P47-L134 HydrophobicContact CB-CD1 3.69Å
48	T	97.7	Very high	78.2	Confident	30 Å²	30	54.5 Å²	54.5	18%	0.184	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	126.1	-175.9	-47.4	0	0	0	0	111.2	G46 I50 Y55 L56 K170 R171	G46-T48 PolarHBondContact O-N 3.07Å; T48-I50 HydrophobicContact CG2-CD1 3.96Å; T48-I50 PolarHBondContact O-N 3.42Å; T48-Y55 CarbonylContact O-C 3.56Å; T48-Y55 WeakPolarHBondContact O-CA 3.39Å; T48-L56 PolarHBondContact N-O 2.87Å; T48-L56 PolarHBondContact O-N 3.4Å; T48-K170 HydrophobicContact CG2-CB 4.11Å; T48-K170 WeakPolarHBondContact CG2-O 3.37Å; T48-R171 HydrophobicContact CG2-CB 4.09Å; T48-R171 WeakPolarHBondContact OG1-CD 3.42Å; T48-R171 PolarHBondContact OG1-NH1 3.41Å
49	K	97.3	Very high	81	Confident	92 Å²	92	52.1 Å²	52.1	40%	0.4	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	110.8	177.3	-168.1	172.9	-168.8	136.9	0	112.3	L51 P52 Y55 K170	K49-L51 WeakPolarHBondContact CG-O 3.35Å; K49-P52 WeakPolarHBondContact CE-O 3.28Å; K49-P52 PolarHBondContact NZ-O 3.04Å; K49-Y55 HydrophobicContact CB-CD1 4.09Å; K49-Y55 HydrophobicContact CB-CE1 3.76Å; K49-Y55 HydrophobicContact CD-CE1 4.32Å; K49-Y55 HydrophobicContact CD-CE2 4.2Å; K49-Y55 WeakPolarHBondContact CD-OH 3.45Å; K49-Y55 HydrophobicContact CG-CE1 4.06Å; K49-Y55 HydrophobicContact CG-CE2 4.01Å; K49-Y55 PolarHBondContact NZ-OH 3.45Å; K49-Y55 VanDerWaalsContact NZ-OH 3.1Å; K49-K170 PolarHBondContact O-NZ 2.96Å
50	I	97.7	Very high	83.5	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-57.9	-176.9	-53.1	-53.5	0	0	0	111.2	T48 L54 L56 V148 V152 Y166 V167 K170	T48-I50 HydrophobicContact CG2-CD1 3.96Å; T48-I50 PolarHBondContact O-N 3.42Å; I50-L54 PolarHBondContact N-O 2.82Å; I50-L56 HydrophobicContact CD1-CB 4.16Å; I50-L56 HydrophobicContact CD1-CD2 4.23Å; I50-L56 HydrophobicContact CG1-CB 3.66Å; I50-L56 HydrophobicContact CG1-CD2 4.31Å; I50-V148 HydrophobicContact CB-CG1 4.18Å; I50-V148 HydrophobicContact CG1-CG1 3.93Å; I50-V148 HydrophobicContact CG2-CG1 3.82Å; I50-V152 HydrophobicContact CG2-CG2 3.91Å; I50-Y166 HydrophobicContact CG2-CD1 4.37Å; I50-Y166 HydrophobicContact CG2-CE1 3.95Å; I50-Y166 PolarHBondContact O-OH 3.01Å; I50-V167 HydrophobicContact CD1-CG1 4.1Å; I50-V167 HydrophobicContact CG2-CG2 4.08Å; I50-K170 HydrophobicContact CD1-CB 3.9Å; I50-K170 HydrophobicContact CD1-CD 3.9Å; I50-K170 HydrophobicContact CG2-CD 4.37Å; I50-K170 WeakPolarHBondContact O-CE 3.43Å; I50-K170 PolarHBondContact O-NZ 3.24Å; I50-K170 VanDerWaalsContact O-NZ 3.16Å
51	L	94.9	Very high	85.8	Confident	10 Å²	10	45.3 Å²	45.3	5%	0.052	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	169.8	171.2	-54.7	175	0	0	0	109.3	K49 F53 L54 V152 Y155 L156 Y166	K49-L51 WeakPolarHBondContact CG-O 3.35Å; L51-F53 HydrophobicContact CB-CD1 4.12Å; L51-F53 HydrophobicContact CB-CE1 3.8Å; L51-F53 HydrophobicContact CB-CZ 4.11Å; L51-F53 HydrophobicContact CD1-CE1 3.95Å; L51-F53 HydrophobicContact CD1-CE2 4.28Å; L51-F53 HydrophobicContact CD1-CZ 3.55Å; L51-F53 HydrophobicContact CG-CZ 4.49Å; L51-F53 PolarHBondContact O-N 3Å; L51-L54 HydrophobicContact CB-CB 3.95Å; L51-L54 HydrophobicContact CD1-CD2 4.05Å; L51-L54 HydrophobicContact CG-CB 4.39Å; L51-L54 HydrophobicContact CG-CD2 4.33Å; L51-L54 PolarHBondContact N-O 3.49Å; L51-L54 VanDerWaalsContact N-O 3.15Å; L51-L54 PolarHBondContact O-N 3.31Å; L51-L54 VanDerWaalsContact O-N 3.12Å; L51-V152 HydrophobicContact CD2-CG2 4.49Å; L51-Y155 HydrophobicContact CD1-CD2 4.44Å; L51-L156 HydrophobicContact CD2-CD1 4.09Å; L51-L156 HydrophobicContact CD2-CD2 4.48Å; L51-L156 HydrophobicContact CD2-CG 4.4Å; L51-Y166 HydrophobicContact CD2-CE1 4.15Å
52	P	92.5	Very high	88.5	Confident	53 Å²	53	40.2 Å²	40.2	34%	0.344	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-21.8	-178.3	-31	39.7	0	0	0	115.6	K49 N132 F211	K49-P52 WeakPolarHBondContact CE-O 3.28Å; K49-P52 PolarHBondContact NZ-O 3.04Å; P52-N132 PolarHBondContact O-OD1 2.91Å; P52-N132 VanDerWaalsContact O-OD1 3.1Å; P52-F211 HydrophobicContact CB-CE1 4.15Å; P52-F211 HydrophobicContact CB-CZ 4.27Å; P52-F211 HydrophobicContact CG-CD1 3.96Å; P52-F211 HydrophobicContact CG-CE1 3.68Å; P52-F211 HydrophobicContact CG-CZ 4.08Å
53	F	93	Very high	90.7	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.018	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-10.5	-179.6	59	-87.2	0	0	0	114.7	L51 I118 L122 K125 N132 V133 Y155	L51-F53 HydrophobicContact CB-CD1 4.12Å; L51-F53 HydrophobicContact CB-CE1 3.8Å; L51-F53 HydrophobicContact CB-CZ 4.11Å; L51-F53 HydrophobicContact CD1-CE1 3.95Å; L51-F53 HydrophobicContact CD1-CE2 4.28Å; L51-F53 HydrophobicContact CD1-CZ 3.55Å; L51-F53 HydrophobicContact CG-CZ 4.49Å; L51-F53 PolarHBondContact O-N 3Å; F53-I118 HydrophobicContact CD2-CG2 4.26Å; F53-I118 HydrophobicContact CE2-CG2 3.66Å; F53-L122 HydrophobicContact CD1-CD1 3.68Å; F53-L122 HydrophobicContact CD2-CB 4.46Å; F53-L122 HydrophobicContact CE1-CD1 3.9Å; F53-L122 HydrophobicContact CE1-CD2 4.19Å; F53-L122 HydrophobicContact CG-CD1 4.08Å; F53-L122 HydrophobicContact CZ-CD1 4.47Å; F53-L122 HydrophobicContact CZ-CD2 4.13Å; F53-K125 HydrophobicContact CB-CD 3.5Å; F53-K125 VanDerWaalsContact CB-CD 3.5Å; F53-N132 WeakPolarHBondContact CA-OD1 3.42Å; F53-N132 WeakPolarHBondContact O-CA 3.47Å; F53-V133 PolarHBondContact O-N 3.24Å; F53-Y155 HydrophobicContact CZ-CD2 4.4Å; F53-Y155 HydrophobicContact CZ-CE2 4.42Å
54	L	96.7	Very high	93.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	120.7	-165.6	177.5	62.1	0	0	0	111.4	I50 L51 V133 V135 V148 C151	I50-L54 PolarHBondContact N-O 2.82Å; L51-L54 HydrophobicContact CB-CB 3.95Å; L51-L54 HydrophobicContact CD1-CD2 4.05Å; L51-L54 HydrophobicContact CG-CB 4.39Å; L51-L54 HydrophobicContact CG-CD2 4.33Å; L51-L54 PolarHBondContact N-O 3.49Å; L51-L54 VanDerWaalsContact N-O 3.15Å; L51-L54 PolarHBondContact O-N 3.31Å; L51-L54 VanDerWaalsContact O-N 3.12Å; L54-V133 HydrophobicContact CD1-CG1 3.89Å; L54-V135 HydrophobicContact CD1-CB 4.39Å; L54-V135 HydrophobicContact CD1-CG2 3.57Å; L54-V148 HydrophobicContact CD2-CG1 4.33Å; L54-C151 HydrophobicContact CD2-CB 4.04Å
55	Y	97.9	Very high	95.2	Very high	15 Å²	15	36.3 Å²	36.3	6%	0.059	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	151.7	177.8	-73.7	-109.4	0	0	0	111	P47 T48 K49 H71 I73 N132 V133 V135	P47-Y55 HydrophobicContact CB-CD1 4.23Å; P47-Y55 HydrophobicContact CG-CD1 4.21Å; P47-Y55 WeakPolarHBondContact O-CD1 3.46Å; T48-Y55 CarbonylContact O-C 3.56Å; T48-Y55 WeakPolarHBondContact O-CA 3.39Å; K49-Y55 HydrophobicContact CB-CD1 4.09Å; K49-Y55 HydrophobicContact CB-CE1 3.76Å; K49-Y55 HydrophobicContact CD-CE1 4.32Å; K49-Y55 HydrophobicContact CD-CE2 4.2Å; K49-Y55 WeakPolarHBondContact CD-OH 3.45Å; K49-Y55 HydrophobicContact CG-CE1 4.06Å; K49-Y55 HydrophobicContact CG-CE2 4.01Å; K49-Y55 PolarHBondContact NZ-OH 3.45Å; K49-Y55 VanDerWaalsContact NZ-OH 3.1Å; Y55-H71 HydrophobicContact CD1-CB 4.49Å; Y55-H71 HydrophobicContact CE1-CB 3.84Å; Y55-H71 AromaticContact CE1-CG 3.74Å; Y55-I73 HydrophobicContact CD1-CD1 4.08Å; Y55-I73 HydrophobicContact CD2-CD1 4.38Å; Y55-I73 HydrophobicContact CD2-CG1 4.31Å; Y55-I73 HydrophobicContact CG-CD1 3.97Å; Y55-I73 HydrophobicContact CG-CG1 4.4Å; Y55-N132 HydrophobicContact CD2-CB 3.96Å; Y55-N132 HydrophobicContact CE2-CB 3.85Å; Y55-V133 PolarHBondContact N-O 2.91Å; Y55-V135 PolarHBondContact O-N 2.96Å
56	L	98.3	Very high	96.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	123.4	-177.4	168.5	59.9	0	0	0	111	P47 T48 I50 V135 P145 V148 V167 R171 I174	P47-L56 CarbonylContact C-O 3.59Å; T48-L56 PolarHBondContact N-O 2.87Å; T48-L56 PolarHBondContact O-N 3.4Å; I50-L56 HydrophobicContact CD1-CB 4.16Å; I50-L56 HydrophobicContact CD1-CD2 4.23Å; I50-L56 HydrophobicContact CG1-CB 3.66Å; I50-L56 HydrophobicContact CG1-CD2 4.31Å; L56-V135 WeakPolarHBondContact CA-O 3.43Å; L56-P145 HydrophobicContact CD1-CG 3.89Å; L56-P145 HydrophobicContact CD2-CB 4.35Å; L56-P145 HydrophobicContact CD2-CG 4.07Å; L56-V148 HydrophobicContact CB-CG2 4.33Å; L56-V148 HydrophobicContact CD1-CG2 4.03Å; L56-V148 HydrophobicContact CD2-CG1 4.27Å; L56-V167 HydrophobicContact CD2-CG1 3.58Å; L56-R171 HydrophobicContact CD2-CB 4.47Å; L56-R171 PolarHBondContact O-NH1 2.99Å; L56-I174 HydrophobicContact CD2-CG2 4.07Å
57	G	97.6	Very high	96.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	-170	-175.9	0	0	0	0	0	116.8	D61 V135 H136 C137 G140 S144	G57-D61 WeakPolarHBondContact CA-OD2 3.36Å; G57-V135 PolarHBondContact N-O 3.02Å; G57-V135 VanDerWaalsContact N-O 3.13Å; G57-H136 VanDerWaalsContact O-CA 3.29Å; G57-H136 WeakPolarHBondContact O-CA 3.49Å; G57-H136 WeakPolarHBondContact O-CB 3.17Å; G57-C137 PolarHBondContact O-N 3.19Å; G57-G140 WeakPolarHBondContact O-CA 3.38Å; G57-S144 PolarHBondContact O-OG 3.19Å
58	S	97	Very high	96.2	Very high	5 Å²	5	35.6 Å²	35.6	4%	0.035	18%	0.18	C	C	.	.			trans	-103	-174.7	-179.5	63.8	0	0	0	0	111.8	Q60 D61 H136 C137	S58-Q60 VanDerWaalsContact C-N 3.35Å; S58-Q60 PolarHBondContact OG-N 2.9Å; S58-Q60 PolarHBondContact OG-OE1 3.17Å; S58-D61 WeakPolarHBondContact CB-OD2 3.44Å; S58-D61 PolarHBondContact N-OD2 2.7Å; S58-D61 PolarHBondContact OG-N 3.41Å; S58-D61 PolarHBondContact OG-OD2 2.78Å; S58-H136 WeakPolarHBondContact O-CB 3.38Å; S58-H136 PolarHBondContact O-ND1 3.43Å; S58-C137 CarbonylContact C-O 3.52Å; S58-C137 VanDerWaalsContact CA-O 3.25Å; S58-C137 WeakPolarHBondContact CA-O 3.44Å
59	Q	97.1	Very high	96.1	Very high	52 Å²	52	39.6 Å²	39.6	24%	0.243	19%	0.194	C	C	.	.	S	Bend	trans	-69.3	-36.7	170.4	176.8	177.7	-40.6	0	0	111.1	A62 M63 S83 C137 L138	Q59-A62 PolarHBondContact O-N 2.58Å; Q59-M63 HydrophobicContact CG-CG 4.25Å; Q59-M63 WeakPolarHBondContact O-CG 3.34Å; Q59-M63 PolarHBondContact O-N 3.12Å; Q59-M63 VanDerWaalsContact O-N 3.16Å; Q59-S83 PolarHBondContact OE1-OG 3.43Å; Q59-C137 PolarHBondContact N-O 3.35Å; Q59-L138 HydrophobicContact CB-CD1 4.33Å; Q59-L138 PolarHBondContact N-O 2.72Å; Q59-L138 VanDerWaalsContact OE1-CD1 3.3Å
60	Q	96	Very high	96	Very high	112 Å²	112	40.6 Å²	40.6	52%	0.523	21%	0.208	S	C	.	.	H	α-helix	trans	-60	-50.5	178.6	-66.8	75.9	3.4	0	0	110.1	S58 A62 M63 D64 L138	S58-Q60 VanDerWaalsContact C-N 3.35Å; S58-Q60 PolarHBondContact OG-N 2.9Å; S58-Q60 PolarHBondContact OG-OE1 3.17Å; Q60-A62 PolarHBondContact O-N 2.92Å; Q60-M63 PolarHBondContact O-N 2.87Å; Q60-M63 VanDerWaalsContact O-N 3.12Å; Q60-D64 PolarHBondContact O-N 3.46Å; Q60-L138 PolarHBondContact OE1-O 3.4Å
61	D	96.8	Very high	95.8	Very high	4 Å²	4	43 Å²	43	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-58.5	-22.4	178.3	-56.2	-45.1	0	0	0	113.6	G46 P47 G57 S58 L68 L134 R171	G46-D61 VanDerWaalsContact CA-OD1 3.23Å; G46-D61 WeakPolarHBondContact CA-OD1 3.29Å; P47-D61 HydrophobicContact CB-CB 4.11Å; P47-D61 HydrophobicContact CG-CB 4.48Å; G57-D61 WeakPolarHBondContact CA-OD2 3.36Å; S58-D61 WeakPolarHBondContact CB-OD2 3.44Å; S58-D61 PolarHBondContact N-OD2 2.7Å; S58-D61 PolarHBondContact OG-N 3.41Å; S58-D61 PolarHBondContact OG-OD2 2.78Å; D61-L68 WeakPolarHBondContact O-CD2 3.28Å; D61-L134 HydrophobicContact CB-CD2 4.49Å; D61-R171 IonicContact OD2-NH2 3.9Å
62	A	96.9	Very high	95.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-96.9	-16.9	-178.2	0	0	0	0	0	114	Q59 Q60 V76 P86 L134 H136	Q59-A62 PolarHBondContact O-N 2.58Å; Q60-A62 PolarHBondContact O-N 2.92Å; A62-V76 HydrophobicContact CB-CG1 4.31Å; A62-P86 WeakPolarHBondContact O-CG 3.32Å; A62-L134 HydrophobicContact CB-CD2 3.82Å; A62-H136 HydrophobicContact CB-CB 4.49Å; A62-H136 VanDerWaalsContact CB-CE1 3.49Å; A62-H136 WeakPolarHBondContact CB-CE1 3.28Å; A62-H136 WeakPolarHBondContact CB-ND1 3.37Å
63	M	96.1	Very high	95.9	Very high	72 Å²	72	47.7 Å²	47.7	36%	0.355	23%	0.23	S	C	.	.	H	α-helix	trans	-96.8	-10.7	178.5	-65.5	-59.7	-58.6	0	0	112.9	Q59 Q60 E65 P84 P86	Q59-M63 HydrophobicContact CG-CG 4.25Å; Q59-M63 WeakPolarHBondContact O-CG 3.34Å; Q59-M63 PolarHBondContact O-N 3.12Å; Q59-M63 VanDerWaalsContact O-N 3.16Å; Q60-M63 PolarHBondContact O-N 2.87Å; Q60-M63 VanDerWaalsContact O-N 3.12Å; M63-E65 PolarHBondContact O-N 3.49Å; M63-P84 HydrophobicContact CE-CG 4.27Å; M63-P84 HydrophobicContact SD-CG 3.9Å; M63-P86 HydrophobicContact CE-CB 4.5Å; M63-P86 HydrophobicContact SD-CB 4.13Å; M63-P86 HydrophobicContact SD-CG 3.98Å
64	D	95.9	Very high	95.9	Very high	76 Å²	76	50.8 Å²	50.8	41%	0.406	25%	0.246	S	C	.	.			trans	-84.3	97.8	176.9	-173.6	-29.1	0	0	0	110.4	Q60 D66 L67 L68	Q60-D64 PolarHBondContact O-N 3.46Å; D64-D66 VanDerWaalsContact C-N 3.31Å; D64-D66 PolarHBondContact O-N 3.25Å; D64-D66 PolarHBondContact OD1-N 2.84Å; D64-L67 HydrophobicContact CB-CB 3.78Å; D64-L67 HydrophobicContact CB-CD2 4.06Å; D64-L67 PolarHBondContact O-N 3.27Å; D64-L67 VanDerWaalsContact OD1-CB 3.28Å; D64-L67 WeakPolarHBondContact OD1-CB 3.2Å; D64-L67 PolarHBondContact OD1-N 2.95Å; D64-L68 WeakPolarHBondContact O-CG 3.38Å; D64-L68 PolarHBondContact O-N 3.16Å; D64-L68 VanDerWaalsContact O-N 3.12Å
65	E	96.1	Very high	95.9	Very high	80 Å²	80	52.4 Å²	52.4	37%	0.374	25%	0.253	S	S	.	.	H	α-helix	trans	-60.3	-39.1	-175.6	-163.6	-175.9	133.9	0	0	112.7	M63 L68 K69 F88	M63-E65 PolarHBondContact O-N 3.49Å; E65-L68 PolarHBondContact O-N 3.22Å; E65-K69 WeakPolarHBondContact O-CG 3.39Å; E65-K69 PolarHBondContact O-N 3.47Å; E65-K69 WeakPolarHBondContact OE1-CE 3.49Å; E65-K69 IonicContact OE1-NZ 2.62Å; E65-K69 PolarHBondContact OE1-NZ 3.24Å; E65-F88 HydrophobicContact CB-CD1 3.7Å; E65-F88 HydrophobicContact CB-CE1 3.51Å; E65-F88 HydrophobicContact CB-CE2 4.41Å; E65-F88 HydrophobicContact CB-CG 4.25Å; E65-F88 HydrophobicContact CB-CZ 3.89Å; E65-F88 HydrophobicContact CG-CB 4.18Å; E65-F88 HydrophobicContact CG-CD1 3.56Å; E65-F88 HydrophobicContact CG-CD2 3.82Å; E65-F88 HydrophobicContact CG-CE1 3.79Å; E65-F88 HydrophobicContact CG-CE2 4.05Å; E65-F88 HydrophobicContact CG-CG 3.58Å; E65-F88 HydrophobicContact CG-CZ 4.02Å; E65-F88 WeakPolarHBondContact OE2-CB 3.47Å; E65-F88 VanDerWaalsContact OE2-CD1 3.27Å; E65-F88 WeakPolarHBondContact OE2-CD1 3.42Å
66	D	95.6	Very high	95.8	Very high	99 Å²	99	51.8 Å²	51.8	53%	0.529	25%	0.251	S	S	.	.	H	α-helix	trans	-76.9	-35.4	-175.1	-66.8	-31	0	0	0	111.5	D64 L68 K69 V70	D64-D66 VanDerWaalsContact C-N 3.31Å; D64-D66 PolarHBondContact O-N 3.25Å; D64-D66 PolarHBondContact OD1-N 2.84Å; D66-L68 VanDerWaalsContact C-N 3.34Å; D66-L68 PolarHBondContact O-N 3.4Å; D66-K69 PolarHBondContact O-N 3.03Å; D66-K69 IonicContact OD1-NZ 3.48Å; D66-K69 PolarHBondContact OD1-NZ 3.1Å; D66-V70 WeakPolarHBondContact O-CB 3.42Å; D66-V70 VanDerWaalsContact O-CG2 3.26Å; D66-V70 WeakPolarHBondContact O-CG2 3.21Å; D66-V70 PolarHBondContact O-N 3.1Å
67	L	94.9	Very high	95.7	Very high	38 Å²	38	51.8 Å²	51.8	20%	0.199	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-39.1	170.1	-174.4	61.7	0	0	0	112.3	P47 D64 H71	P47-L67 HydrophobicContact CG-CG 4.43Å; D64-L67 HydrophobicContact CB-CB 3.78Å; D64-L67 HydrophobicContact CB-CD2 4.06Å; D64-L67 PolarHBondContact O-N 3.27Å; D64-L67 VanDerWaalsContact OD1-CB 3.28Å; D64-L67 WeakPolarHBondContact OD1-CB 3.2Å; D64-L67 PolarHBondContact OD1-N 2.95Å; L67-H71 PolarHBondContact O-CD2 3.17Å; L67-H71 VanDerWaalsContact O-CD2 3.3Å; L67-H71 PolarHBondContact O-N 2.87Å; L67-H71 VanDerWaalsContact O-N 3.15Å
68	L	95.5	Very high	95.7	Very high	5 Å²	5	51.8 Å²	51.8	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-67.5	-42.4	173.6	-64.6	-173.5	0	0	0	112	D61 D64 E65 D66 H71 R72 I73 V76 F88 L134	D61-L68 WeakPolarHBondContact O-CD2 3.28Å; D64-L68 WeakPolarHBondContact O-CG 3.38Å; D64-L68 PolarHBondContact O-N 3.16Å; D64-L68 VanDerWaalsContact O-N 3.12Å; E65-L68 PolarHBondContact O-N 3.22Å; D66-L68 VanDerWaalsContact C-N 3.34Å; D66-L68 PolarHBondContact O-N 3.4Å; L68-H71 CarbonylContact O-C 3.02Å; L68-H71 PolarHBondContact O-N 2.89Å; L68-R72 PolarHBondContact O-N 2.78Å; L68-I73 HydrophobicContact CB-CB 4.26Å; L68-I73 HydrophobicContact CD2-CB 3.88Å; L68-I73 HydrophobicContact CD2-CD1 3.67Å; L68-I73 HydrophobicContact CD2-CG1 4.38Å; L68-I73 HydrophobicContact CD2-CG2 3.89Å; L68-I73 PolarHBondContact O-N 3.29Å; L68-V76 HydrophobicContact CD1-CG2 4.27Å; L68-F88 HydrophobicContact CD1-CE2 3.79Å; L68-F88 HydrophobicContact CD1-CZ 3.87Å; L68-L134 HydrophobicContact CD2-CD2 3.72Å
69	K	94.6	Very high	95.7	Very high	113 Å²	113	51.6 Å²	51.6	49%	0.491	25%	0.249	S	C	.	.	H	α-helix	trans	-59.7	-48.7	173.4	-71.5	167.7	-168.2	147.7	0	112.1	E65 D66 H71 R72	E65-K69 WeakPolarHBondContact O-CG 3.39Å; E65-K69 PolarHBondContact O-N 3.47Å; E65-K69 WeakPolarHBondContact OE1-CE 3.49Å; E65-K69 IonicContact OE1-NZ 2.62Å; E65-K69 PolarHBondContact OE1-NZ 3.24Å; D66-K69 PolarHBondContact O-N 3.03Å; D66-K69 IonicContact OD1-NZ 3.48Å; D66-K69 PolarHBondContact OD1-NZ 3.1Å; K69-H71 PolarHBondContact O-N 3.23Å; K69-R72 PolarHBondContact O-N 3.14Å
70	V	94.8	Very high	95.7	Very high	114 Å²	114	49.2 Å²	49.2	69%	0.691	24%	0.238	S	C	*	.	H	α-helix	trans	-57.5	-37.5	179	163.8	0	0	0	0	111.4	D66	D66-V70 WeakPolarHBondContact O-CB 3.42Å; D66-V70 VanDerWaalsContact O-CG2 3.26Å; D66-V70 WeakPolarHBondContact O-CG2 3.21Å; D66-V70 PolarHBondContact O-N 3.1Å
71	H	94.4	Very high	95.6	Very high	50 Å²	50	47.6 Å²	47.6	23%	0.231	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	2.1	176.4	-67	-38.1	0	0	0	114.8	Y55 L67 L68 K69 I73 N132	Y55-H71 HydrophobicContact CD1-CB 4.49Å; Y55-H71 HydrophobicContact CE1-CB 3.84Å; Y55-H71 AromaticContact CE1-CG 3.74Å; L67-H71 PolarHBondContact O-CD2 3.17Å; L67-H71 VanDerWaalsContact O-CD2 3.3Å; L67-H71 PolarHBondContact O-N 2.87Å; L67-H71 VanDerWaalsContact O-N 3.15Å; L68-H71 CarbonylContact O-C 3.02Å; L68-H71 PolarHBondContact O-N 2.89Å; K69-H71 PolarHBondContact O-N 3.23Å; H71-I73 VanDerWaalsContact C-N 3.32Å; H71-I73 HydrophobicContact CB-CD1 3.55Å; H71-I73 HydrophobicContact CB-CG1 3.8Å; H71-I73 PolarHBondContact O-N 3.21Å; H71-N132 PolarHBondContact O-ND2 2.76Å
72	R	94.3	Very high	95.3	Very high	155 Å²	155	51.7 Å²	51.7	59%	0.585	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	51.7	-174.2	-56.3	-175.5	-173.4	-171.1	0.5	111.9	L68 K69 N132	L68-R72 PolarHBondContact O-N 2.78Å; K69-R72 PolarHBondContact O-N 3.14Å; R72-N132 VanDerWaalsContact O-CB 3.27Å; R72-N132 WeakPolarHBondContact O-CB 3.45Å; R72-N132 PolarHBondContact O-N 3.48Å; R72-N132 PolarHBondContact O-ND2 2.89Å
73	I	95	Very high	94.9	Very high	8 Å²	8	51.8 Å²	51.8	4%	0.041	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	94.2	179	-63.2	164.6	0	0	0	107.8	P47 Y55 L68 H71 Y75 V76 N132 L134	P47-I73 HydrophobicContact CG-CD1 3.93Å; Y55-I73 HydrophobicContact CD1-CD1 4.08Å; Y55-I73 HydrophobicContact CD2-CD1 4.38Å; Y55-I73 HydrophobicContact CD2-CG1 4.31Å; Y55-I73 HydrophobicContact CG-CD1 3.97Å; Y55-I73 HydrophobicContact CG-CG1 4.4Å; L68-I73 HydrophobicContact CB-CB 4.26Å; L68-I73 HydrophobicContact CD2-CB 3.88Å; L68-I73 HydrophobicContact CD2-CD1 3.67Å; L68-I73 HydrophobicContact CD2-CG1 4.38Å; L68-I73 HydrophobicContact CD2-CG2 3.89Å; L68-I73 PolarHBondContact O-N 3.29Å; H71-I73 VanDerWaalsContact C-N 3.32Å; H71-I73 HydrophobicContact CB-CD1 3.55Å; H71-I73 HydrophobicContact CB-CG1 3.8Å; H71-I73 PolarHBondContact O-N 3.21Å; I73-Y75 VanDerWaalsContact CG2-O 3.3Å; I73-Y75 WeakPolarHBondContact CG2-O 3.27Å; I73-V76 HydrophobicContact CG2-CG2 4.45Å; I73-N132 HydrophobicContact CG1-CB 4.13Å; I73-L134 HydrophobicContact CD1-CB 4.29Å; I73-L134 HydrophobicContact CG2-CB 3.59Å
74	D	92.9	Very high	94.8	Very high	68 Å²	68	51.2 Å²	51.2	36%	0.364	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-16.9	179.8	-46.7	-79.5	0	0	0	112.3	L89 H93 A131 N132	D74-L89 WeakPolarHBondContact O-CD1 3.24Å; D74-H93 VanDerWaalsContact O-CB 3.24Å; D74-H93 WeakPolarHBondContact O-CB 3.18Å; D74-H93 PolarHBondContact O-ND1 3.2Å; D74-A131 HydrophobicContact CB-CB 4.23Å; D74-A131 WeakPolarHBondContact OD2-CA 3.43Å; D74-A131 WeakPolarHBondContact OD2-CB 3.42Å; D74-N132 PolarHBondContact N-O 2.74Å
75	Y	95.2	Very high	94.7	Very high	34 Å²	34	49.8 Å²	49.8	13%	0.133	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	139.5	-175.3	-65.4	-92.4	0	0	0	112.8	I73 H93 I121 A131 N132 V133 L134	I73-Y75 VanDerWaalsContact CG2-O 3.3Å; I73-Y75 WeakPolarHBondContact CG2-O 3.27Å; Y75-H93 WeakPolarHBondContact CA-O 3.17Å; Y75-H93 HydrophobicContact CD1-CB 3.8Å; Y75-H93 AromaticContact CD1-CG 3.94Å; Y75-H93 HydrophobicContact CE1-CB 4.09Å; Y75-H93 AromaticContact CE1-CD2 3.58Å; Y75-H93 AromaticContact CE1-CG 3.74Å; Y75-H93 HydrophobicContact CG-CB 4.38Å; Y75-H93 AromaticContact CZ-CD2 3.95Å; Y75-H93 AromaticContact CZ-NE2 3.97Å; Y75-I121 HydrophobicContact CD1-CD1 3.61Å; Y75-I121 HydrophobicContact CD1-CG1 3.9Å; Y75-I121 HydrophobicContact CD2-CD1 3.92Å; Y75-I121 HydrophobicContact CD2-CG1 3.84Å; Y75-I121 HydrophobicContact CD2-CG2 3.85Å; Y75-I121 HydrophobicContact CE1-CD1 4.26Å; Y75-I121 HydrophobicContact CE1-CG1 4.06Å; Y75-I121 HydrophobicContact CE2-CG1 3.99Å; Y75-I121 HydrophobicContact CE2-CG2 4.18Å; Y75-I121 HydrophobicContact CG-CD1 3.42Å; Y75-I121 VanDerWaalsContact CG-CD1 3.42Å; Y75-I121 HydrophobicContact CG-CG1 3.8Å; Y75-I121 HydrophobicContact CG-CG2 4.46Å; Y75-A131 HydrophobicContact CD2-CB 4.12Å; Y75-A131 HydrophobicContact CE2-CB 3.9Å; Y75-N132 PolarHBondContact N-O 3.11Å; Y75-V133 WeakPolarHBondContact O-CA 3.36Å; Y75-L134 PolarHBondContact O-N 2.92Å
76	V	96.4	Very high	94.6	Very high	2 Å²	2	46 Å²	46	1%	0.012	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	123.1	-180	-176.6	0	0	0	0	111.7	A62 L68 I73 L89 H93 F94 L95 H136	A62-V76 HydrophobicContact CB-CG1 4.31Å; L68-V76 HydrophobicContact CD1-CG2 4.27Å; I73-V76 HydrophobicContact CG2-CG2 4.45Å; V76-L89 HydrophobicContact CB-CD2 3.65Å; V76-L89 HydrophobicContact CG2-CD1 4.3Å; V76-L89 HydrophobicContact CG2-CD2 3.66Å; V76-H93 PolarHBondContact N-O 3.28Å; V76-F94 HydrophobicContact CB-CD2 4.26Å; V76-F94 HydrophobicContact CG1-CD2 4.49Å; V76-F94 HydrophobicContact CG1-CE2 4.44Å; V76-F94 WeakPolarHBondContact O-CD2 3.44Å; V76-L95 PolarHBondContact O-N 2.89Å; V76-H136 VanDerWaalsContact CG1-CD2 3.43Å; V76-H136 WeakPolarHBondContact CG1-CD2 3.49Å
77	L	97.4	Very high	94.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	106.8	174.4	-166.1	173.2	0	0	0	109.5	M79 L95 I97 A114 L117 I118 L134 V135 H136 L147	L77-M79 HydrophobicContact CD2-CG 3.57Å; L77-L95 CarbonylContact C-O 3.6Å; L77-L95 WeakPolarHBondContact CA-O 3.42Å; L77-L95 HydrophobicContact CD1-CD2 4.28Å; L77-L95 HydrophobicContact CG-CB 4.39Å; L77-L95 HydrophobicContact CG-CD2 4.22Å; L77-L95 HydrophobicContact CG-CG 4.39Å; L77-I97 HydrophobicContact CD1-CD1 4.38Å; L77-I97 HydrophobicContact CD2-CD1 3.76Å; L77-I97 HydrophobicContact CD2-CG1 4.01Å; L77-I97 HydrophobicContact CG-CD1 4.39Å; L77-A114 HydrophobicContact CD1-CB 4.02Å; L77-L117 HydrophobicContact CD1-CD2 4.28Å; L77-I118 HydrophobicContact CD1-CD1 4.25Å; L77-L134 PolarHBondContact N-O 2.98Å; L77-V135 HydrophobicContact CB-CG2 4.2Å; L77-V135 HydrophobicContact CD1-CG2 4.25Å; L77-V135 HydrophobicContact CD2-CG1 4.45Å; L77-H136 PolarHBondContact O-CD2 3.31Å; L77-H136 PolarHBondContact O-N 3.16Å; L77-L147 HydrophobicContact CD1-CD2 3.8Å; L77-L147 HydrophobicContact CD2-CD2 3.98Å
78	N	97.6	Very high	94.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	101.9	-174.8	-174.3	-31.5	0	0	0	111.6	S80 S83 P84 F94 L95 R96 I97 H136	N78-S80 VanDerWaalsContact C-N 3.26Å; N78-S80 PolarHBondContact O-N 2.91Å; N78-S80 VanDerWaalsContact O-N 3.11Å; N78-S80 WeakPolarHBondContact OD1-CB 3.43Å; N78-S80 PolarHBondContact OD1-N 2.56Å; N78-S80 PolarHBondContact OD1-OG 3.26Å; N78-S83 PolarHBondContact ND2-O 3.31Å; N78-P84 PolarHBondContact ND2-O 3.36Å; N78-F94 HydrophobicContact CB-CE2 3.58Å; N78-F94 HydrophobicContact CB-CZ 3.59Å; N78-L95 PolarHBondContact N-O 3.42Å; N78-R96 PolarHBondContact ND2-NH1 3.48Å; N78-R96 WeakPolarHBondContact O-CA 3.5Å; N78-R96 PolarHBondContact OD1-NH1 2.86Å; N78-I97 PolarHBondContact O-N 3.08Å; N78-H136 WeakPolarHBondContact CA-NE2 3.45Å; N78-H136 WeakPolarHBondContact CB-NE2 3.31Å; N78-H136 VanDerWaalsContact CG-NE2 3.26Å; N78-H136 PolarHBondContact ND2-NE2 3.06Å
79	M	97	Very high	94.4	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	27%	0.266	C	S	.	.			trans	-84.9	61.6	174.5	-58.6	-162.5	79.9	0	0	111.7	L77 I97 V99 L107 V135 H136 C137 R143 L147	L77-M79 HydrophobicContact CD2-CG 3.57Å; M79-I97 CarbonylContact C-O 3.59Å; M79-I97 WeakPolarHBondContact CA-O 3.17Å; M79-I97 HydrophobicContact CE-CG2 4.3Å; M79-V99 HydrophobicContact CB-CG2 4.15Å; M79-V99 HydrophobicContact CE-CG2 4.05Å; M79-L107 HydrophobicContact CE-CD2 3.85Å; M79-L107 HydrophobicContact CE-CG 4.1Å; M79-V135 HydrophobicContact CG-CG1 4.43Å; M79-V135 HydrophobicContact SD-CG1 4.22Å; M79-H136 WeakPolarHBondContact CB-O 3.37Å; M79-H136 PolarHBondContact N-O 3.47Å; M79-C137 HydrophobicContact CB-CB 4.17Å; M79-C137 VanDerWaalsContact O-CB 3.3Å; M79-C137 WeakPolarHBondContact O-CB 3.31Å; M79-R143 HydrophobicContact CB-CB 4.17Å; M79-R143 WeakPolarHBondContact O-CD 3.28Å; M79-L147 HydrophobicContact CE-CB 3.87Å; M79-L147 HydrophobicContact CE-CD2 4.06Å; M79-L147 HydrophobicContact CG-CD2 4.32Å; M79-L147 HydrophobicContact SD-CB 3.39Å; M79-L147 WeakPolarHBondContact SD-CB 3.33Å; M79-L147 HydrophobicContact SD-CD2 3.52Å; M79-L147 VanDerWaalsContact SD-CD2 3.52Å; M79-L147 HydrophobicContact SD-CG 4.1Å
80	S	95.4	Very high	94.3	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.014	27%	0.27	C	S	.	.			trans	-154.3	155.9	174	82.7	0	0	0	0	113.4	N78 S83 R96 I97	N78-S80 VanDerWaalsContact C-N 3.26Å; N78-S80 PolarHBondContact O-N 2.91Å; N78-S80 VanDerWaalsContact O-N 3.11Å; N78-S80 WeakPolarHBondContact OD1-CB 3.43Å; N78-S80 PolarHBondContact OD1-N 2.56Å; N78-S80 PolarHBondContact OD1-OG 3.26Å; S80-S83 WeakPolarHBondContact OG-CB 3.21Å; S80-S83 PolarHBondContact OG-N 2.62Å; S80-S83 PolarHBondContact OG-OG 3.01Å; S80-R96 WeakPolarHBondContact O-CG 3.41Å; S80-R96 PolarHBondContact O-NH1 3.4Å; S80-I97 PolarHBondContact N-O 2.87Å
81	V	94.4	Very high	94.1	Very high	78 Å²	78	50.9 Å²	50.9	47%	0.473	26%	0.262	S	S	.	.	S	Bend	trans	-72.1	-39	169.3	-175.3	0	0	0	0	111.9	P98	V81-P98 HydrophobicContact CG2-CB 4.41Å; V81-P98 WeakPolarHBondContact CG2-O 3.43Å
82	A	90.1	Very high	93.9	Very high	90 Å²	90	53.8 Å²	53.8	74%	0.744	28%	0.275	S	S	*	.	S	Bend	trans	-116.7	-22.4	-160.4	0	0	0	0	0	116.6
83	S	89.6	Confident	93.8	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.021	26%	0.258	C	S	.	.	S	Bend	trans	-65.8	130.3	178	-57	0	0	0	0	109.3	Q59 N78 S80 R96	Q59-S83 PolarHBondContact OE1-OG 3.43Å; N78-S83 PolarHBondContact ND2-O 3.31Å; S80-S83 WeakPolarHBondContact OG-CB 3.21Å; S80-S83 PolarHBondContact OG-N 2.62Å; S80-S83 PolarHBondContact OG-OG 3.01Å; S83-R96 VanDerWaalsContact O-CZ 3.23Å; S83-R96 PolarHBondContact O-NH1 3.07Å; S83-R96 PolarHBondContact O-NH2 3.19Å
84	P	93	Very high	93.7	Very high	59 Å²	59	49.4 Å²	49.4	38%	0.383	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-63.6	171.3	-173.3	25.6	-34.7	0	0	0	113.5	M63 N78	M63-P84 HydrophobicContact CE-CG 4.27Å; M63-P84 HydrophobicContact SD-CG 3.9Å; N78-P84 PolarHBondContact ND2-O 3.36Å
85	K	94.7	Very high	93.8	Very high	47 Å²	47	47.4 Å²	47.4	20%	0.204	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-81.5	140.3	157.4	-175	-173.9	69.3	66.4	0	106.9	L89 E91 F94	K85-L89 PolarHBondContact NZ-O 2.59Å; K85-E91 WeakPolarHBondContact CD-OE2 3.27Å; K85-E91 WeakPolarHBondContact CE-OE2 3.39Å; K85-F94 HydrophobicContact CB-CD1 4.14Å; K85-F94 HydrophobicContact CB-CD2 4.41Å; K85-F94 HydrophobicContact CB-CE1 3.86Å; K85-F94 HydrophobicContact CB-CE2 4.13Å; K85-F94 HydrophobicContact CB-CG 4.4Å; K85-F94 HydrophobicContact CB-CZ 3.85Å; K85-F94 HydrophobicContact CD-CB 3.91Å; K85-F94 HydrophobicContact CD-CD1 3.78Å; K85-F94 HydrophobicContact CD-CD2 4.37Å; K85-F94 HydrophobicContact CD-CE1 4.38Å; K85-F94 HydrophobicContact CD-CG 3.77Å; K85-F94 HydrophobicContact CG-CB 4.21Å; K85-F94 HydrophobicContact CG-CD1 3.79Å; K85-F94 HydrophobicContact CG-CD2 3.74Å; K85-F94 HydrophobicContact CG-CE1 4.02Å; K85-F94 HydrophobicContact CG-CE2 3.95Å; K85-F94 HydrophobicContact CG-CG 3.64Å; K85-F94 HydrophobicContact CG-CZ 4.09Å
86	P	93.9	Very high	93.8	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-65.4	139.7	170.1	-15.7	30.5	0	0	0	110.6	A62 M63 F88 L89	A62-P86 WeakPolarHBondContact O-CG 3.32Å; M63-P86 HydrophobicContact CE-CB 4.5Å; M63-P86 HydrophobicContact SD-CB 4.13Å; M63-P86 HydrophobicContact SD-CG 3.98Å; P86-F88 HydrophobicContact CB-CD1 4.09Å; P86-F88 HydrophobicContact CB-CD2 4.18Å; P86-F88 HydrophobicContact CB-CE1 3.55Å; P86-F88 HydrophobicContact CB-CE2 3.64Å; P86-F88 HydrophobicContact CB-CG 4.39Å; P86-F88 HydrophobicContact CB-CZ 3.29Å; P86-F88 HydrophobicContact CG-CE2 4.34Å; P86-F88 HydrophobicContact CG-CZ 4.06Å; P86-F88 PolarHBondContact O-N 3.5Å; P86-L89 HydrophobicContact CB-CB 4.22Å; P86-L89 HydrophobicContact CG-CB 4.47Å; P86-L89 PolarHBondContact O-N 2.96Å
87	D	94.2	Very high	93.8	Very high	149 Å²	149	49.3 Å²	49.3	80%	0.797	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-35.3	-172.4	-65.6	-52.1	0	0	0	112.7	L89	D87-L89 PolarHBondContact O-N 2.78Å
88	F	93.7	Very high	93.7	Very high	75 Å²	75	52.1 Å²	52.1	33%	0.329	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-16.2	175	56.5	-105	0	0	0	114.5	E65 L68 P86	E65-F88 HydrophobicContact CB-CD1 3.7Å; E65-F88 HydrophobicContact CB-CE1 3.51Å; E65-F88 HydrophobicContact CB-CE2 4.41Å; E65-F88 HydrophobicContact CB-CG 4.25Å; E65-F88 HydrophobicContact CB-CZ 3.89Å; E65-F88 HydrophobicContact CG-CB 4.18Å; E65-F88 HydrophobicContact CG-CD1 3.56Å; E65-F88 HydrophobicContact CG-CD2 3.82Å; E65-F88 HydrophobicContact CG-CE1 3.79Å; E65-F88 HydrophobicContact CG-CE2 4.05Å; E65-F88 HydrophobicContact CG-CG 3.58Å; E65-F88 HydrophobicContact CG-CZ 4.02Å; E65-F88 WeakPolarHBondContact OE2-CB 3.47Å; E65-F88 VanDerWaalsContact OE2-CD1 3.27Å; E65-F88 WeakPolarHBondContact OE2-CD1 3.42Å; L68-F88 HydrophobicContact CD1-CE2 3.79Å; L68-F88 HydrophobicContact CD1-CZ 3.87Å; P86-F88 HydrophobicContact CB-CD1 4.09Å; P86-F88 HydrophobicContact CB-CD2 4.18Å; P86-F88 HydrophobicContact CB-CE1 3.55Å; P86-F88 HydrophobicContact CB-CE2 3.64Å; P86-F88 HydrophobicContact CB-CG 4.39Å; P86-F88 HydrophobicContact CB-CZ 3.29Å; P86-F88 HydrophobicContact CG-CE2 4.34Å; P86-F88 HydrophobicContact CG-CZ 4.06Å; P86-F88 PolarHBondContact O-N 3.5Å
89	L	92.9	Very high	93.6	Very high	14 Å²	14	52.1 Å²	52.1	7%	0.073	28%	0.275	C	S	.	.	S	Bend	trans	-88.4	131.3	-174.8	-171.3	73.8	0	0	0	111.4	D74 V76 K85 P86 D87 H93 F94	D74-L89 WeakPolarHBondContact O-CD1 3.24Å; V76-L89 HydrophobicContact CB-CD2 3.65Å; V76-L89 HydrophobicContact CG2-CD1 4.3Å; V76-L89 HydrophobicContact CG2-CD2 3.66Å; K85-L89 PolarHBondContact NZ-O 2.59Å; P86-L89 HydrophobicContact CB-CB 4.22Å; P86-L89 HydrophobicContact CG-CB 4.47Å; P86-L89 PolarHBondContact O-N 2.96Å; D87-L89 PolarHBondContact O-N 2.78Å; L89-H93 HydrophobicContact CD1-CB 4.23Å; L89-F94 HydrophobicContact CD2-CB 3.96Å; L89-F94 HydrophobicContact CD2-CD2 3.79Å; L89-F94 HydrophobicContact CD2-CG 4.31Å
90	Q	92.6	Very high	93.6	Very high	120 Å²	120	55.9 Å²	55.9	56%	0.561	30%	0.296	S	S	*	.			trans	-66.5	146.2	175	-66.4	-179.1	-12.1	0	0	111.7	E92 H93 F94	Q90-E92 VanDerWaalsContact C-N 3.31Å; Q90-E92 PolarHBondContact O-N 2.98Å; Q90-H93 PolarHBondContact O-N 3.48Å; Q90-H93 VanDerWaalsContact O-N 3.12Å; Q90-F94 PolarHBondContact O-N 3.27Å
91	E	91.1	Very high	93.7	Very high	114 Å²	114	59 Å²	59	53%	0.533	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-67.5	-35	-176.2	-166.1	67.5	-160.5	0	0	111.2	K85 H93 F94	K85-E91 WeakPolarHBondContact CD-OE2 3.27Å; K85-E91 WeakPolarHBondContact CE-OE2 3.39Å; E91-H93 PolarHBondContact O-N 3.3Å; E91-H93 VanDerWaalsContact O-N 3.14Å; E91-F94 PolarHBondContact O-N 3.3Å; E91-F94 VanDerWaalsContact O-N 3.07Å
92	E	89.8	Confident	93.7	Very high	110 Å²	110	56.7 Å²	56.7	51%	0.514	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-57.3	-24.4	173.1	-69.2	74.7	-170.6	0	0	113.3	Q90 L269	Q90-E92 VanDerWaalsContact C-N 3.31Å; Q90-E92 PolarHBondContact O-N 2.98Å; E92-L269 HydrophobicContact CG-CD2 4.14Å
93	H	92	Very high	93.8	Very high	48 Å²	48	60.7 Å²	60.7	22%	0.222	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-101	1	-178.5	-68.7	-164.1	0	0	0	113.1	D74 Y75 V76 L89 Q90 E91	D74-H93 VanDerWaalsContact O-CB 3.24Å; D74-H93 WeakPolarHBondContact O-CB 3.18Å; D74-H93 PolarHBondContact O-ND1 3.2Å; Y75-H93 WeakPolarHBondContact CA-O 3.17Å; Y75-H93 HydrophobicContact CD1-CB 3.8Å; Y75-H93 AromaticContact CD1-CG 3.94Å; Y75-H93 HydrophobicContact CE1-CB 4.09Å; Y75-H93 AromaticContact CE1-CD2 3.58Å; Y75-H93 AromaticContact CE1-CG 3.74Å; Y75-H93 HydrophobicContact CG-CB 4.38Å; Y75-H93 AromaticContact CZ-CD2 3.95Å; Y75-H93 AromaticContact CZ-NE2 3.97Å; V76-H93 PolarHBondContact N-O 3.28Å; L89-H93 HydrophobicContact CD1-CB 4.23Å; Q90-H93 PolarHBondContact O-N 3.48Å; Q90-H93 VanDerWaalsContact O-N 3.12Å; E91-H93 PolarHBondContact O-N 3.3Å; E91-H93 VanDerWaalsContact O-N 3.14Å
94	F	94.6	Very high	94.1	Very high	23 Å²	23	64.4 Å²	64.4	10%	0.101	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.4	-176.7	-175.1	-112.1	0	0	0	111.9	V76 N78 K85 L89 Q90 E91 R96	V76-F94 HydrophobicContact CB-CD2 4.26Å; V76-F94 HydrophobicContact CG1-CD2 4.49Å; V76-F94 HydrophobicContact CG1-CE2 4.44Å; V76-F94 WeakPolarHBondContact O-CD2 3.44Å; N78-F94 HydrophobicContact CB-CE2 3.58Å; N78-F94 HydrophobicContact CB-CZ 3.59Å; K85-F94 HydrophobicContact CB-CD1 4.14Å; K85-F94 HydrophobicContact CB-CD2 4.41Å; K85-F94 HydrophobicContact CB-CE1 3.86Å; K85-F94 HydrophobicContact CB-CE2 4.13Å; K85-F94 HydrophobicContact CB-CG 4.4Å; K85-F94 HydrophobicContact CB-CZ 3.85Å; K85-F94 HydrophobicContact CD-CB 3.91Å; K85-F94 HydrophobicContact CD-CD1 3.78Å; K85-F94 HydrophobicContact CD-CD2 4.37Å; K85-F94 HydrophobicContact CD-CE1 4.38Å; K85-F94 HydrophobicContact CD-CG 3.77Å; K85-F94 HydrophobicContact CG-CB 4.21Å; K85-F94 HydrophobicContact CG-CD1 3.79Å; K85-F94 HydrophobicContact CG-CD2 3.74Å; K85-F94 HydrophobicContact CG-CE1 4.02Å; K85-F94 HydrophobicContact CG-CE2 3.95Å; K85-F94 HydrophobicContact CG-CG 3.64Å; K85-F94 HydrophobicContact CG-CZ 4.09Å; L89-F94 HydrophobicContact CD2-CB 3.96Å; L89-F94 HydrophobicContact CD2-CD2 3.79Å; L89-F94 HydrophobicContact CD2-CG 4.31Å; Q90-F94 PolarHBondContact O-N 3.27Å; E91-F94 PolarHBondContact O-N 3.3Å; E91-F94 VanDerWaalsContact O-N 3.07Å; F94-R96 HydrophobicContact CE1-CB 4.01Å; F94-R96 HydrophobicContact CZ-CB 4.35Å
95	L	94.3	Very high	94.2	Very high	26 Å²	26	63.5 Å²	63.5	14%	0.136	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	120.4	169.6	175.5	62.2	0	0	0	110.8	V76 L77 N78 I97 L117	V76-L95 PolarHBondContact O-N 2.89Å; L77-L95 CarbonylContact C-O 3.6Å; L77-L95 WeakPolarHBondContact CA-O 3.42Å; L77-L95 HydrophobicContact CD1-CD2 4.28Å; L77-L95 HydrophobicContact CG-CB 4.39Å; L77-L95 HydrophobicContact CG-CD2 4.22Å; L77-L95 HydrophobicContact CG-CG 4.39Å; N78-L95 PolarHBondContact N-O 3.42Å; L95-I97 HydrophobicContact CD2-CD1 4.5Å; L95-I97 HydrophobicContact CD2-CG1 4.46Å; L95-I97 HydrophobicContact CG-CG1 4.35Å; L95-L117 HydrophobicContact CB-CD1 3.82Å; L95-L117 HydrophobicContact CD2-CB 4.29Å; L95-L117 HydrophobicContact CD2-CD1 3.9Å; L95-L117 HydrophobicContact CD2-CG 4.49Å; L95-L117 HydrophobicContact CG-CD1 4.45Å
96	R	95.6	Very high	94.2	Very high	76 Å²	76	68 Å²	68	29%	0.287	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	129.4	169.2	-174.1	177.6	-61.8	-79.3	-3.1	111.5	N78 S80 S83 F94 P98	N78-R96 PolarHBondContact ND2-NH1 3.48Å; N78-R96 WeakPolarHBondContact O-CA 3.5Å; N78-R96 PolarHBondContact OD1-NH1 2.86Å; S80-R96 WeakPolarHBondContact O-CG 3.41Å; S80-R96 PolarHBondContact O-NH1 3.4Å; S83-R96 VanDerWaalsContact O-CZ 3.23Å; S83-R96 PolarHBondContact O-NH1 3.07Å; S83-R96 PolarHBondContact O-NH2 3.19Å; F94-R96 HydrophobicContact CE1-CB 4.01Å; F94-R96 HydrophobicContact CZ-CB 4.35Å; R96-P98 HydrophobicContact CG-CB 4.33Å
97	I	96.2	Very high	94.3	Very high	1 Å²	1	68.1 Å²	68.1	1%	0.005	33%	0.333	C	S	.	.			trans	-112.3	99.4	165.4	-57.5	-175.9	0	0	0	106.5	L77 N78 M79 S80 L95 V99 Y110 A114 L147	L77-I97 HydrophobicContact CD1-CD1 4.38Å; L77-I97 HydrophobicContact CD2-CD1 3.76Å; L77-I97 HydrophobicContact CD2-CG1 4.01Å; L77-I97 HydrophobicContact CG-CD1 4.39Å; N78-I97 PolarHBondContact O-N 3.08Å; M79-I97 CarbonylContact C-O 3.59Å; M79-I97 WeakPolarHBondContact CA-O 3.17Å; M79-I97 HydrophobicContact CE-CG2 4.3Å; S80-I97 PolarHBondContact N-O 2.87Å; L95-I97 HydrophobicContact CD2-CD1 4.5Å; L95-I97 HydrophobicContact CD2-CG1 4.46Å; L95-I97 HydrophobicContact CG-CG1 4.35Å; I97-V99 VanDerWaalsContact C-N 3.27Å; I97-V99 HydrophobicContact CG2-CG1 4.08Å; I97-V99 HydrophobicContact CG2-CG2 4.3Å; I97-V99 PolarHBondContact O-N 3.45Å; I97-Y110 HydrophobicContact CG2-CD1 3.81Å; I97-Y110 HydrophobicContact CG2-CD2 3.97Å; I97-Y110 HydrophobicContact CG2-CE1 4.36Å; I97-Y110 HydrophobicContact CG2-CG 3.58Å; I97-A114 HydrophobicContact CD1-CB 3.95Å; I97-L147 HydrophobicContact CD1-CD2 4.42Å
98	P	95.3	Very high	94.2	Very high	59 Å²	59	62.5 Å²	62.5	38%	0.383	30%	0.303	S	S	.	.			trans	-80.8	67.5	-164.7	33.2	-37	0	0	0	112.8	V81 R96	V81-P98 HydrophobicContact CG2-CB 4.41Å; V81-P98 WeakPolarHBondContact CG2-O 3.43Å; R96-P98 HydrophobicContact CG-CB 4.33Å
99	V	95.8	Very high	94.2	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.316	C	S	.	.			trans	-103.9	143	-177.8	-72.1	0	0	0	0	113.6	M79 I97 E105 L107 Y110 R143	M79-V99 HydrophobicContact CB-CG2 4.15Å; M79-V99 HydrophobicContact CE-CG2 4.05Å; I97-V99 VanDerWaalsContact C-N 3.27Å; I97-V99 HydrophobicContact CG2-CG1 4.08Å; I97-V99 HydrophobicContact CG2-CG2 4.3Å; I97-V99 PolarHBondContact O-N 3.45Å; V99-E105 HydrophobicContact CB-CG 3.83Å; V99-E105 HydrophobicContact CG1-CG 3.95Å; V99-L107 HydrophobicContact CB-CD1 4.05Å; V99-L107 HydrophobicContact CG1-CD1 3.97Å; V99-L107 HydrophobicContact CG1-CG 4.44Å; V99-L107 HydrophobicContact CG2-CD1 4.23Å; V99-L107 HydrophobicContact CG2-CG 4.45Å; V99-Y110 HydrophobicContact CG1-CD2 4.14Å; V99-Y110 HydrophobicContact CG1-CE2 3.9Å; V99-R143 HydrophobicContact CG2-CG 4.13Å; V99-R143 WeakPolarHBondContact O-CD 3Å; V99-R143 PolarHBondContact O-NH1 2.9Å
100	N	96.5	Very high	94.3	Very high	80 Å²	80	66.3 Å²	66.3	43%	0.428	33%	0.327	S	S	.	.			trans	-86.9	162.4	172.7	-59.2	-79.2	0	0	0	111.4	S102 E105 R143 F180	N100-S102 PolarHBondContact O-N 2.85Å; N100-E105 WeakPolarHBondContact CB-OE2 3.36Å; N100-E105 PolarHBondContact N-OE2 3.08Å; N100-E105 PolarHBondContact ND2-OE2 2.95Å; N100-E105 WeakPolarHBondContact O-CG 3.19Å; N100-R143 WeakPolarHBondContact O-CD 3.33Å; N100-F180 WeakPolarHBondContact O-CZ 3.49Å
101	D	96.9	Very high	94.3	Very high	67 Å²	67	60.8 Å²	60.8	36%	0.358	30%	0.301	S	S	.	.	S	Bend	trans	-95.4	82.2	173.9	-131.5	-51.1	0	0	0	109.4	S142 R143 N177 F180	D101-S142 WeakPolarHBondContact OD1-CB 3.15Å; D101-S142 PolarHBondContact OD1-OG 2.93Å; D101-S142 WeakPolarHBondContact OD2-CB 3.15Å; D101-R143 HydrophobicContact CB-CG 4.44Å; D101-R143 WeakPolarHBondContact OD2-CG 3.37Å; D101-R143 IonicContact OD2-CZ 3.59Å; D101-R143 PolarHBondContact OD2-N 2.91Å; D101-R143 IonicContact OD2-NE 2.68Å; D101-R143 PolarHBondContact OD2-NE 3.32Å; D101-R143 IonicContact OD2-NH2 2.81Å; D101-N177 PolarHBondContact OD1-ND2 2.95Å; D101-N177 VanDerWaalsContact OD1-ND2 3.11Å; D101-F180 WeakPolarHBondContact OD1-CE2 3.21Å
102	S	95.2	Very high	94.2	Very high	29 Å²	29	59.4 Å²	59.4	20%	0.203	30%	0.297	C	S	.	.	S	Bend	trans	-138.9	164	-172.8	90	0	0	0	0	113.9	N100 S104 E105 N177 N179	N100-S102 PolarHBondContact O-N 2.85Å; S102-S104 PolarHBondContact O-N 2.99Å; S102-S104 PolarHBondContact OG-N 3.44Å; S102-S104 VanDerWaalsContact OG-N 3.12Å; S102-S104 PolarHBondContact OG-OG 2.95Å; S102-S104 VanDerWaalsContact OG-OG 3.1Å; S102-E105 WeakPolarHBondContact OG-CB 3.31Å; S102-E105 PolarHBondContact OG-N 3.12Å; S102-N177 PolarHBondContact O-ND2 3.32Å; S102-N179 PolarHBondContact O-ND2 2.97Å
103	Y	92.9	Very high	94.3	Very high	174 Å²	174	58.7 Å²	58.7	68%	0.682	29%	0.294	S	S	*	.	S	Bend	trans	-72	-4.3	174	65.1	-94.5	0	0	0	114.1	N179 F470	Y103-N179 WeakPolarHBondContact O-CB 3.39Å; Y103-F470 HydrophobicContact CE2-CZ 4.36Å
104	S	94.6	Very high	94.3	Very high	81 Å²	81	56.4 Å²	56.4	57%	0.566	28%	0.283	S	S	*	.	S	Bend	trans	-122.4	-12.7	-176	56.5	0	0	0	0	114.3	S102	S102-S104 PolarHBondContact O-N 2.99Å; S102-S104 PolarHBondContact OG-N 3.44Å; S102-S104 VanDerWaalsContact OG-N 3.12Å; S102-S104 PolarHBondContact OG-OG 2.95Å; S102-S104 VanDerWaalsContact OG-OG 3.1Å
105	E	96.3	Very high	94.2	Very high	41 Å²	41	55.7 Å²	55.7	19%	0.192	28%	0.28	C	S	.	.			trans	-71.2	141.9	-178.4	-169.7	69.4	-81.7	0	0	111.8	V99 N100 S102 L107 N179 F180 Q183	V99-E105 HydrophobicContact CB-CG 3.83Å; V99-E105 HydrophobicContact CG1-CG 3.95Å; N100-E105 WeakPolarHBondContact CB-OE2 3.36Å; N100-E105 PolarHBondContact N-OE2 3.08Å; N100-E105 PolarHBondContact ND2-OE2 2.95Å; N100-E105 WeakPolarHBondContact O-CG 3.19Å; S102-E105 WeakPolarHBondContact OG-CB 3.31Å; S102-E105 PolarHBondContact OG-N 3.12Å; E105-L107 HydrophobicContact CG-CD1 4.02Å; E105-N179 PolarHBondContact O-ND2 3.29Å; E105-F180 HydrophobicContact CB-CE1 4.1Å; E105-F180 HydrophobicContact CB-CZ 4.35Å; E105-Q183 PolarHBondContact O-NE2 3.41Å
106	K	94.7	Very high	94.1	Very high	142 Å²	142	60.3 Å²	60.3	62%	0.617	30%	0.301	S	S	*	.			trans	-110	112.2	-177.8	-65.4	-168.9	176.8	-166.8	0	111.5	P109 Y110	K106-P109 HydrophobicContact CB-CG 4.41Å; K106-Y110 WeakPolarHBondContact O-CD2 3.45Å; K106-Y110 WeakPolarHBondContact O-CE2 3.49Å
107	L	94.7	Very high	93.7	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.005	30%	0.297	C	S	.	.			trans	-91.5	-30.8	176.2	-86.9	63.1	0	0	0	112.2	M79 V99 E105 P109 Y110 F111 T146 F180	M79-L107 HydrophobicContact CE-CD2 3.85Å; M79-L107 HydrophobicContact CE-CG 4.1Å; V99-L107 HydrophobicContact CB-CD1 4.05Å; V99-L107 HydrophobicContact CG1-CD1 3.97Å; V99-L107 HydrophobicContact CG1-CG 4.44Å; V99-L107 HydrophobicContact CG2-CD1 4.23Å; V99-L107 HydrophobicContact CG2-CG 4.45Å; E105-L107 HydrophobicContact CG-CD1 4.02Å; L107-P109 VanDerWaalsContact C-CD 3.44Å; L107-Y110 WeakPolarHBondContact O-CB 3.46Å; L107-Y110 PolarHBondContact O-N 3.5Å; L107-F111 HydrophobicContact CB-CE1 3.87Å; L107-F111 HydrophobicContact CB-CZ 4.42Å; L107-F111 WeakPolarHBondContact O-CD1 3.27Å; L107-T146 HydrophobicContact CD2-CG2 3.83Å; L107-F180 HydrophobicContact CD1-CD1 4.03Å; L107-F180 HydrophobicContact CD1-CE1 3.47Å; L107-F180 VanDerWaalsContact CD1-CE1 3.47Å; L107-F180 HydrophobicContact CD1-CE2 4.27Å; L107-F180 HydrophobicContact CD1-CZ 3.6Å; L107-F180 HydrophobicContact CD2-CD1 4.48Å; L107-F180 HydrophobicContact CD2-CD2 4.23Å; L107-F180 HydrophobicContact CD2-CE1 4.5Å; L107-F180 HydrophobicContact CD2-CE2 4.24Å; L107-F180 HydrophobicContact CD2-CG 4.37Å; L107-F180 HydrophobicContact CD2-CZ 4.37Å
108	L	93.4	Very high	93.5	Very high	31 Å²	31	58.6 Å²	58.6	16%	0.162	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-45	-47.6	-179.9	-84	164.9	0	0	0	115	Y110 F111 Q183 E186 F187	L108-Y110 PolarHBondContact O-N 2.96Å; L108-Y110 VanDerWaalsContact O-N 3.11Å; L108-F111 HydrophobicContact CD2-CD2 4.01Å; L108-F111 HydrophobicContact CD2-CE2 3.99Å; L108-F111 WeakPolarHBondContact O-CB 3.4Å; L108-F111 PolarHBondContact O-N 3.06Å; L108-F111 VanDerWaalsContact O-N 3.16Å; L108-Q183 HydrophobicContact CD1-CB 3.95Å; L108-Q183 HydrophobicContact CD1-CG 3.78Å; L108-Q183 HydrophobicContact CG-CB 3.97Å; L108-Q183 HydrophobicContact CG-CG 4.15Å; L108-E186 HydrophobicContact CD1-CB 4.08Å; L108-E186 HydrophobicContact CD1-CG 3.96Å; L108-E186 WeakPolarHBondContact CD1-OE1 3.45Å; L108-E186 WeakPolarHBondContact CD1-OE2 3.37Å; L108-F187 HydrophobicContact CD2-CB 3.83Å; L108-F187 HydrophobicContact CD2-CD2 4.42Å
109	P	93.8	Very high	93.3	Very high	92 Å²	92	59.8 Å²	59.8	60%	0.597	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-65.1	-16.9	-177.9	-21.5	34.9	0	0	0	114.5	K106 L107	K106-P109 HydrophobicContact CB-CG 4.41Å; L107-P109 VanDerWaalsContact C-CD 3.44Å
110	Y	93	Very high	92.9	Very high	78 Å²	78	61.9 Å²	61.9	31%	0.306	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-95.9	-8.9	-179.5	-59.3	-76.7	0	0	0	113.2	I97 V99 K106 L107 L108 Q113 A114	I97-Y110 HydrophobicContact CG2-CD1 3.81Å; I97-Y110 HydrophobicContact CG2-CD2 3.97Å; I97-Y110 HydrophobicContact CG2-CE1 4.36Å; I97-Y110 HydrophobicContact CG2-CG 3.58Å; V99-Y110 HydrophobicContact CG1-CD2 4.14Å; V99-Y110 HydrophobicContact CG1-CE2 3.9Å; K106-Y110 WeakPolarHBondContact O-CD2 3.45Å; K106-Y110 WeakPolarHBondContact O-CE2 3.49Å; L107-Y110 WeakPolarHBondContact O-CB 3.46Å; L107-Y110 PolarHBondContact O-N 3.5Å; L108-Y110 PolarHBondContact O-N 2.96Å; L108-Y110 VanDerWaalsContact O-N 3.11Å; Y110-Q113 PolarHBondContact O-N 3.35Å; Y110-A114 WeakPolarHBondContact O-CB 3.4Å; Y110-A114 PolarHBondContact O-N 3.38Å
111	F	93.1	Very high	92.4	Very high	3 Å²	3	58.2 Å²	58.2	1%	0.013	29%	0.294	C	S	.	.	H	α-helix	trans	-61.6	-48.2	-175.4	-79.9	2.8	0	0	0	112.2	L107 L108 Q113 A114 F115 T146 L147 A150 L184 F187	L107-F111 HydrophobicContact CB-CE1 3.87Å; L107-F111 HydrophobicContact CB-CZ 4.42Å; L107-F111 WeakPolarHBondContact O-CD1 3.27Å; L108-F111 HydrophobicContact CD2-CD2 4.01Å; L108-F111 HydrophobicContact CD2-CE2 3.99Å; L108-F111 WeakPolarHBondContact O-CB 3.4Å; L108-F111 PolarHBondContact O-N 3.06Å; L108-F111 VanDerWaalsContact O-N 3.16Å; F111-Q113 PolarHBondContact O-N 3.3Å; F111-A114 PolarHBondContact O-N 3.34Å; F111-F115 VanDerWaalsContact C-CD2 3.5Å; F111-F115 HydrophobicContact CB-CD2 4.31Å; F111-F115 HydrophobicContact CB-CE2 3.66Å; F111-F115 HydrophobicContact CB-CZ 3.91Å; F111-F115 HydrophobicContact CD2-CZ 4.32Å; F111-F115 HydrophobicContact CG-CE2 4.41Å; F111-F115 HydrophobicContact CG-CZ 4.21Å; F111-F115 WeakPolarHBondContact O-CD2 3.23Å; F111-F115 WeakPolarHBondContact O-CG 3.41Å; F111-F115 PolarHBondContact O-N 2.87Å; F111-T146 HydrophobicContact CZ-CG2 4.25Å; F111-L147 HydrophobicContact CD1-CD1 3.88Å; F111-L147 HydrophobicContact CE1-CD1 4.22Å; F111-A150 HydrophobicContact CD2-CB 3.97Å; F111-A150 HydrophobicContact CE1-CB 4.21Å; F111-A150 HydrophobicContact CE2-CB 3.55Å; F111-A150 HydrophobicContact CG-CB 4.47Å; F111-A150 HydrophobicContact CZ-CB 3.68Å; F111-L184 HydrophobicContact CE2-CD2 4.41Å; F111-L184 HydrophobicContact CZ-CD2 4.28Å; F111-F187 HydrophobicContact CD2-CB 4.32Å; F111-F187 HydrophobicContact CD2-CD1 4.2Å; F111-F187 AromaticContact CD2-CD2 3.8Å; F111-F187 HydrophobicContact CD2-CD2 3.8Å; F111-F187 HydrophobicContact CD2-CE2 4.16Å; F111-F187 AromaticContact CD2-CG 3.84Å; F111-F187 HydrophobicContact CD2-CG 3.84Å; F111-F187 HydrophobicContact CE2-CB 4Å; F111-F187 HydrophobicContact CE2-CD1 4.14Å; F111-F187 HydrophobicContact CE2-CD2 4.32Å; F111-F187 AromaticContact CE2-CG 3.89Å; F111-F187 HydrophobicContact CE2-CG 3.89Å
112	D	90.2	Very high	91.9	Very high	86 Å²	86	55.3 Å²	55.3	46%	0.46	28%	0.279	S	S	.	.	H	α-helix	trans	-66	-36.2	-179.9	-70	-53.6	0	0	0	113.3	F115 Q116 R154	D112-F115 PolarHBondContact O-N 2.85Å; D112-Q116 WeakPolarHBondContact O-CB 3.26Å; D112-Q116 VanDerWaalsContact O-CG 3.22Å; D112-Q116 WeakPolarHBondContact O-CG 3.39Å; D112-Q116 PolarHBondContact O-N 3.15Å; D112-R154 IonicContact OD1-CZ 2.78Å; D112-R154 IonicContact OD1-NH1 3.9Å; D112-R154 PolarHBondContact OD1-NH1 3.44Å
113	Q	90.8	Very high	91.5	Very high	95 Å²	95	55.4 Å²	55.4	44%	0.444	28%	0.278	S	S	.	.	H	α-helix	trans	-61.7	-45	173	-175.6	-175.1	7.7	0	0	111.2	Y110 F111 Q116 L117	Y110-Q113 PolarHBondContact O-N 3.35Å; F111-Q113 PolarHBondContact O-N 3.3Å; Q113-Q116 PolarHBondContact O-N 3.12Å; Q113-L117 PolarHBondContact O-N 2.96Å
114	A	92.4	Very high	91	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.8	-42.1	177.4	0	0	0	0	0	112.3	L77 I97 Y110 F111 Q116 L117 I118 L147	L77-A114 HydrophobicContact CD1-CB 4.02Å; I97-A114 HydrophobicContact CD1-CB 3.95Å; Y110-A114 WeakPolarHBondContact O-CB 3.4Å; Y110-A114 PolarHBondContact O-N 3.38Å; F111-A114 PolarHBondContact O-N 3.34Å; A114-Q116 VanDerWaalsContact C-N 3.35Å; A114-Q116 PolarHBondContact O-N 2.94Å; A114-L117 PolarHBondContact O-N 3.05Å; A114-I118 WeakPolarHBondContact O-CB 3.39Å; A114-I118 VanDerWaalsContact O-CG1 3.24Å; A114-I118 WeakPolarHBondContact O-CG1 3.37Å; A114-I118 PolarHBondContact O-N 2.86Å; A114-L147 HydrophobicContact CB-CD1 3.58Å; A114-L147 HydrophobicContact CB-CD2 3.68Å; A114-L147 HydrophobicContact CB-CG 4.24Å
115	F	93.4	Very high	90.4	Very high	7 Å²	7	47.6 Å²	47.6	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-64.1	-39	176.9	-59.9	-36.6	0	0	0	112	F111 D112 I118 F119 L147 A150 C151 F187	F111-F115 VanDerWaalsContact C-CD2 3.5Å; F111-F115 HydrophobicContact CB-CD2 4.31Å; F111-F115 HydrophobicContact CB-CE2 3.66Å; F111-F115 HydrophobicContact CB-CZ 3.91Å; F111-F115 HydrophobicContact CD2-CZ 4.32Å; F111-F115 HydrophobicContact CG-CE2 4.41Å; F111-F115 HydrophobicContact CG-CZ 4.21Å; F111-F115 WeakPolarHBondContact O-CD2 3.23Å; F111-F115 WeakPolarHBondContact O-CG 3.41Å; F111-F115 PolarHBondContact O-N 2.87Å; D112-F115 PolarHBondContact O-N 2.85Å; F115-I118 PolarHBondContact O-N 3.24Å; F115-F119 WeakPolarHBondContact O-CB 3.48Å; F115-F119 PolarHBondContact O-N 2.97Å; F115-L147 HydrophobicContact CE1-CD1 4.29Å; F115-A150 HydrophobicContact CE1-CB 4.22Å; F115-A150 HydrophobicContact CZ-CB 3.92Å; F115-C151 HydrophobicContact CE1-CB 4.37Å; F115-F187 HydrophobicContact CE2-CE1 4.22Å; F115-F187 AromaticContact CE2-CE2 3.77Å; F115-F187 HydrophobicContact CE2-CE2 3.77Å; F115-F187 AromaticContact CE2-CZ 3.36Å; F115-F187 HydrophobicContact CE2-CZ 3.36Å; F115-F187 AromaticContact CZ-CE1 3.81Å; F115-F187 HydrophobicContact CZ-CE1 3.81Å; F115-F187 HydrophobicContact CZ-CE2 4.16Å; F115-F187 AromaticContact CZ-CZ 3.43Å; F115-F187 HydrophobicContact CZ-CZ 3.43Å; F115-F187 VanDerWaalsContact CZ-CZ 3.43Å
116	Q	90.5	Very high	89.6	Confident	124 Å²	124	49.5 Å²	49.5	58%	0.579	25%	0.254	S	S	*	.	H	α-helix	trans	-60.5	-46.2	176.2	-75.3	168	20.8	0	0	112	D112 Q113 A114 F119 A120	D112-Q116 WeakPolarHBondContact O-CB 3.26Å; D112-Q116 VanDerWaalsContact O-CG 3.22Å; D112-Q116 WeakPolarHBondContact O-CG 3.39Å; D112-Q116 PolarHBondContact O-N 3.15Å; Q113-Q116 PolarHBondContact O-N 3.12Å; A114-Q116 VanDerWaalsContact C-N 3.35Å; A114-Q116 PolarHBondContact O-N 2.94Å; Q116-F119 PolarHBondContact O-N 2.72Å; Q116-A120 WeakPolarHBondContact O-CB 3.41Å; Q116-A120 PolarHBondContact O-N 3.11Å
117	L	88.3	Confident	89	Confident	40 Å²	40	49.1 Å²	49.1	21%	0.209	25%	0.249	C	C	.	.	H	α-helix	trans	-64.2	-46.8	175.7	176	135.6	0	0	0	111.7	L77 L95 Q113 A114 F119 A120 I121 V133	L77-L117 HydrophobicContact CD1-CD2 4.28Å; L95-L117 HydrophobicContact CB-CD1 3.82Å; L95-L117 HydrophobicContact CD2-CB 4.29Å; L95-L117 HydrophobicContact CD2-CD1 3.9Å; L95-L117 HydrophobicContact CD2-CG 4.49Å; L95-L117 HydrophobicContact CG-CD1 4.45Å; Q113-L117 PolarHBondContact O-N 2.96Å; A114-L117 PolarHBondContact O-N 3.05Å; L117-F119 VanDerWaalsContact C-N 3.27Å; L117-F119 PolarHBondContact O-N 2.72Å; L117-A120 PolarHBondContact O-N 2.83Å; L117-I121 HydrophobicContact CD2-CD1 3.49Å; L117-I121 VanDerWaalsContact CD2-CD1 3.49Å; L117-I121 HydrophobicContact CG-CD1 3.81Å; L117-I121 WeakPolarHBondContact O-CD1 3.48Å; L117-I121 VanDerWaalsContact O-CG1 3.32Å; L117-I121 WeakPolarHBondContact O-CG1 3.49Å; L117-I121 PolarHBondContact O-N 2.88Å; L117-V133 HydrophobicContact CD2-CG2 4.36Å
118	I	90.9	Very high	87.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-64.5	-33.9	179.9	-67.6	169.3	0	0	0	111.3	F53 L77 A114 F115 L122 V133 V135 C151 Y155	F53-I118 HydrophobicContact CD2-CG2 4.26Å; F53-I118 HydrophobicContact CE2-CG2 3.66Å; L77-I118 HydrophobicContact CD1-CD1 4.25Å; A114-I118 WeakPolarHBondContact O-CB 3.39Å; A114-I118 VanDerWaalsContact O-CG1 3.24Å; A114-I118 WeakPolarHBondContact O-CG1 3.37Å; A114-I118 PolarHBondContact O-N 2.86Å; F115-I118 PolarHBondContact O-N 3.24Å; I118-L122 WeakPolarHBondContact O-CB 3.15Å; I118-L122 PolarHBondContact O-N 2.9Å; I118-V133 HydrophobicContact CG1-CG1 4.34Å; I118-V135 HydrophobicContact CD1-CG2 4.07Å; I118-C151 VanDerWaalsContact CD1-SG 3.58Å; I118-Y155 HydrophobicContact CG2-CE2 3.95Å
119	F	91.4	Very high	87	Confident	84 Å²	84	58 Å²	58	37%	0.368	30%	0.3	S	S	.	.	H	α-helix	trans	-70.9	-42.2	175.2	-177.1	-95.5	0	0	0	112.2	F115 Q116 L117 I121 L122 V123 Y155 L208	F115-F119 WeakPolarHBondContact O-CB 3.48Å; F115-F119 PolarHBondContact O-N 2.97Å; Q116-F119 PolarHBondContact O-N 2.72Å; L117-F119 VanDerWaalsContact C-N 3.27Å; L117-F119 PolarHBondContact O-N 2.72Å; F119-I121 PolarHBondContact O-N 2.79Å; F119-L122 WeakPolarHBondContact O-CB 3.49Å; F119-L122 PolarHBondContact O-N 2.81Å; F119-V123 HydrophobicContact CD1-CG2 4.22Å; F119-V123 HydrophobicContact CE1-CG2 3.85Å; F119-V123 HydrophobicContact CZ-CG2 4.12Å; F119-V123 WeakPolarHBondContact O-CG2 3.5Å; F119-V123 PolarHBondContact O-N 3.12Å; F119-Y155 WeakPolarHBondContact CA-OH 3.46Å; F119-Y155 WeakPolarHBondContact CB-OH 3.3Å; F119-Y155 HydrophobicContact CD2-CE1 4.41Å; F119-Y155 PolarHBondContact N-OH 2.8Å; F119-L208 HydrophobicContact CE2-CD1 4.08Å
120	A	87.9	Confident	86.6	Confident	45 Å²	45	57.4 Å²	57.4	37%	0.372	29%	0.291	S	S	.	.	H	α-helix	trans	-58.7	-47.5	174.4	0	0	0	0	0	111.2	Q116 L117 L122 V123 D124	Q116-A120 WeakPolarHBondContact O-CB 3.41Å; Q116-A120 PolarHBondContact O-N 3.11Å; L117-A120 PolarHBondContact O-N 2.83Å; A120-L122 VanDerWaalsContact C-N 3.32Å; A120-L122 PolarHBondContact O-N 2.97Å; A120-V123 WeakPolarHBondContact O-CB 3.47Å; A120-V123 PolarHBondContact O-N 2.91Å; A120-V123 VanDerWaalsContact O-N 3.09Å; A120-D124 PolarHBondContact O-N 3.28Å
121	I	86.1	Confident	86.4	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.015	28%	0.277	C	S	.	.	H	α-helix	trans	-64.1	-36.6	177.8	-62.7	161.6	0	0	0	111.5	Y75 L117 F119 D124 K125 V133	Y75-I121 HydrophobicContact CD1-CD1 3.61Å; Y75-I121 HydrophobicContact CD1-CG1 3.9Å; Y75-I121 HydrophobicContact CD2-CD1 3.92Å; Y75-I121 HydrophobicContact CD2-CG1 3.84Å; Y75-I121 HydrophobicContact CD2-CG2 3.85Å; Y75-I121 HydrophobicContact CE1-CD1 4.26Å; Y75-I121 HydrophobicContact CE1-CG1 4.06Å; Y75-I121 HydrophobicContact CE2-CG1 3.99Å; Y75-I121 HydrophobicContact CE2-CG2 4.18Å; Y75-I121 HydrophobicContact CG-CD1 3.42Å; Y75-I121 VanDerWaalsContact CG-CD1 3.42Å; Y75-I121 HydrophobicContact CG-CG1 3.8Å; Y75-I121 HydrophobicContact CG-CG2 4.46Å; L117-I121 HydrophobicContact CD2-CD1 3.49Å; L117-I121 VanDerWaalsContact CD2-CD1 3.49Å; L117-I121 HydrophobicContact CG-CD1 3.81Å; L117-I121 WeakPolarHBondContact O-CD1 3.48Å; L117-I121 VanDerWaalsContact O-CG1 3.32Å; L117-I121 WeakPolarHBondContact O-CG1 3.49Å; L117-I121 PolarHBondContact O-N 2.88Å; F119-I121 PolarHBondContact O-N 2.79Å; I121-D124 PolarHBondContact O-N 3.35Å; I121-K125 WeakPolarHBondContact O-CB 3.44Å; I121-K125 PolarHBondContact O-N 3.15Å; I121-V133 HydrophobicContact CD1-CB 3.95Å; I121-V133 HydrophobicContact CD1-CG2 4.01Å; I121-V133 HydrophobicContact CG2-CB 4.34Å
122	L	86.8	Confident	86.5	Confident	5 Å²	5	53.9 Å²	53.9	3%	0.026	28%	0.278	C	S	.	.	H	α-helix	trans	-62	-42.9	172	172.6	59.4	0	0	0	111.7	F53 I118 F119 A120 K125 V126 Y155 L208	F53-L122 HydrophobicContact CD1-CD1 3.68Å; F53-L122 HydrophobicContact CD2-CB 4.46Å; F53-L122 HydrophobicContact CE1-CD1 3.9Å; F53-L122 HydrophobicContact CE1-CD2 4.19Å; F53-L122 HydrophobicContact CG-CD1 4.08Å; F53-L122 HydrophobicContact CZ-CD1 4.47Å; F53-L122 HydrophobicContact CZ-CD2 4.13Å; I118-L122 WeakPolarHBondContact O-CB 3.15Å; I118-L122 PolarHBondContact O-N 2.9Å; F119-L122 WeakPolarHBondContact O-CB 3.49Å; F119-L122 PolarHBondContact O-N 2.81Å; A120-L122 VanDerWaalsContact C-N 3.32Å; A120-L122 PolarHBondContact O-N 2.97Å; L122-K125 PolarHBondContact O-N 2.79Å; L122-V126 HydrophobicContact CD1-CG2 4.27Å; L122-V126 WeakPolarHBondContact O-CG2 3.47Å; L122-V126 PolarHBondContact O-N 2.83Å; L122-Y155 HydrophobicContact CD2-CE1 4.08Å; L122-L208 HydrophobicContact CD2-CD1 4Å; L122-L208 HydrophobicContact CD2-CD2 4.32Å
123	V	86.2	Confident	86.7	Confident	32 Å²	32	49.8 Å²	49.8	19%	0.194	26%	0.256	C	S	.	.	H	α-helix	trans	-64.6	-43.7	176.5	168.3	0	0	0	0	111.3	F119 A120 V126 R127	F119-V123 HydrophobicContact CD1-CG2 4.22Å; F119-V123 HydrophobicContact CE1-CG2 3.85Å; F119-V123 HydrophobicContact CZ-CG2 4.12Å; F119-V123 WeakPolarHBondContact O-CG2 3.5Å; F119-V123 PolarHBondContact O-N 3.12Å; A120-V123 WeakPolarHBondContact O-CB 3.47Å; A120-V123 PolarHBondContact O-N 2.91Å; A120-V123 VanDerWaalsContact O-N 3.09Å; V123-V126 PolarHBondContact O-N 3.49Å; V123-R127 HydrophobicContact CG1-CG 4.47Å; V123-R127 VanDerWaalsContact CG1-CZ 3.45Å; V123-R127 WeakPolarHBondContact O-CB 3.41Å; V123-R127 VanDerWaalsContact O-CG 3.27Å; V123-R127 WeakPolarHBondContact O-CG 3.43Å; V123-R127 PolarHBondContact O-N 3.34Å
124	D	81.9	Confident	87.1	Confident	57 Å²	57	45.2 Å²	45.2	31%	0.305	24%	0.235	S	C	.	.	H	α-helix	trans	-70.2	-34.6	179.1	-67.9	-29.5	0	0	0	112.5	A120 I121 R127 N128 T129	A120-D124 PolarHBondContact O-N 3.28Å; I121-D124 PolarHBondContact O-N 3.35Å; D124-R127 PolarHBondContact O-N 3.28Å; D124-N128 PolarHBondContact O-N 3.3Å; D124-T129 PolarHBondContact O-N 2.97Å; D124-T129 PolarHBondContact O-OG1 3.44Å
125	K	83.1	Confident	87.3	Confident	34 Å²	34	45.2 Å²	45.2	15%	0.148	24%	0.235	C	C	.	.	I	π-helix	trans	-60	-44.9	171.2	-175.3	-175	-167.4	65.5	0	112	F53 I121 L122 R127 N130 A131 N132	F53-K125 HydrophobicContact CB-CD 3.5Å; F53-K125 VanDerWaalsContact CB-CD 3.5Å; I121-K125 WeakPolarHBondContact O-CB 3.44Å; I121-K125 PolarHBondContact O-N 3.15Å; L122-K125 PolarHBondContact O-N 2.79Å; K125-R127 VanDerWaalsContact C-N 3.35Å; K125-N130 WeakPolarHBondContact CE-OD1 3.43Å; K125-N130 PolarHBondContact NZ-O 2.86Å; K125-N130 PolarHBondContact NZ-OD1 3.19Å; K125-A131 WeakPolarHBondContact CD-O 3.17Å; K125-A131 VanDerWaalsContact CG-O 3.31Å; K125-A131 WeakPolarHBondContact CG-O 3.4Å; K125-A131 PolarHBondContact NZ-O 3.18Å; K125-N132 PolarHBondContact NZ-OD1 2.86Å
126	V	79	Confident	87.6	Confident	80 Å²	80	45 Å²	45	49%	0.485	23%	0.234	S	C	.	.	I	π-helix	trans	-70.2	-32.4	178.1	168.7	0	0	0	0	111.5	L122 V123 F256	L122-V126 HydrophobicContact CD1-CG2 4.27Å; L122-V126 WeakPolarHBondContact O-CG2 3.47Å; L122-V126 PolarHBondContact O-N 2.83Å; V123-V126 PolarHBondContact O-N 3.49Å; V126-F256 HydrophobicContact CG1-CD2 4.45Å; V126-F256 HydrophobicContact CG1-CE2 4.43Å
127	R	81.4	Confident	87.9	Confident	134 Å²	134	39.1 Å²	39.1	51%	0.506	21%	0.207	S	C	.	.	I	π-helix	trans	-82.3	-56.4	-176.7	-75	174	173.8	171.8	-2.7	114.1	V123 D124 K125	V123-R127 HydrophobicContact CG1-CG 4.47Å; V123-R127 VanDerWaalsContact CG1-CZ 3.45Å; V123-R127 WeakPolarHBondContact O-CB 3.41Å; V123-R127 VanDerWaalsContact O-CG 3.27Å; V123-R127 WeakPolarHBondContact O-CG 3.43Å; V123-R127 PolarHBondContact O-N 3.34Å; D124-R127 PolarHBondContact O-N 3.28Å; K125-R127 VanDerWaalsContact C-N 3.35Å
128	N	71.8	Confident	88.3	Confident	143 Å²	143	41.4 Å²	41.4	77%	0.765	22%	0.219	S	C	*	.	I	π-helix	trans	-143.7	-40.9	-163.6	-66.3	-55.6	0	0	0	115.5	D124	D124-N128 PolarHBondContact O-N 3.3Å
129	T	74.3	Confident	88.5	Confident	77 Å²	77	43.7 Å²	43.7	47%	0.472	24%	0.237	S	C	.	.	I	π-helix	trans	-95.5	-20.8	-160.5	59.2	0	0	0	0	114.7	D124 A131	D124-T129 PolarHBondContact O-N 2.97Å; D124-T129 PolarHBondContact O-OG1 3.44Å; T129-A131 PolarHBondContact O-N 2.8Å; T129-A131 VanDerWaalsContact O-N 3.12Å; T129-A131 WeakPolarHBondContact OG1-CB 3.39Å; T129-A131 PolarHBondContact OG1-N 2.95Å
130	N	85.2	Confident	88.8	Confident	78 Å²	78	39.7 Å²	39.7	42%	0.417	22%	0.22	S	C	.	.			trans	51.3	24.4	-166.3	-161.9	1.2	0	0	0	114.1	K125	K125-N130 WeakPolarHBondContact CE-OD1 3.43Å; K125-N130 PolarHBondContact NZ-O 2.86Å; K125-N130 PolarHBondContact NZ-OD1 3.19Å
131	A	89.7	Confident	89.3	Confident	1 Å²	1	41 Å²	41	1%	0.008	22%	0.22	C	C	.	.			trans	-63.1	160.5	-176.8	0	0	0	0	0	114	D74 Y75 K125 T129	D74-A131 HydrophobicContact CB-CB 4.23Å; D74-A131 WeakPolarHBondContact OD2-CA 3.43Å; D74-A131 WeakPolarHBondContact OD2-CB 3.42Å; Y75-A131 HydrophobicContact CD2-CB 4.12Å; Y75-A131 HydrophobicContact CE2-CB 3.9Å; K125-A131 WeakPolarHBondContact CD-O 3.17Å; K125-A131 VanDerWaalsContact CG-O 3.31Å; K125-A131 WeakPolarHBondContact CG-O 3.4Å; K125-A131 PolarHBondContact NZ-O 3.18Å; T129-A131 PolarHBondContact O-N 2.8Å; T129-A131 VanDerWaalsContact O-N 3.12Å; T129-A131 WeakPolarHBondContact OG1-CB 3.39Å; T129-A131 PolarHBondContact OG1-N 2.95Å
132	N	94.5	Very high	89.8	Confident	6 Å²	6	41.1 Å²	41.1	3%	0.032	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	158.6	169.5	-54.9	-81.4	0	0	0	111.3	P52 F53 Y55 H71 R72 I73 D74 Y75 K125	P52-N132 PolarHBondContact O-OD1 2.91Å; P52-N132 VanDerWaalsContact O-OD1 3.1Å; F53-N132 WeakPolarHBondContact CA-OD1 3.42Å; F53-N132 WeakPolarHBondContact O-CA 3.47Å; Y55-N132 HydrophobicContact CD2-CB 3.96Å; Y55-N132 HydrophobicContact CE2-CB 3.85Å; H71-N132 PolarHBondContact O-ND2 2.76Å; R72-N132 VanDerWaalsContact O-CB 3.27Å; R72-N132 WeakPolarHBondContact O-CB 3.45Å; R72-N132 PolarHBondContact O-N 3.48Å; R72-N132 PolarHBondContact O-ND2 2.89Å; I73-N132 HydrophobicContact CG1-CB 4.13Å; D74-N132 PolarHBondContact N-O 2.74Å; Y75-N132 PolarHBondContact N-O 3.11Å; K125-N132 PolarHBondContact NZ-OD1 2.86Å
133	V	96.1	Very high	90.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.4	176	60.5	0	0	0	0	111.5	F53 L54 Y55 Y75 L117 I118 I121	F53-V133 PolarHBondContact O-N 3.24Å; L54-V133 HydrophobicContact CD1-CG1 3.89Å; Y55-V133 PolarHBondContact N-O 2.91Å; Y75-V133 WeakPolarHBondContact O-CA 3.36Å; L117-V133 HydrophobicContact CD2-CG2 4.36Å; I118-V133 HydrophobicContact CG1-CG1 4.34Å; I121-V133 HydrophobicContact CD1-CB 3.95Å; I121-V133 HydrophobicContact CD1-CG2 4.01Å; I121-V133 HydrophobicContact CG2-CB 4.34Å
134	L	97.6	Very high	90.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	117.8	168.6	171.9	58.9	0	0	0	110.3	P47 D61 A62 L68 I73 Y75 L77 H136	P47-L134 HydrophobicContact CB-CD1 3.69Å; D61-L134 HydrophobicContact CB-CD2 4.49Å; A62-L134 HydrophobicContact CB-CD2 3.82Å; L68-L134 HydrophobicContact CD2-CD2 3.72Å; I73-L134 HydrophobicContact CD1-CB 4.29Å; I73-L134 HydrophobicContact CG2-CB 3.59Å; Y75-L134 PolarHBondContact O-N 2.92Å; L77-L134 PolarHBondContact N-O 2.98Å; L134-H136 HydrophobicContact CD1-CB 4.29Å; L134-H136 HydrophobicContact CD2-CB 4.41Å; L134-H136 HydrophobicContact CG-CB 4.09Å
135	V	98.1	Very high	91.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	114.7	166.8	179.7	0	0	0	0	108.2	L54 Y55 L56 G57 L77 M79 I118 L147 V148	L54-V135 HydrophobicContact CD1-CB 4.39Å; L54-V135 HydrophobicContact CD1-CG2 3.57Å; Y55-V135 PolarHBondContact O-N 2.96Å; L56-V135 WeakPolarHBondContact CA-O 3.43Å; G57-V135 PolarHBondContact N-O 3.02Å; G57-V135 VanDerWaalsContact N-O 3.13Å; L77-V135 HydrophobicContact CB-CG2 4.2Å; L77-V135 HydrophobicContact CD1-CG2 4.25Å; L77-V135 HydrophobicContact CD2-CG1 4.45Å; M79-V135 HydrophobicContact CG-CG1 4.43Å; M79-V135 HydrophobicContact SD-CG1 4.22Å; I118-V135 HydrophobicContact CD1-CG2 4.07Å; V135-L147 HydrophobicContact CG1-CB 4.48Å; V135-L147 HydrophobicContact CG1-CD2 3.9Å; V135-L147 HydrophobicContact CG1-CG 4.4Å; V135-V148 HydrophobicContact CB-CG2 3.74Å; V135-V148 HydrophobicContact CG1-CG2 3.81Å; V135-V148 HydrophobicContact CG2-CG2 4.25Å
136	H	98	Very high	92.5	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.009	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	163.9	-176.6	86.8	113.9	0	0	0	113.6	G57 S58 A62 V76 L77 N78 M79 L134 S144	G57-H136 VanDerWaalsContact O-CA 3.29Å; G57-H136 WeakPolarHBondContact O-CA 3.49Å; G57-H136 WeakPolarHBondContact O-CB 3.17Å; S58-H136 WeakPolarHBondContact O-CB 3.38Å; S58-H136 PolarHBondContact O-ND1 3.43Å; A62-H136 HydrophobicContact CB-CB 4.49Å; A62-H136 VanDerWaalsContact CB-CE1 3.49Å; A62-H136 WeakPolarHBondContact CB-CE1 3.28Å; A62-H136 WeakPolarHBondContact CB-ND1 3.37Å; V76-H136 VanDerWaalsContact CG1-CD2 3.43Å; V76-H136 WeakPolarHBondContact CG1-CD2 3.49Å; L77-H136 PolarHBondContact O-CD2 3.31Å; L77-H136 PolarHBondContact O-N 3.16Å; N78-H136 WeakPolarHBondContact CA-NE2 3.45Å; N78-H136 WeakPolarHBondContact CB-NE2 3.31Å; N78-H136 VanDerWaalsContact CG-NE2 3.26Å; N78-H136 PolarHBondContact ND2-NE2 3.06Å; M79-H136 WeakPolarHBondContact CB-O 3.37Å; M79-H136 PolarHBondContact N-O 3.47Å; L134-H136 HydrophobicContact CD1-CB 4.29Å; L134-H136 HydrophobicContact CD2-CB 4.41Å; L134-H136 HydrophobicContact CG-CB 4.09Å; H136-S144 VanDerWaalsContact C-CB 3.41Å
137	C	97.4	Very high	93.4	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.007	17%	0.171	C	C	.	.			trans	-141.2	-167.8	166	78.2	0	0	0	0	107.4	G57 S58 Q59 M79 A139 G140 R143 S144	G57-C137 PolarHBondContact O-N 3.19Å; S58-C137 CarbonylContact C-O 3.52Å; S58-C137 VanDerWaalsContact CA-O 3.25Å; S58-C137 WeakPolarHBondContact CA-O 3.44Å; Q59-C137 PolarHBondContact N-O 3.35Å; M79-C137 HydrophobicContact CB-CB 4.17Å; M79-C137 VanDerWaalsContact O-CB 3.3Å; M79-C137 WeakPolarHBondContact O-CB 3.31Å; C137-A139 PolarHBondContact O-N 3.17Å; C137-G140 PolarHBondContact SG-N 3.21Å; C137-G140 VanDerWaalsContact SG-N 3.36Å; C137-R143 HydrophobicContact CB-CB 3.79Å; C137-S144 PolarHBondContact N-OG 3.26Å; C137-S144 VanDerWaalsContact N-OG 3.12Å; C137-S144 PolarHBondContact SG-OG 3.08Å; C137-S144 VanDerWaalsContact SG-OG 3.34Å
138	L	96.8	Very high	94.2	Very high	88 Å²	88	26.1 Å²	26.1	46%	0.461	15%	0.147	S	C	.	.	S	Bend	trans	-51.7	-49.2	-179	-176.9	61	0	0	0	113.7	Q59 Q60	Q59-L138 HydrophobicContact CB-CD1 4.33Å; Q59-L138 PolarHBondContact N-O 2.72Å; Q59-L138 VanDerWaalsContact OE1-CD1 3.3Å; Q60-L138 PolarHBondContact OE1-O 3.4Å
139	A	96.1	Very high	95.4	Very high	47 Å²	47	19.3 Å²	19.3	39%	0.388	11%	0.11	S	C	.	.	S	Bend	trans	-120.2	-8.3	-173.7	0	0	0	0	0	115	C137 I141	C137-A139 PolarHBondContact O-N 3.17Å; A139-I141 VanDerWaalsContact C-N 3.32Å; A139-I141 HydrophobicContact CB-CD1 4.01Å; A139-I141 HydrophobicContact CB-CG1 4.15Å; A139-I141 PolarHBondContact O-N 3.36Å
140	G	96.8	Very high	96.5	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.088	C	C	.	.	S	Bend	trans	68	27.1	-176.1	0	0	0	0	0	115	G57 C137 P145 R171	G57-G140 WeakPolarHBondContact O-CA 3.38Å; C137-G140 PolarHBondContact SG-N 3.21Å; C137-G140 VanDerWaalsContact SG-N 3.36Å; G140-P145 VanDerWaalsContact O-CG 3.31Å; G140-P145 WeakPolarHBondContact O-CG 3.47Å; G140-R171 PolarHBondContact O-NE 3.45Å
141	I	97.8	Very high	97.1	Very high	73 Å²	73	12 Å²	12	37%	0.374	7%	0.068	S	C	.	.	S	Bend	trans	-107	-45	-174.6	-66.4	174.3	0	0	0	113.2	A139 P145 S175	A139-I141 VanDerWaalsContact C-N 3.32Å; A139-I141 HydrophobicContact CB-CD1 4.01Å; A139-I141 HydrophobicContact CB-CG1 4.15Å; A139-I141 PolarHBondContact O-N 3.36Å; I141-P145 WeakPolarHBondContact O-CG 3.44Å; I141-S175 CarbonylContact O-C 3.45Å; I141-S175 VanDerWaalsContact O-C 3.31Å; I141-S175 PolarHBondContact O-N 2.72Å
142	S	98.1	Very high	97.4	Very high	6 Å²	6	11.9 Å²	11.9	4%	0.042	7%	0.067	C	C	.	.	S	Bend	trans	-122.4	-67.4	-171.6	167.7	0	0	0	0	113.6	D101 P145 T146 N177 F180	D101-S142 WeakPolarHBondContact OD1-CB 3.15Å; D101-S142 PolarHBondContact OD1-OG 2.93Å; D101-S142 WeakPolarHBondContact OD2-CB 3.15Å; S142-P145 WeakPolarHBondContact O-CD 3.19Å; S142-T146 PolarHBondContact O-N 3.39Å; S142-T146 PolarHBondContact O-OG1 3.21Å; S142-N177 PolarHBondContact OG-N 3.5Å; S142-F180 VanDerWaalsContact OG-CD2 3.32Å; S142-F180 WeakPolarHBondContact OG-CD2 3.37Å; S142-F180 WeakPolarHBondContact OG-CE2 3.37Å
143	R	98.2	Very high	97.5	Very high	26 Å²	26	11.7 Å²	11.7	10%	0.098	7%	0.066	C	C	.	.	H	α-helix	trans	-53.4	-63.4	179.6	-77.2	167	-79	175.3	0.1	114.8	M79 V99 N100 D101 C137 T146 L147 F180	M79-R143 HydrophobicContact CB-CB 4.17Å; M79-R143 WeakPolarHBondContact O-CD 3.28Å; V99-R143 HydrophobicContact CG2-CG 4.13Å; V99-R143 WeakPolarHBondContact O-CD 3Å; V99-R143 PolarHBondContact O-NH1 2.9Å; N100-R143 WeakPolarHBondContact O-CD 3.33Å; D101-R143 HydrophobicContact CB-CG 4.44Å; D101-R143 WeakPolarHBondContact OD2-CG 3.37Å; D101-R143 IonicContact OD2-CZ 3.59Å; D101-R143 PolarHBondContact OD2-N 2.91Å; D101-R143 IonicContact OD2-NE 2.68Å; D101-R143 PolarHBondContact OD2-NE 3.32Å; D101-R143 IonicContact OD2-NH2 2.81Å; C137-R143 HydrophobicContact CB-CB 3.79Å; R143-T146 WeakPolarHBondContact O-CB 3.47Å; R143-T146 PolarHBondContact O-N 3.11Å; R143-T146 VanDerWaalsContact O-N 3.15Å; R143-L147 PolarHBondContact O-N 3.13Å; R143-F180 HydrophobicContact CG-CE2 3.67Å; R143-F180 HydrophobicContact CG-CZ 4.11Å
144	S	98	Very high	97.4	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-63.7	-41	-178.4	39	0	0	0	0	113.8	G57 H136 C137 T146 L147 V148	G57-S144 PolarHBondContact O-OG 3.19Å; H136-S144 VanDerWaalsContact C-CB 3.41Å; C137-S144 PolarHBondContact N-OG 3.26Å; C137-S144 VanDerWaalsContact N-OG 3.12Å; C137-S144 PolarHBondContact SG-OG 3.08Å; C137-S144 VanDerWaalsContact SG-OG 3.34Å; S144-T146 VanDerWaalsContact C-N 3.26Å; S144-T146 PolarHBondContact O-N 2.9Å; S144-L147 PolarHBondContact O-N 3.43Å; S144-V148 WeakPolarHBondContact O-CB 3.41Å; S144-V148 WeakPolarHBondContact O-CG2 3.06Å; S144-V148 PolarHBondContact O-N 3.07Å
145	P	98.3	Very high	97.1	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-58.2	-34.8	171.6	-30.8	40.1	0	0	0	113.9	L56 G140 I141 S142 V148 I149 I174 P176	L56-P145 HydrophobicContact CD1-CG 3.89Å; L56-P145 HydrophobicContact CD2-CB 4.35Å; L56-P145 HydrophobicContact CD2-CG 4.07Å; G140-P145 VanDerWaalsContact O-CG 3.31Å; G140-P145 WeakPolarHBondContact O-CG 3.47Å; I141-P145 WeakPolarHBondContact O-CG 3.44Å; S142-P145 WeakPolarHBondContact O-CD 3.19Å; P145-V148 PolarHBondContact O-N 3.43Å; P145-I149 WeakPolarHBondContact O-CB 3.1Å; P145-I149 WeakPolarHBondContact O-CD1 3.46Å; P145-I149 WeakPolarHBondContact O-CG1 3.22Å; P145-I149 PolarHBondContact O-N 2.95Å; P145-I174 HydrophobicContact CB-CB 3.82Å; P145-I174 HydrophobicContact CB-CD1 4.43Å; P145-I174 HydrophobicContact CB-CG2 3.66Å; P145-I174 HydrophobicContact CG-CB 3.93Å; P145-I174 HydrophobicContact CG-CG2 3.46Å; P145-I174 VanDerWaalsContact CG-CG2 3.46Å; P145-P176 HydrophobicContact CB-CG 4.2Å
146	T	98.4	Very high	96.9	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-60.4	-51.6	177.4	-56.7	0	0	0	0	111.3	L107 F111 S142 R143 S144 V148 I149 A150 F180 L184	L107-T146 HydrophobicContact CD2-CG2 3.83Å; F111-T146 HydrophobicContact CZ-CG2 4.25Å; S142-T146 PolarHBondContact O-N 3.39Å; S142-T146 PolarHBondContact O-OG1 3.21Å; R143-T146 WeakPolarHBondContact O-CB 3.47Å; R143-T146 PolarHBondContact O-N 3.11Å; R143-T146 VanDerWaalsContact O-N 3.15Å; S144-T146 VanDerWaalsContact C-N 3.26Å; S144-T146 PolarHBondContact O-N 2.9Å; T146-V148 VanDerWaalsContact C-N 3.32Å; T146-V148 PolarHBondContact O-N 3.07Å; T146-I149 PolarHBondContact O-N 3.4Å; T146-A150 PolarHBondContact O-N 3.33Å; T146-F180 HydrophobicContact CG2-CB 3.79Å; T146-F180 HydrophobicContact CG2-CG 4.33Å; T146-F180 WeakPolarHBondContact OG1-CB 3.25Å; T146-F180 WeakPolarHBondContact OG1-CD2 3.38Å; T146-L184 HydrophobicContact CG2-CD1 4.06Å; T146-L184 HydrophobicContact CG2-CD2 4.23Å; T146-L184 HydrophobicContact CG2-CG 4Å
147	L	98.1	Very high	96.7	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-63.9	-38.8	177.4	174.4	61.1	0	0	0	111.8	L77 M79 I97 F111 A114 F115 V135 R143 S144 A150 C151	L77-L147 HydrophobicContact CD1-CD2 3.8Å; L77-L147 HydrophobicContact CD2-CD2 3.98Å; M79-L147 HydrophobicContact CE-CB 3.87Å; M79-L147 HydrophobicContact CE-CD2 4.06Å; M79-L147 HydrophobicContact CG-CD2 4.32Å; M79-L147 HydrophobicContact SD-CB 3.39Å; M79-L147 WeakPolarHBondContact SD-CB 3.33Å; M79-L147 HydrophobicContact SD-CD2 3.52Å; M79-L147 VanDerWaalsContact SD-CD2 3.52Å; M79-L147 HydrophobicContact SD-CG 4.1Å; I97-L147 HydrophobicContact CD1-CD2 4.42Å; F111-L147 HydrophobicContact CD1-CD1 3.88Å; F111-L147 HydrophobicContact CE1-CD1 4.22Å; A114-L147 HydrophobicContact CB-CD1 3.58Å; A114-L147 HydrophobicContact CB-CD2 3.68Å; A114-L147 HydrophobicContact CB-CG 4.24Å; F115-L147 HydrophobicContact CE1-CD1 4.29Å; V135-L147 HydrophobicContact CG1-CB 4.48Å; V135-L147 HydrophobicContact CG1-CD2 3.9Å; V135-L147 HydrophobicContact CG1-CG 4.4Å; R143-L147 PolarHBondContact O-N 3.13Å; S144-L147 PolarHBondContact O-N 3.43Å; L147-A150 WeakPolarHBondContact O-CB 3.35Å; L147-A150 PolarHBondContact O-N 2.98Å; L147-C151 PolarHBondContact O-N 3.49Å; L147-C151 PolarHBondContact O-SG 2.94Å
148	V	98.2	Very high	96.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-66.4	-37.8	178.4	168.6	0	0	0	0	112.1	I50 L54 L56 V135 S144 P145 T146 C151 V152 V167	I50-V148 HydrophobicContact CB-CG1 4.18Å; I50-V148 HydrophobicContact CG1-CG1 3.93Å; I50-V148 HydrophobicContact CG2-CG1 3.82Å; L54-V148 HydrophobicContact CD2-CG1 4.33Å; L56-V148 HydrophobicContact CB-CG2 4.33Å; L56-V148 HydrophobicContact CD1-CG2 4.03Å; L56-V148 HydrophobicContact CD2-CG1 4.27Å; V135-V148 HydrophobicContact CB-CG2 3.74Å; V135-V148 HydrophobicContact CG1-CG2 3.81Å; V135-V148 HydrophobicContact CG2-CG2 4.25Å; S144-V148 WeakPolarHBondContact O-CB 3.41Å; S144-V148 WeakPolarHBondContact O-CG2 3.06Å; S144-V148 PolarHBondContact O-N 3.07Å; P145-V148 PolarHBondContact O-N 3.43Å; T146-V148 VanDerWaalsContact C-N 3.32Å; T146-V148 PolarHBondContact O-N 3.07Å; V148-C151 WeakPolarHBondContact O-CB 3.45Å; V148-C151 PolarHBondContact O-N 2.83Å; V148-V152 WeakPolarHBondContact O-CG2 3.19Å; V148-V152 PolarHBondContact O-N 3.33Å; V148-V167 HydrophobicContact CG1-CG1 4.06Å; V148-V167 HydrophobicContact CG1-CG2 4.04Å
149	I	98.4	Very high	96.6	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.9	-45.7	171.5	-68.1	161.1	0	0	0	109.9	P145 T146 C151 V152 M153 A163 Y164 V167 I174 P176 L184	P145-I149 WeakPolarHBondContact O-CB 3.1Å; P145-I149 WeakPolarHBondContact O-CD1 3.46Å; P145-I149 WeakPolarHBondContact O-CG1 3.22Å; P145-I149 PolarHBondContact O-N 2.95Å; T146-I149 PolarHBondContact O-N 3.4Å; I149-C151 VanDerWaalsContact C-N 3.27Å; I149-C151 PolarHBondContact O-N 3.02Å; I149-V152 PolarHBondContact O-N 3.33Å; I149-V152 VanDerWaalsContact O-N 3.08Å; I149-M153 HydrophobicContact CG2-CG 4.41Å; I149-M153 HydrophobicContact CG2-SD 4.12Å; I149-M153 VanDerWaalsContact O-CG 3.31Å; I149-M153 WeakPolarHBondContact O-CG 3.49Å; I149-M153 PolarHBondContact O-N 2.85Å; I149-A163 HydrophobicContact CG2-CB 3.78Å; I149-Y164 HydrophobicContact CD1-CD2 3.75Å; I149-Y164 HydrophobicContact CD1-CG 4.37Å; I149-V167 HydrophobicContact CG1-CB 4.07Å; I149-V167 HydrophobicContact CG1-CG2 3.88Å; I149-I174 HydrophobicContact CD1-CD1 4.18Å; I149-P176 HydrophobicContact CD1-CG 4.02Å; I149-L184 HydrophobicContact CB-CD1 4.13Å; I149-L184 HydrophobicContact CB-CD2 4.36Å; I149-L184 HydrophobicContact CD1-CD1 4.26Å; I149-L184 HydrophobicContact CG2-CD1 3.84Å; I149-L184 HydrophobicContact CG2-CD2 4.09Å
150	A	97.8	Very high	96.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60	-36.4	175.6	0	0	0	0	0	112.5	F111 F115 T146 L147 R154 L184 F187	F111-A150 HydrophobicContact CD2-CB 3.97Å; F111-A150 HydrophobicContact CE1-CB 4.21Å; F111-A150 HydrophobicContact CE2-CB 3.55Å; F111-A150 HydrophobicContact CG-CB 4.47Å; F111-A150 HydrophobicContact CZ-CB 3.68Å; F115-A150 HydrophobicContact CE1-CB 4.22Å; F115-A150 HydrophobicContact CZ-CB 3.92Å; T146-A150 PolarHBondContact O-N 3.33Å; L147-A150 WeakPolarHBondContact O-CB 3.35Å; L147-A150 PolarHBondContact O-N 2.98Å; A150-R154 PolarHBondContact O-N 3.35Å; A150-L184 HydrophobicContact CB-CD2 3.78Å; A150-F187 HydrophobicContact CB-CD1 3.94Å; A150-F187 HydrophobicContact CB-CE1 3.9Å; A150-F187 WeakPolarHBondContact O-CE1 3.45Å
151	C	96.1	Very high	96.7	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.6	-48.4	171.6	-65.1	0	0	0	0	111.1	L54 F115 I118 L147 V148 I149 M153 R154 Y155	L54-C151 HydrophobicContact CD2-CB 4.04Å; F115-C151 HydrophobicContact CE1-CB 4.37Å; I118-C151 VanDerWaalsContact CD1-SG 3.58Å; L147-C151 PolarHBondContact O-N 3.49Å; L147-C151 PolarHBondContact O-SG 2.94Å; V148-C151 WeakPolarHBondContact O-CB 3.45Å; V148-C151 PolarHBondContact O-N 2.83Å; I149-C151 VanDerWaalsContact C-N 3.27Å; I149-C151 PolarHBondContact O-N 3.02Å; C151-M153 VanDerWaalsContact C-N 3.35Å; C151-M153 PolarHBondContact O-N 3.25Å; C151-R154 PolarHBondContact O-N 2.83Å; C151-Y155 HydrophobicContact CB-CD2 4.17Å; C151-Y155 HydrophobicContact CB-CE2 4.39Å; C151-Y155 WeakPolarHBondContact O-CB 3.39Å; C151-Y155 WeakPolarHBondContact O-CD2 3.48Å; C151-Y155 PolarHBondContact O-N 3.35Å
152	V	97	Very high	96.7	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.6	-41.1	178.8	170.8	0	0	0	0	111.5	I50 L51 V148 I149 R154 L156 M158 A163 Y166 V167	I50-V152 HydrophobicContact CG2-CG2 3.91Å; L51-V152 HydrophobicContact CD2-CG2 4.49Å; V148-V152 WeakPolarHBondContact O-CG2 3.19Å; V148-V152 PolarHBondContact O-N 3.33Å; I149-V152 PolarHBondContact O-N 3.33Å; I149-V152 VanDerWaalsContact O-N 3.08Å; V152-R154 PolarHBondContact O-N 3.14Å; V152-L156 HydrophobicContact CG1-CD1 4.12Å; V152-L156 HydrophobicContact CG1-CG 4.43Å; V152-L156 WeakPolarHBondContact O-CB 3.35Å; V152-L156 PolarHBondContact O-N 3.29Å; V152-M158 HydrophobicContact CG1-SD 3.76Å; V152-A163 HydrophobicContact CB-CB 4.06Å; V152-A163 HydrophobicContact CG1-CB 3.69Å; V152-Y166 HydrophobicContact CG1-CD1 3.83Å; V152-Y166 HydrophobicContact CG1-CE1 4.42Å; V152-Y166 HydrophobicContact CG1-CG 4.23Å; V152-Y166 HydrophobicContact CG2-CD1 3.99Å; V152-Y166 HydrophobicContact CG2-CE1 4.17Å; V152-V167 HydrophobicContact CG2-CG2 3.95Å
153	M	97	Very high	96.8	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-57.3	-47.6	172.5	-65.8	165.6	63.6	0	0	111.7	I149 C151 R157 M158 A163 L184 F187 E188 L191	I149-M153 HydrophobicContact CG2-CG 4.41Å; I149-M153 HydrophobicContact CG2-SD 4.12Å; I149-M153 VanDerWaalsContact O-CG 3.31Å; I149-M153 WeakPolarHBondContact O-CG 3.49Å; I149-M153 PolarHBondContact O-N 2.85Å; C151-M153 VanDerWaalsContact C-N 3.35Å; C151-M153 PolarHBondContact O-N 3.25Å; M153-R157 WeakPolarHBondContact O-CA 3.39Å; M153-R157 PolarHBondContact O-N 3.03Å; M153-R157 VanDerWaalsContact O-N 3.08Å; M153-M158 WeakPolarHBondContact CA-O 3.41Å; M153-M158 PolarHBondContact O-N 3.43Å; M153-A163 HydrophobicContact CB-CB 4.44Å; M153-A163 HydrophobicContact CG-CB 3.44Å; M153-A163 VanDerWaalsContact CG-CB 3.44Å; M153-L184 HydrophobicContact SD-CD2 3.91Å; M153-F187 HydrophobicContact CB-CE1 4.41Å; M153-F187 HydrophobicContact CE-CD1 3.75Å; M153-F187 HydrophobicContact CE-CE1 4.44Å; M153-F187 HydrophobicContact SD-CD1 4.12Å; M153-E188 HydrophobicContact CE-CB 3.58Å; M153-E188 HydrophobicContact CE-CG 3.98Å; M153-L191 HydrophobicContact CB-CD1 3.97Å; M153-L191 HydrophobicContact CE-CD1 4.33Å
154	R	93.9	Very high	96.8	Very high	65 Å²	65	31.5 Å²	31.5	25%	0.245	14%	0.142	C	C	.	.	H	α-helix	trans	-71	-44.4	-177.8	-169.3	172.7	-173	139.9	1	112.8	D112 A150 C151 V152 F187 L191	D112-R154 IonicContact OD1-CZ 2.78Å; D112-R154 IonicContact OD1-NH1 3.9Å; D112-R154 PolarHBondContact OD1-NH1 3.44Å; A150-R154 PolarHBondContact O-N 3.35Å; C151-R154 PolarHBondContact O-N 2.83Å; V152-R154 PolarHBondContact O-N 3.14Å; R154-F187 HydrophobicContact CB-CZ 4.44Å; R154-L191 HydrophobicContact CB-CD2 4.49Å; R154-L191 HydrophobicContact CG-CD2 4.23Å
155	Y	91.7	Very high	96.8	Very high	33 Å²	33	36.5 Å²	36.5	13%	0.129	16%	0.161	C	C	.	.	H	α-helix	trans	-81	-37.9	-175.1	-75.3	-66.3	0	0	0	113.8	L51 F53 I118 F119 L122 C151 F205	L51-Y155 HydrophobicContact CD1-CD2 4.44Å; F53-Y155 HydrophobicContact CZ-CD2 4.4Å; F53-Y155 HydrophobicContact CZ-CE2 4.42Å; I118-Y155 HydrophobicContact CG2-CE2 3.95Å; F119-Y155 WeakPolarHBondContact CA-OH 3.46Å; F119-Y155 WeakPolarHBondContact CB-OH 3.3Å; F119-Y155 HydrophobicContact CD2-CE1 4.41Å; F119-Y155 PolarHBondContact N-OH 2.8Å; L122-Y155 HydrophobicContact CD2-CE1 4.08Å; C151-Y155 HydrophobicContact CB-CD2 4.17Å; C151-Y155 HydrophobicContact CB-CE2 4.39Å; C151-Y155 WeakPolarHBondContact O-CB 3.39Å; C151-Y155 WeakPolarHBondContact O-CD2 3.48Å; C151-Y155 PolarHBondContact O-N 3.35Å; Y155-F205 HydrophobicContact CD1-CZ 4.05Å; Y155-F205 HydrophobicContact CE1-CZ 4.13Å
156	L	93.6	Very high	96.8	Very high	57 Å²	57	39.3 Å²	39.3	30%	0.298	17%	0.172	S	C	.	.	H	α-helix	trans	-101.3	5.1	-179.6	-53.9	-170.3	0	0	0	113.3	L51 V152 M158 Y166	L51-L156 HydrophobicContact CD2-CD1 4.09Å; L51-L156 HydrophobicContact CD2-CD2 4.48Å; L51-L156 HydrophobicContact CD2-CG 4.4Å; V152-L156 HydrophobicContact CG1-CD1 4.12Å; V152-L156 HydrophobicContact CG1-CG 4.43Å; V152-L156 WeakPolarHBondContact O-CB 3.35Å; V152-L156 PolarHBondContact O-N 3.29Å; L156-M158 HydrophobicContact CB-CE 4.09Å; L156-M158 HydrophobicContact CB-CG 4.02Å; L156-M158 HydrophobicContact CB-SD 4.11Å; L156-M158 HydrophobicContact CD1-CE 3.82Å; L156-M158 HydrophobicContact CD1-SD 4.19Å; L156-M158 PolarHBondContact O-N 3.36Å; L156-M158 VanDerWaalsContact O-N 3.12Å; L156-Y166 HydrophobicContact CD1-CE1 4.41Å; L156-Y166 HydrophobicContact CD1-CE2 4.23Å
157	R	93.7	Very high	96.8	Very high	135 Å²	135	39.3 Å²	39.3	51%	0.509	17%	0.172	S	C	.	.			trans	53.6	28.3	-178.8	-56	-62	-176.7	146.1	1.5	114.2	M153	M153-R157 WeakPolarHBondContact O-CA 3.39Å; M153-R157 PolarHBondContact O-N 3.03Å; M153-R157 VanDerWaalsContact O-N 3.08Å
158	M	95.6	Very high	96.8	Very high	54 Å²	54	42.3 Å²	42.3	27%	0.266	19%	0.185	S	C	.	.			trans	-80.2	150.9	178.6	-72.3	178	177.1	0	0	112.2	V152 M153 L156 E162 A163 Y166	V152-M158 HydrophobicContact CG1-SD 3.76Å; M153-M158 WeakPolarHBondContact CA-O 3.41Å; M153-M158 PolarHBondContact O-N 3.43Å; L156-M158 HydrophobicContact CB-CE 4.09Å; L156-M158 HydrophobicContact CB-CG 4.02Å; L156-M158 HydrophobicContact CB-SD 4.11Å; L156-M158 HydrophobicContact CD1-CE 3.82Å; L156-M158 HydrophobicContact CD1-SD 4.19Å; L156-M158 PolarHBondContact O-N 3.36Å; L156-M158 VanDerWaalsContact O-N 3.12Å; M158-E162 HydrophobicContact CB-CB 4.01Å; M158-E162 HydrophobicContact CG-CB 4.28Å; M158-E162 HydrophobicContact SD-CB 4.48Å; M158-A163 HydrophobicContact CB-CB 4.12Å; M158-Y166 HydrophobicContact CE-CD2 4.23Å; M158-Y166 HydrophobicContact SD-CG 4.48Å
159	S	96.9	Very high	96.7	Very high	28 Å²	28	48.6 Å²	48.6	20%	0.196	22%	0.219	C	C	.	.			trans	-62.9	163.3	164.2	65.3	0	0	0	0	111.6	E161 E162 A163	S159-E161 PolarHBondContact O-N 3.09Å; S159-E162 VanDerWaalsContact CB-OE2 3.24Å; S159-E162 WeakPolarHBondContact CB-OE2 3.45Å; S159-E162 PolarHBondContact N-OE2 2.95Å; S159-E162 PolarHBondContact O-N 3.49Å; S159-E162 VanDerWaalsContact OG-CD 3.25Å; S159-E162 VanDerWaalsContact OG-CG 3.29Å; S159-E162 WeakPolarHBondContact OG-CG 3.48Å; S159-E162 PolarHBondContact OG-N 3.04Å; S159-E162 PolarHBondContact OG-OE2 3.44Å; S159-A163 VanDerWaalsContact O-CB 3.27Å; S159-A163 WeakPolarHBondContact O-CB 3.24Å; S159-A163 PolarHBondContact O-N 3.03Å
160	S	97.1	Very high	96.7	Very high	13 Å²	13	52.4 Å²	52.4	9%	0.091	24%	0.235	C	C	.	.	H	α-helix	trans	-59.6	-32.8	175.9	58	0	0	0	0	112.7	Y164 L185 E188	S160-Y164 WeakPolarHBondContact O-CB 3.32Å; S160-Y164 PolarHBondContact O-N 3.01Å; S160-L185 WeakPolarHBondContact OG-CD2 3.45Å; S160-E188 WeakPolarHBondContact CB-OE2 3.34Å; S160-E188 PolarHBondContact N-OE2 2.98Å; S160-E188 PolarHBondContact OG-OE2 2.96Å
161	E	97.7	Very high	96.7	Very high	116 Å²	116	53.6 Å²	53.6	54%	0.542	24%	0.24	S	C	.	.	H	α-helix	trans	-74	-42.7	177.3	-157.5	-167.9	-175.6	0	0	112.1	S159 Y164 R165	S159-E161 PolarHBondContact O-N 3.09Å; E161-Y164 PolarHBondContact O-N 2.94Å; E161-R165 VanDerWaalsContact CD-CZ 3.47Å; E161-R165 VanDerWaalsContact O-CG 3.28Å; E161-R165 WeakPolarHBondContact O-CG 3.3Å; E161-R165 PolarHBondContact O-N 3.39Å; E161-R165 IonicContact OE1-CZ 2.83Å; E161-R165 IonicContact OE1-NE 3.73Å; E161-R165 IonicContact OE1-NH2 3.71Å; E161-R165 PolarHBondContact OE1-NH2 3.26Å; E161-R165 IonicContact OE2-CZ 2.9Å; E161-R165 IonicContact OE2-NH1 3.76Å; E161-R165 IonicContact OE2-NH2 3.51Å; E161-R165 PolarHBondContact OE2-NH2 3.06Å
162	E	98	Very high	96.7	Very high	96 Å²	96	57.9 Å²	57.9	45%	0.449	27%	0.267	S	S	.	.	H	α-helix	trans	-66.2	-45	176.4	-70	162.3	132.4	0	0	111.6	M158 S159 Y164 R165 Y166	M158-E162 HydrophobicContact CB-CB 4.01Å; M158-E162 HydrophobicContact CG-CB 4.28Å; M158-E162 HydrophobicContact SD-CB 4.48Å; S159-E162 VanDerWaalsContact CB-OE2 3.24Å; S159-E162 WeakPolarHBondContact CB-OE2 3.45Å; S159-E162 PolarHBondContact N-OE2 2.95Å; S159-E162 PolarHBondContact O-N 3.49Å; S159-E162 VanDerWaalsContact OG-CD 3.25Å; S159-E162 VanDerWaalsContact OG-CG 3.29Å; S159-E162 WeakPolarHBondContact OG-CG 3.48Å; S159-E162 PolarHBondContact OG-N 3.04Å; S159-E162 PolarHBondContact OG-OE2 3.44Å; E162-Y164 VanDerWaalsContact C-N 3.35Å; E162-Y164 PolarHBondContact O-N 2.89Å; E162-R165 PolarHBondContact O-N 3.27Å; E162-Y166 WeakPolarHBondContact O-CB 3.43Å; E162-Y166 PolarHBondContact O-N 3.09Å
163	A	98.4	Very high	96.6	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.4	-38.4	175.8	0	0	0	0	0	111.9	I149 V152 M153 M158 S159 Y166 V167	I149-A163 HydrophobicContact CG2-CB 3.78Å; V152-A163 HydrophobicContact CB-CB 4.06Å; V152-A163 HydrophobicContact CG1-CB 3.69Å; M153-A163 HydrophobicContact CB-CB 4.44Å; M153-A163 HydrophobicContact CG-CB 3.44Å; M153-A163 VanDerWaalsContact CG-CB 3.44Å; M158-A163 HydrophobicContact CB-CB 4.12Å; S159-A163 VanDerWaalsContact O-CB 3.27Å; S159-A163 WeakPolarHBondContact O-CB 3.24Å; S159-A163 PolarHBondContact O-N 3.03Å; A163-Y166 PolarHBondContact O-N 3.46Å; A163-V167 WeakPolarHBondContact O-CG2 3.46Å; A163-V167 PolarHBondContact O-N 3.33Å; A163-V167 VanDerWaalsContact O-N 3.12Å
164	Y	98.6	Very high	96.7	Very high	63 Å²	63	60.2 Å²	60.2	25%	0.247	28%	0.284	C	S	.	.	H	α-helix	trans	-59	-49.9	171.6	180	-79.8	0	0	0	111.1	I149 S160 E161 E162 V167 K168 P176 L181	I149-Y164 HydrophobicContact CD1-CD2 3.75Å; I149-Y164 HydrophobicContact CD1-CG 4.37Å; S160-Y164 WeakPolarHBondContact O-CB 3.32Å; S160-Y164 PolarHBondContact O-N 3.01Å; E161-Y164 PolarHBondContact O-N 2.94Å; E162-Y164 VanDerWaalsContact C-N 3.35Å; E162-Y164 PolarHBondContact O-N 2.89Å; Y164-V167 PolarHBondContact O-N 3.48Å; Y164-K168 HydrophobicContact CD1-CB 4.31Å; Y164-K168 HydrophobicContact CE1-CB 4.1Å; Y164-K168 HydrophobicContact CE1-CD 4.32Å; Y164-K168 HydrophobicContact CE1-CG 4.13Å; Y164-K168 WeakPolarHBondContact O-CB 3.32Å; Y164-K168 PolarHBondContact O-N 3.13Å; Y164-P176 HydrophobicContact CE2-CG 4.37Å; Y164-L181 HydrophobicContact CD2-CD2 3.93Å; Y164-L181 HydrophobicContact CE2-CD2 4Å
165	R	98.3	Very high	96.9	Very high	104 Å²	104	60.5 Å²	60.5	39%	0.392	30%	0.296	S	S	.	.	H	α-helix	trans	-58.9	-48.4	177.7	-68.7	166.9	-171.5	157.7	-1.1	111.2	E161 E162 V167 K168 D169	E161-R165 VanDerWaalsContact CD-CZ 3.47Å; E161-R165 VanDerWaalsContact O-CG 3.28Å; E161-R165 WeakPolarHBondContact O-CG 3.3Å; E161-R165 PolarHBondContact O-N 3.39Å; E161-R165 IonicContact OE1-CZ 2.83Å; E161-R165 IonicContact OE1-NE 3.73Å; E161-R165 IonicContact OE1-NH2 3.71Å; E161-R165 PolarHBondContact OE1-NH2 3.26Å; E161-R165 IonicContact OE2-CZ 2.9Å; E161-R165 IonicContact OE2-NH1 3.76Å; E161-R165 IonicContact OE2-NH2 3.51Å; E161-R165 PolarHBondContact OE2-NH2 3.06Å; E162-R165 PolarHBondContact O-N 3.27Å; R165-V167 VanDerWaalsContact C-N 3.32Å; R165-V167 PolarHBondContact O-N 3.34Å; R165-K168 WeakPolarHBondContact O-CB 3.47Å; R165-K168 PolarHBondContact O-N 3.12Å; R165-D169 VanDerWaalsContact O-CG 3.25Å; R165-D169 PolarHBondContact O-N 2.89Å
166	Y	98.4	Very high	97.2	Very high	60 Å²	60	59.1 Å²	59.1	24%	0.235	29%	0.291	C	S	.	.	H	α-helix	trans	-54.3	-43.5	179	-178.8	-89.6	0	0	0	113.1	I50 L51 V152 L156 M158 E162 A163 K170	I50-Y166 HydrophobicContact CG2-CD1 4.37Å; I50-Y166 HydrophobicContact CG2-CE1 3.95Å; I50-Y166 PolarHBondContact O-OH 3.01Å; L51-Y166 HydrophobicContact CD2-CE1 4.15Å; V152-Y166 HydrophobicContact CG1-CD1 3.83Å; V152-Y166 HydrophobicContact CG1-CE1 4.42Å; V152-Y166 HydrophobicContact CG1-CG 4.23Å; V152-Y166 HydrophobicContact CG2-CD1 3.99Å; V152-Y166 HydrophobicContact CG2-CE1 4.17Å; L156-Y166 HydrophobicContact CD1-CE1 4.41Å; L156-Y166 HydrophobicContact CD1-CE2 4.23Å; M158-Y166 HydrophobicContact CE-CD2 4.23Å; M158-Y166 HydrophobicContact SD-CG 4.48Å; E162-Y166 WeakPolarHBondContact O-CB 3.43Å; E162-Y166 PolarHBondContact O-N 3.09Å; A163-Y166 PolarHBondContact O-N 3.46Å; Y166-K170 HydrophobicContact CD1-CD 4.31Å; Y166-K170 HydrophobicContact CE1-CD 3.93Å; Y166-K170 VanDerWaalsContact CZ-CE 3.47Å; Y166-K170 WeakPolarHBondContact O-CD 3.44Å; Y166-K170 WeakPolarHBondContact OH-CE 3.46Å
167	V	98.3	Very high	97.4	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-77.4	-33.9	177.1	-172.2	0	0	0	0	111.2	I50 L56 V148 I149 V152 A163 Y164 R165 K170 R171 I174	I50-V167 HydrophobicContact CD1-CG1 4.1Å; I50-V167 HydrophobicContact CG2-CG2 4.08Å; L56-V167 HydrophobicContact CD2-CG1 3.58Å; V148-V167 HydrophobicContact CG1-CG1 4.06Å; V148-V167 HydrophobicContact CG1-CG2 4.04Å; I149-V167 HydrophobicContact CG1-CB 4.07Å; I149-V167 HydrophobicContact CG1-CG2 3.88Å; V152-V167 HydrophobicContact CG2-CG2 3.95Å; A163-V167 WeakPolarHBondContact O-CG2 3.46Å; A163-V167 PolarHBondContact O-N 3.33Å; A163-V167 VanDerWaalsContact O-N 3.12Å; Y164-V167 PolarHBondContact O-N 3.48Å; R165-V167 VanDerWaalsContact C-N 3.32Å; R165-V167 PolarHBondContact O-N 3.34Å; V167-K170 PolarHBondContact O-N 2.77Å; V167-R171 PolarHBondContact O-N 3.32Å; V167-I174 HydrophobicContact CB-CD1 3.88Å; V167-I174 HydrophobicContact CG1-CD1 3.8Å
168	K	98	Very high	97.5	Very high	63 Å²	63	59.7 Å²	59.7	27%	0.274	30%	0.297	S	S	.	.	H	α-helix	trans	-65.9	-40.9	178.3	-174.9	65.4	168.9	-180	0	112.9	Y164 R165 K170 R171 P172 I174	Y164-K168 HydrophobicContact CD1-CB 4.31Å; Y164-K168 HydrophobicContact CE1-CB 4.1Å; Y164-K168 HydrophobicContact CE1-CD 4.32Å; Y164-K168 HydrophobicContact CE1-CG 4.13Å; Y164-K168 WeakPolarHBondContact O-CB 3.32Å; Y164-K168 PolarHBondContact O-N 3.13Å; R165-K168 WeakPolarHBondContact O-CB 3.47Å; R165-K168 PolarHBondContact O-N 3.12Å; K168-K170 PolarHBondContact O-N 2.87Å; K168-R171 CarbonylContact O-C 3.19Å; K168-R171 PolarHBondContact O-N 3.35Å; K168-P172 WeakPolarHBondContact CE-O 3.43Å; K168-P172 PolarHBondContact NZ-O 2.98Å; K168-P172 VanDerWaalsContact O-CA 3.28Å; K168-P172 WeakPolarHBondContact O-CA 3.14Å; K168-P172 VanDerWaalsContact O-N 3.16Å; K168-I174 HydrophobicContact CB-CD1 4.02Å; K168-I174 HydrophobicContact CB-CG1 4.18Å; K168-I174 HydrophobicContact CD-CD1 4.35Å; K168-I174 HydrophobicContact CD-CG1 3.58Å; K168-I174 PolarHBondContact NZ-O 2.81Å
169	D	97.3	Very high	97.6	Very high	133 Å²	133	59 Å²	59	71%	0.711	29%	0.294	S	S	*	.	H	α-helix	trans	-66.4	-29.5	178.3	-65.8	-21.7	0	0	0	111.5	R165	R165-D169 VanDerWaalsContact O-CG 3.25Å; R165-D169 PolarHBondContact O-N 2.89Å
170	K	97.6	Very high	97.6	Very high	80 Å²	80	57.7 Å²	57.7	35%	0.348	29%	0.285	S	S	.	.	H	α-helix	trans	-82.3	-43.3	174.7	-71.7	169.1	162.4	-74.4	0	113.3	T48 K49 I50 Y166 V167 K168	T48-K170 HydrophobicContact CG2-CB 4.11Å; T48-K170 WeakPolarHBondContact CG2-O 3.37Å; K49-K170 PolarHBondContact O-NZ 2.96Å; I50-K170 HydrophobicContact CD1-CB 3.9Å; I50-K170 HydrophobicContact CD1-CD 3.9Å; I50-K170 HydrophobicContact CG2-CD 4.37Å; I50-K170 WeakPolarHBondContact O-CE 3.43Å; I50-K170 PolarHBondContact O-NZ 3.24Å; I50-K170 VanDerWaalsContact O-NZ 3.16Å; Y166-K170 HydrophobicContact CD1-CD 4.31Å; Y166-K170 HydrophobicContact CE1-CD 3.93Å; Y166-K170 VanDerWaalsContact CZ-CE 3.47Å; Y166-K170 WeakPolarHBondContact O-CD 3.44Å; Y166-K170 WeakPolarHBondContact OH-CE 3.46Å; V167-K170 PolarHBondContact O-N 2.77Å; K168-K170 PolarHBondContact O-N 2.87Å
171	R	96.8	Very high	97.7	Very high	25 Å²	25	59.5 Å²	59.5	9%	0.094	29%	0.293	C	S	.	.			trans	-125.3	87.1	178.3	-168.6	172.7	-177.3	98.4	-6.6	109.6	G46 T48 L56 D61 G140 V167 K168 S173 I174	G46-R171 PolarHBondContact O-NH1 3.35Å; T48-R171 HydrophobicContact CG2-CB 4.09Å; T48-R171 WeakPolarHBondContact OG1-CD 3.42Å; T48-R171 PolarHBondContact OG1-NH1 3.41Å; L56-R171 HydrophobicContact CD2-CB 4.47Å; L56-R171 PolarHBondContact O-NH1 2.99Å; D61-R171 IonicContact OD2-NH2 3.9Å; G140-R171 PolarHBondContact O-NE 3.45Å; V167-R171 PolarHBondContact O-N 3.32Å; K168-R171 CarbonylContact O-C 3.19Å; K168-R171 PolarHBondContact O-N 3.35Å; R171-S173 WeakPolarHBondContact CG-OG 3.29Å; R171-S173 PolarHBondContact O-N 2.67Å; R171-I174 HydrophobicContact CB-CG2 3.96Å; R171-I174 HydrophobicContact CG-CG2 3.98Å; R171-I174 WeakPolarHBondContact O-CG2 3.07Å; R171-I174 PolarHBondContact O-N 3.32Å; R171-I174 VanDerWaalsContact O-N 3.11Å
172	P	96.8	Very high	97.6	Very high	90 Å²	90	55.7 Å²	55.7	58%	0.584	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-17.8	-176.3	-29.3	37.3	0	0	0	115.4	K168	K168-P172 WeakPolarHBondContact CE-O 3.43Å; K168-P172 PolarHBondContact NZ-O 2.98Å; K168-P172 VanDerWaalsContact O-CA 3.28Å; K168-P172 WeakPolarHBondContact O-CA 3.14Å; K168-P172 VanDerWaalsContact O-N 3.16Å
173	S	96.2	Very high	97.6	Very high	50 Å²	50	51.7 Å²	51.7	35%	0.35	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-9.3	177.4	53.8	0	0	0	0	115.2	R171 S175	R171-S173 WeakPolarHBondContact CG-OG 3.29Å; R171-S173 PolarHBondContact O-N 2.67Å; S173-S175 PolarHBondContact O-N 2.88Å
174	I	98.1	Very high	97.6	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.267	C	S	.	.			trans	-65.4	138.7	-179.1	73.8	172.7	0	0	0	112.2	L56 P145 I149 V167 K168 R171	L56-I174 HydrophobicContact CD2-CG2 4.07Å; P145-I174 HydrophobicContact CB-CB 3.82Å; P145-I174 HydrophobicContact CB-CD1 4.43Å; P145-I174 HydrophobicContact CB-CG2 3.66Å; P145-I174 HydrophobicContact CG-CB 3.93Å; P145-I174 HydrophobicContact CG-CG2 3.46Å; P145-I174 VanDerWaalsContact CG-CG2 3.46Å; I149-I174 HydrophobicContact CD1-CD1 4.18Å; V167-I174 HydrophobicContact CB-CD1 3.88Å; V167-I174 HydrophobicContact CG1-CD1 3.8Å; K168-I174 HydrophobicContact CB-CD1 4.02Å; K168-I174 HydrophobicContact CB-CG1 4.18Å; K168-I174 HydrophobicContact CD-CD1 4.35Å; K168-I174 HydrophobicContact CD-CG1 3.58Å; K168-I174 PolarHBondContact NZ-O 2.81Å; R171-I174 HydrophobicContact CB-CG2 3.96Å; R171-I174 HydrophobicContact CG-CG2 3.98Å; R171-I174 WeakPolarHBondContact O-CG2 3.07Å; R171-I174 PolarHBondContact O-N 3.32Å; R171-I174 VanDerWaalsContact O-N 3.11Å
175	S	98	Very high	97.5	Very high	71 Å²	71	53.5 Å²	53.5	50%	0.497	28%	0.28	S	S	.	.			trans	-157.2	71.4	173.2	-176.6	0	0	0	0	110.6	I141 S173 N177	I141-S175 CarbonylContact O-C 3.45Å; I141-S175 VanDerWaalsContact O-C 3.31Å; I141-S175 PolarHBondContact O-N 2.72Å; S173-S175 PolarHBondContact O-N 2.88Å; S175-N177 PolarHBondContact O-N 3.12Å
176	P	97.9	Very high	97.4	Very high	4 Å²	4	53.2 Å²	53.2	3%	0.026	28%	0.283	C	S	.	.			trans	-41.1	134.7	162.5	-31.4	35.8	0	0	0	113.2	P145 I149 Y164 F180 L181	P145-P176 HydrophobicContact CB-CG 4.2Å; I149-P176 HydrophobicContact CD1-CG 4.02Å; Y164-P176 HydrophobicContact CE2-CG 4.37Å; P176-F180 HydrophobicContact CB-CB 4.35Å; P176-L181 HydrophobicContact CB-CD2 3.88Å; P176-L181 HydrophobicContact CB-CG 4.07Å; P176-L181 HydrophobicContact CG-CD2 4.45Å
177	N	97.1	Very high	97.3	Very high	35 Å²	35	51 Å²	51	19%	0.187	28%	0.275	C	S	.	.			trans	-67.9	161.2	176.2	74.4	54.5	0	0	0	111.5	D101 S102 S142 S175 N179 F180 L181	D101-N177 PolarHBondContact OD1-ND2 2.95Å; D101-N177 VanDerWaalsContact OD1-ND2 3.11Å; S102-N177 PolarHBondContact O-ND2 3.32Å; S142-N177 PolarHBondContact OG-N 3.5Å; S175-N177 PolarHBondContact O-N 3.12Å; N177-N179 VanDerWaalsContact C-N 3.27Å; N177-N179 PolarHBondContact O-N 3.4Å; N177-N179 WeakPolarHBondContact OD1-CB 3.42Å; N177-N179 PolarHBondContact OD1-N 3.38Å; N177-N179 VanDerWaalsContact OD1-N 3.1Å; N177-F180 VanDerWaalsContact ND2-CD2 3.25Å; N177-F180 WeakPolarHBondContact ND2-CD2 3.35Å; N177-F180 WeakPolarHBondContact ND2-CE2 3.3Å; N177-F180 VanDerWaalsContact ND2-CZ 3.26Å; N177-F180 WeakPolarHBondContact ND2-CZ 3.24Å; N177-F180 WeakPolarHBondContact O-CB 3.48Å; N177-F180 PolarHBondContact O-N 3.46Å; N177-F180 PolarHBondContact OD1-N 3.49Å; N177-F180 VanDerWaalsContact OD1-N 3.07Å; N177-L181 PolarHBondContact O-N 3.1Å
178	F	96.8	Very high	97.2	Very high	169 Å²	169	52.3 Å²	52.3	74%	0.741	28%	0.281	S	S	*	.	H	α-helix	trans	-61.8	-29.1	-173.3	-65.2	-63.3	0	0	0	114.7	L181 G182	F178-L181 HydrophobicContact CD1-CD1 4.18Å; F178-G182 PolarHBondContact O-N 3.24Å
179	N	97.6	Very high	97.1	Very high	40 Å²	40	56.4 Å²	56.4	21%	0.214	30%	0.299	C	S	.	.	H	α-helix	trans	-66.2	-42.6	173.5	162.5	44.6	0	0	0	110.5	S102 Y103 E105 N177 G182 Q183	S102-N179 PolarHBondContact O-ND2 2.97Å; Y103-N179 WeakPolarHBondContact O-CB 3.39Å; E105-N179 PolarHBondContact O-ND2 3.29Å; N177-N179 VanDerWaalsContact C-N 3.27Å; N177-N179 PolarHBondContact O-N 3.4Å; N177-N179 WeakPolarHBondContact OD1-CB 3.42Å; N177-N179 PolarHBondContact OD1-N 3.38Å; N177-N179 VanDerWaalsContact OD1-N 3.1Å; N179-G182 PolarHBondContact O-N 3.25Å; N179-Q183 PolarHBondContact ND2-NE2 2.81Å; N179-Q183 WeakPolarHBondContact O-CG 3.37Å; N179-Q183 PolarHBondContact O-N 3.47Å; N179-Q183 PolarHBondContact OD1-NE2 2.68Å
180	F	97.8	Very high	96.8	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-69.6	-36.2	177.4	-63.4	-5.5	0	0	0	112.7	N100 D101 E105 L107 S142 R143 T146 P176 N177 Q183 L184	N100-F180 WeakPolarHBondContact O-CZ 3.49Å; D101-F180 WeakPolarHBondContact OD1-CE2 3.21Å; E105-F180 HydrophobicContact CB-CE1 4.1Å; E105-F180 HydrophobicContact CB-CZ 4.35Å; L107-F180 HydrophobicContact CD1-CD1 4.03Å; L107-F180 HydrophobicContact CD1-CE1 3.47Å; L107-F180 VanDerWaalsContact CD1-CE1 3.47Å; L107-F180 HydrophobicContact CD1-CE2 4.27Å; L107-F180 HydrophobicContact CD1-CZ 3.6Å; L107-F180 HydrophobicContact CD2-CD1 4.48Å; L107-F180 HydrophobicContact CD2-CD2 4.23Å; L107-F180 HydrophobicContact CD2-CE1 4.5Å; L107-F180 HydrophobicContact CD2-CE2 4.24Å; L107-F180 HydrophobicContact CD2-CG 4.37Å; L107-F180 HydrophobicContact CD2-CZ 4.37Å; S142-F180 VanDerWaalsContact OG-CD2 3.32Å; S142-F180 WeakPolarHBondContact OG-CD2 3.37Å; S142-F180 WeakPolarHBondContact OG-CE2 3.37Å; R143-F180 HydrophobicContact CG-CE2 3.67Å; R143-F180 HydrophobicContact CG-CZ 4.11Å; T146-F180 HydrophobicContact CG2-CB 3.79Å; T146-F180 HydrophobicContact CG2-CG 4.33Å; T146-F180 WeakPolarHBondContact OG1-CB 3.25Å; T146-F180 WeakPolarHBondContact OG1-CD2 3.38Å; P176-F180 HydrophobicContact CB-CB 4.35Å; N177-F180 VanDerWaalsContact ND2-CD2 3.25Å; N177-F180 WeakPolarHBondContact ND2-CD2 3.35Å; N177-F180 WeakPolarHBondContact ND2-CE2 3.3Å; N177-F180 VanDerWaalsContact ND2-CZ 3.26Å; N177-F180 WeakPolarHBondContact ND2-CZ 3.24Å; N177-F180 WeakPolarHBondContact O-CB 3.48Å; N177-F180 PolarHBondContact O-N 3.46Å; N177-F180 PolarHBondContact OD1-N 3.49Å; N177-F180 VanDerWaalsContact OD1-N 3.07Å; F180-Q183 PolarHBondContact O-N 3.23Å; F180-L184 WeakPolarHBondContact O-CG 3.43Å; F180-L184 PolarHBondContact O-N 3.16Å
181	L	97.6	Very high	96.5	Very high	50 Å²	50	50.7 Å²	50.7	26%	0.262	27%	0.272	S	S	.	.	H	α-helix	trans	-63.5	-39.8	170.7	-66.1	174.3	0	0	0	111.9	Y164 P176 N177 F178 L184 L185	Y164-L181 HydrophobicContact CD2-CD2 3.93Å; Y164-L181 HydrophobicContact CE2-CD2 4Å; P176-L181 HydrophobicContact CB-CD2 3.88Å; P176-L181 HydrophobicContact CB-CG 4.07Å; P176-L181 HydrophobicContact CG-CD2 4.45Å; N177-L181 PolarHBondContact O-N 3.1Å; F178-L181 HydrophobicContact CD1-CD1 4.18Å; L181-L184 HydrophobicContact CD2-CD1 4.39Å; L181-L184 PolarHBondContact O-N 2.4Å; L181-L185 PolarHBondContact O-N 3.19Å; L181-L185 VanDerWaalsContact O-N 3.13Å
182	G	97.3	Very high	96	Very high	37 Å²	37	54.8 Å²	54.8	38%	0.381	29%	0.29	S	S	.	.	H	α-helix	trans	-61	-42.4	172	0	0	0	0	0	112.7	F178 N179 L184 L185 E186	F178-G182 PolarHBondContact O-N 3.24Å; N179-G182 PolarHBondContact O-N 3.25Å; G182-L184 VanDerWaalsContact C-N 3.34Å; G182-L184 PolarHBondContact O-N 3.23Å; G182-L185 WeakPolarHBondContact O-CB 3.48Å; G182-L185 PolarHBondContact O-N 2.71Å; G182-E186 PolarHBondContact O-N 2.91Å
183	Q	97.6	Very high	95.3	Very high	11 Å²	11	53.9 Å²	53.9	5%	0.051	29%	0.286	C	S	.	.	H	α-helix	trans	-66.8	-30.7	176	-75.7	180	59.5	0	0	113.3	E105 L108 N179 F180 E186 F187	E105-Q183 PolarHBondContact O-NE2 3.41Å; L108-Q183 HydrophobicContact CD1-CB 3.95Å; L108-Q183 HydrophobicContact CD1-CG 3.78Å; L108-Q183 HydrophobicContact CG-CB 3.97Å; L108-Q183 HydrophobicContact CG-CG 4.15Å; N179-Q183 PolarHBondContact ND2-NE2 2.81Å; N179-Q183 WeakPolarHBondContact O-CG 3.37Å; N179-Q183 PolarHBondContact O-N 3.47Å; N179-Q183 PolarHBondContact OD1-NE2 2.68Å; F180-Q183 PolarHBondContact O-N 3.23Å; Q183-E186 PolarHBondContact O-N 3.35Å; Q183-F187 WeakPolarHBondContact O-CB 3.43Å; Q183-F187 PolarHBondContact O-N 3.46Å
184	L	97.6	Very high	94.3	Very high	3 Å²	3	55 Å²	55	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-68.7	-37.6	170.9	-72.7	168.6	0	0	0	112.2	F111 T146 I149 A150 M153 F180 L181 G182 F187 E188	F111-L184 HydrophobicContact CE2-CD2 4.41Å; F111-L184 HydrophobicContact CZ-CD2 4.28Å; T146-L184 HydrophobicContact CG2-CD1 4.06Å; T146-L184 HydrophobicContact CG2-CD2 4.23Å; T146-L184 HydrophobicContact CG2-CG 4Å; I149-L184 HydrophobicContact CB-CD1 4.13Å; I149-L184 HydrophobicContact CB-CD2 4.36Å; I149-L184 HydrophobicContact CD1-CD1 4.26Å; I149-L184 HydrophobicContact CG2-CD1 3.84Å; I149-L184 HydrophobicContact CG2-CD2 4.09Å; A150-L184 HydrophobicContact CB-CD2 3.78Å; M153-L184 HydrophobicContact SD-CD2 3.91Å; F180-L184 WeakPolarHBondContact O-CG 3.43Å; F180-L184 PolarHBondContact O-N 3.16Å; L181-L184 HydrophobicContact CD2-CD1 4.39Å; L181-L184 PolarHBondContact O-N 2.4Å; G182-L184 VanDerWaalsContact C-N 3.34Å; G182-L184 PolarHBondContact O-N 3.23Å; L184-F187 PolarHBondContact O-N 2.98Å; L184-E188 PolarHBondContact O-N 2.83Å
185	L	96.9	Very high	92.9	Very high	98 Å²	98	57.2 Å²	57.2	51%	0.513	30%	0.303	S	S	.	.	H	α-helix	trans	-67.7	-34.6	173.7	-70.4	163.8	0	0	0	112.3	S160 L181 G182 K189	S160-L185 WeakPolarHBondContact OG-CD2 3.45Å; L181-L185 PolarHBondContact O-N 3.19Å; L181-L185 VanDerWaalsContact O-N 3.13Å; G182-L185 WeakPolarHBondContact O-CB 3.48Å; G182-L185 PolarHBondContact O-N 2.71Å; L185-K189 PolarHBondContact O-N 3.29Å
186	E	96.4	Very high	91.2	Very high	98 Å²	98	60 Å²	60	46%	0.458	31%	0.311	S	S	.	.	H	α-helix	trans	-66.3	-45.2	170.8	-171.2	180	154	0	0	111.1	L108 G182 Q183 E188 K189 N190	L108-E186 HydrophobicContact CD1-CB 4.08Å; L108-E186 HydrophobicContact CD1-CG 3.96Å; L108-E186 WeakPolarHBondContact CD1-OE1 3.45Å; L108-E186 WeakPolarHBondContact CD1-OE2 3.37Å; G182-E186 PolarHBondContact O-N 2.91Å; Q183-E186 PolarHBondContact O-N 3.35Å; E186-E188 VanDerWaalsContact C-N 3.3Å; E186-E188 PolarHBondContact O-N 3.32Å; E186-K189 WeakPolarHBondContact O-CB 3.49Å; E186-K189 PolarHBondContact O-N 3.47Å; E186-N190 PolarHBondContact O-N 2.96Å; E186-N190 VanDerWaalsContact O-N 3.16Å; E186-N190 PolarHBondContact O-OD1 2.83Å
187	F	96.4	Very high	89.2	Confident	13 Å²	13	62.8 Å²	62.8	6%	0.057	34%	0.335	C	S	.	.	H	α-helix	trans	-60.3	-37.1	175.2	-176	-121.6	0	0	0	113	L108 F111 F115 A150 M153 R154 Q183 L184 K189 N190 L191	L108-F187 HydrophobicContact CD2-CB 3.83Å; L108-F187 HydrophobicContact CD2-CD2 4.42Å; F111-F187 HydrophobicContact CD2-CB 4.32Å; F111-F187 HydrophobicContact CD2-CD1 4.2Å; F111-F187 AromaticContact CD2-CD2 3.8Å; F111-F187 HydrophobicContact CD2-CD2 3.8Å; F111-F187 HydrophobicContact CD2-CE2 4.16Å; F111-F187 AromaticContact CD2-CG 3.84Å; F111-F187 HydrophobicContact CD2-CG 3.84Å; F111-F187 HydrophobicContact CE2-CB 4Å; F111-F187 HydrophobicContact CE2-CD1 4.14Å; F111-F187 HydrophobicContact CE2-CD2 4.32Å; F111-F187 AromaticContact CE2-CG 3.89Å; F111-F187 HydrophobicContact CE2-CG 3.89Å; F115-F187 HydrophobicContact CE2-CE1 4.22Å; F115-F187 AromaticContact CE2-CE2 3.77Å; F115-F187 HydrophobicContact CE2-CE2 3.77Å; F115-F187 AromaticContact CE2-CZ 3.36Å; F115-F187 HydrophobicContact CE2-CZ 3.36Å; F115-F187 AromaticContact CZ-CE1 3.81Å; F115-F187 HydrophobicContact CZ-CE1 3.81Å; F115-F187 HydrophobicContact CZ-CE2 4.16Å; F115-F187 AromaticContact CZ-CZ 3.43Å; F115-F187 HydrophobicContact CZ-CZ 3.43Å; F115-F187 VanDerWaalsContact CZ-CZ 3.43Å; A150-F187 HydrophobicContact CB-CD1 3.94Å; A150-F187 HydrophobicContact CB-CE1 3.9Å; A150-F187 WeakPolarHBondContact O-CE1 3.45Å; M153-F187 HydrophobicContact CB-CE1 4.41Å; M153-F187 HydrophobicContact CE-CD1 3.75Å; M153-F187 HydrophobicContact CE-CE1 4.44Å; M153-F187 HydrophobicContact SD-CD1 4.12Å; R154-F187 HydrophobicContact CB-CZ 4.44Å; Q183-F187 WeakPolarHBondContact O-CB 3.43Å; Q183-F187 PolarHBondContact O-N 3.46Å; L184-F187 PolarHBondContact O-N 2.98Å; F187-K189 VanDerWaalsContact C-N 3.33Å; F187-K189 PolarHBondContact O-N 3.27Å; F187-N190 PolarHBondContact O-N 3.22Å; F187-L191 HydrophobicContact CD1-CD1 4.09Å; F187-L191 HydrophobicContact CD1-CG 4.37Å; F187-L191 HydrophobicContact CE1-CD1 3.56Å; F187-L191 HydrophobicContact CE1-CD2 4.28Å; F187-L191 HydrophobicContact CE1-CG 3.91Å; F187-L191 HydrophobicContact CE2-CD2 4.09Å; F187-L191 HydrophobicContact CE2-CG 4.07Å; F187-L191 HydrophobicContact CZ-CD1 3.86Å; F187-L191 HydrophobicContact CZ-CD2 3.68Å; F187-L191 HydrophobicContact CZ-CG 3.73Å; F187-L191 PolarHBondContact O-N 2.94Å
188	E	96.1	Very high	87.1	Confident	28 Å²	28	64.7 Å²	64.7	13%	0.131	35%	0.345	C	S	.	.	H	α-helix	trans	-62.8	-37.9	176.3	-162.5	-173.6	136.1	0	0	112.6	M153 S160 L184 E186 K192	M153-E188 HydrophobicContact CE-CB 3.58Å; M153-E188 HydrophobicContact CE-CG 3.98Å; S160-E188 WeakPolarHBondContact CB-OE2 3.34Å; S160-E188 PolarHBondContact N-OE2 2.98Å; S160-E188 PolarHBondContact OG-OE2 2.96Å; L184-E188 PolarHBondContact O-N 2.83Å; E186-E188 VanDerWaalsContact C-N 3.3Å; E186-E188 PolarHBondContact O-N 3.32Å; E188-K192 WeakPolarHBondContact O-CG 3.36Å; E188-K192 PolarHBondContact O-N 3.49Å; E188-K192 WeakPolarHBondContact OE1-CE 3.36Å; E188-K192 IonicContact OE1-NZ 2.7Å; E188-K192 PolarHBondContact OE1-NZ 2.85Å
189	K	94.7	Very high	84.7	Confident	150 Å²	150	62.4 Å²	62.4	65%	0.652	34%	0.34	S	S	*	.	H	α-helix	trans	-63.6	-44.6	172.9	-63.6	173.1	-176.9	-179.7	0	110.8	L185 E186 F187 K192 S193	L185-K189 PolarHBondContact O-N 3.29Å; E186-K189 WeakPolarHBondContact O-CB 3.49Å; E186-K189 PolarHBondContact O-N 3.47Å; F187-K189 VanDerWaalsContact C-N 3.33Å; F187-K189 PolarHBondContact O-N 3.27Å; K189-K192 PolarHBondContact O-N 2.99Å; K189-K192 VanDerWaalsContact O-N 3.16Å; K189-S193 PolarHBondContact O-N 3.3Å
190	N	92.3	Very high	82.3	Confident	71 Å²	71	67.5 Å²	67.5	38%	0.38	37%	0.368	S	S	.	.	H	α-helix	trans	-63.8	-43.4	-178.5	-62.3	-9.1	0	0	0	111.2	E186 F187 K192 S193 I194	E186-N190 PolarHBondContact O-N 2.96Å; E186-N190 VanDerWaalsContact O-N 3.16Å; E186-N190 PolarHBondContact O-OD1 2.83Å; F187-N190 PolarHBondContact O-N 3.22Å; N190-K192 VanDerWaalsContact C-N 3.3Å; N190-K192 PolarHBondContact O-N 3.4Å; N190-S193 WeakPolarHBondContact CA-OG 3.26Å; N190-S193 PolarHBondContact O-N 3.48Å; N190-S193 PolarHBondContact O-OG 3.43Å; N190-I194 WeakPolarHBondContact O-CG1 3.48Å; N190-I194 PolarHBondContact O-N 2.93Å
191	L	90.9	Very high	79.4	Confident	22 Å²	22	71.9 Å²	71.9	12%	0.115	39%	0.391	C	S	.	.	H	α-helix	trans	-57.4	-40.6	173	-75	-178.9	0	0	0	112.6	M153 R154 F187 I194 S195	M153-L191 HydrophobicContact CB-CD1 3.97Å; M153-L191 HydrophobicContact CE-CD1 4.33Å; R154-L191 HydrophobicContact CB-CD2 4.49Å; R154-L191 HydrophobicContact CG-CD2 4.23Å; F187-L191 HydrophobicContact CD1-CD1 4.09Å; F187-L191 HydrophobicContact CD1-CG 4.37Å; F187-L191 HydrophobicContact CE1-CD1 3.56Å; F187-L191 HydrophobicContact CE1-CD2 4.28Å; F187-L191 HydrophobicContact CE1-CG 3.91Å; F187-L191 HydrophobicContact CE2-CD2 4.09Å; F187-L191 HydrophobicContact CE2-CG 4.07Å; F187-L191 HydrophobicContact CZ-CD1 3.86Å; F187-L191 HydrophobicContact CZ-CD2 3.68Å; F187-L191 HydrophobicContact CZ-CG 3.73Å; F187-L191 PolarHBondContact O-N 2.94Å; L191-I194 PolarHBondContact O-N 3.31Å; L191-S195 PolarHBondContact O-N 3.46Å; L191-S195 VanDerWaalsContact O-N 3.08Å; L191-S195 PolarHBondContact O-OG 2.99Å
192	K	86.6	Confident	76.4	Confident	110 Å²	110	76.6 Å²	76.6	48%	0.478	42%	0.416	S	S	.	.	H	α-helix	trans	-69.4	-35.6	177.5	-70.2	171.7	-172.4	173.6	0	112.6	E188 K189 N190 I194 S195 L196	E188-K192 WeakPolarHBondContact O-CG 3.36Å; E188-K192 PolarHBondContact O-N 3.49Å; E188-K192 WeakPolarHBondContact OE1-CE 3.36Å; E188-K192 IonicContact OE1-NZ 2.7Å; E188-K192 PolarHBondContact OE1-NZ 2.85Å; K189-K192 PolarHBondContact O-N 2.99Å; K189-K192 VanDerWaalsContact O-N 3.16Å; N190-K192 VanDerWaalsContact C-N 3.3Å; N190-K192 PolarHBondContact O-N 3.4Å; K192-I194 VanDerWaalsContact C-N 3.28Å; K192-I194 PolarHBondContact O-N 3.27Å; K192-S195 WeakPolarHBondContact CA-OG 3.25Å; K192-S195 PolarHBondContact O-OG 3.01Å; K192-L196 WeakPolarHBondContact O-CB 3.48Å; K192-L196 VanDerWaalsContact O-CG 3.28Å; K192-L196 WeakPolarHBondContact O-CG 3.48Å; K192-L196 PolarHBondContact O-N 3.2Å; K192-L196 VanDerWaalsContact O-N 3.14Å
193	S	81.6	Confident	73.7	Confident	72 Å²	72	77.4 Å²	77.4	50%	0.503	42%	0.416	S	S	.	.	H	α-helix	trans	-67.7	-28.1	173.3	65	0	0	0	0	113.3	K189 N190	K189-S193 PolarHBondContact O-N 3.3Å; N190-S193 WeakPolarHBondContact CA-OG 3.26Å; N190-S193 PolarHBondContact O-N 3.48Å; N190-S193 PolarHBondContact O-OG 3.43Å
194	I	75.8	Confident	71.2	Confident	74 Å²	74	82.2 Å²	82.2	38%	0.379	44%	0.439	S	S	.	.	H	α-helix	trans	-73.5	-48.7	174.4	-66.7	163	0	0	0	110.1	N190 L191 K192 L196 A197 D198	N190-I194 WeakPolarHBondContact O-CG1 3.48Å; N190-I194 PolarHBondContact O-N 2.93Å; L191-I194 PolarHBondContact O-N 3.31Å; K192-I194 VanDerWaalsContact C-N 3.28Å; K192-I194 PolarHBondContact O-N 3.27Å; I194-L196 VanDerWaalsContact C-N 3.29Å; I194-L196 PolarHBondContact O-N 3.33Å; I194-A197 WeakPolarHBondContact O-CB 3.48Å; I194-A197 PolarHBondContact O-N 3.41Å; I194-D198 WeakPolarHBondContact CG2-OD2 3.07Å; I194-D198 PolarHBondContact O-N 3.39Å
195	S	67.9	Low	68.8	Low	45 Å²	45	85.3 Å²	85.3	32%	0.315	45%	0.452	S	S	.	.	H	α-helix	trans	-60	-38	178.7	52.5	0	0	0	0	113.1	L191 K192 A197 D198 D199	L191-S195 PolarHBondContact O-N 3.46Å; L191-S195 VanDerWaalsContact O-N 3.08Å; L191-S195 PolarHBondContact O-OG 2.99Å; K192-S195 WeakPolarHBondContact CA-OG 3.25Å; K192-S195 PolarHBondContact O-OG 3.01Å; S195-A197 PolarHBondContact O-N 2.92Å; S195-D198 PolarHBondContact O-N 3.46Å; S195-D199 PolarHBondContact O-N 2.97Å
196	L	61.5	Low	66	Low	130 Å²	130	84.9 Å²	84.9	68%	0.681	46%	0.462	S	S	*	.	H	α-helix	trans	-72.8	-6	176.9	-67.6	170.1	0	0	0	114.1	K192 I194	K192-L196 WeakPolarHBondContact O-CB 3.48Å; K192-L196 VanDerWaalsContact O-CG 3.28Å; K192-L196 WeakPolarHBondContact O-CG 3.48Å; K192-L196 PolarHBondContact O-N 3.2Å; K192-L196 VanDerWaalsContact O-N 3.14Å; I194-L196 VanDerWaalsContact C-N 3.29Å; I194-L196 PolarHBondContact O-N 3.33Å
197	A	57.3	Low	63	Low	62 Å²	62	81.6 Å²	81.6	51%	0.512	46%	0.455	S	S	.	.	H	α-helix	trans	-99.8	-39.3	169.1	0	0	0	0	0	111.2	I194 S195 D199	I194-A197 WeakPolarHBondContact O-CB 3.48Å; I194-A197 PolarHBondContact O-N 3.41Å; S195-A197 PolarHBondContact O-N 2.92Å; A197-D199 PolarHBondContact O-N 3.4Å
198	D	51.7	Low	60.5	Low	76 Å²	76	83.5 Å²	83.5	41%	0.406	47%	0.465	S	S	.	.	H	α-helix	trans	-67.8	-13.5	179	-68.3	-12.2	0	0	0	113.5	I194 S195 N200 D201	I194-D198 WeakPolarHBondContact CG2-OD2 3.07Å; I194-D198 PolarHBondContact O-N 3.39Å; S195-D198 PolarHBondContact O-N 3.46Å; D198-N200 PolarHBondContact O-N 3.26Å; D198-D201 CarbonylContact O-C 3.31Å; D198-D201 PolarHBondContact O-N 3.39Å
199	D	48	Very low	57.5	Low	120 Å²	120	84.1 Å²	84.1	64%	0.642	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	8	171.5	-73.9	-39.2	0	0	0	114.5	S195 A197	S195-D199 PolarHBondContact O-N 2.97Å; A197-D199 PolarHBondContact O-N 3.4Å
200	N	46	Very low	54.8	Low	148 Å²	148	82.7 Å²	82.7	79%	0.791	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.5	-2.4	173.3	-59.6	-95	0	0	0	113.8	D198	D198-N200 PolarHBondContact O-N 3.26Å
201	D	36.4	Very low	52.5	Low	91 Å²	91	83.8 Å²	83.8	49%	0.487	48%	0.479	S	S	.	.			trans	-151.6	80.8	-177.9	-169.2	-9	0	0	0	111.7	D198 S203	D198-D201 CarbonylContact O-C 3.31Å; D198-D201 PolarHBondContact O-N 3.39Å; D201-S203 PolarHBondContact O-N 2.91Å; D201-S203 WeakPolarHBondContact OD1-CB 3.2Å; D201-S203 PolarHBondContact OD1-N 3.41Å; D201-S203 PolarHBondContact OD1-OG 2.9Å
202	D	36.2	Very low	49.8	Very low	149 Å²	149	88 Å²	88	80%	0.797	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-57.2	-4.1	-180	-76.6	-66.4	0	0	0	115.7	H204	D202-H204 PolarHBondContact O-N 3.45Å
203	S	40.7	Very low	47.3	Very low	54 Å²	54	87.6 Å²	87.6	38%	0.378	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-76.1	-17.7	-160.5	67.7	0	0	0	0	116.6	D201 F259	D201-S203 PolarHBondContact O-N 2.91Å; D201-S203 WeakPolarHBondContact OD1-CB 3.2Å; D201-S203 PolarHBondContact OD1-N 3.41Å; D201-S203 PolarHBondContact OD1-OG 2.9Å; S203-F259 WeakPolarHBondContact O-CZ 3.45Å
204	H	45.3	Very low	45	Very low	112 Å²	112	90.3 Å²	90.3	52%	0.519	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-103.8	-5.1	-161.8	-93.8	-75	0	0	0	118.1	D202 R263	D202-H204 PolarHBondContact O-N 3.45Å; H204-R263 PolarHBondContact NE2-NH1 3.2Å
205	F	46.3	Very low	42.9	Very low	69 Å²	69	92.6 Å²	92.6	30%	0.303	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-140.3	-5.6	173.8	-137.8	-96.2	0	0	0	115.8	Y155 G207 L208	Y155-F205 HydrophobicContact CD1-CZ 4.05Å; Y155-F205 HydrophobicContact CE1-CZ 4.13Å; F205-G207 PolarHBondContact O-N 3.21Å; F205-G207 VanDerWaalsContact O-N 3.17Å; F205-L208 HydrophobicContact CE1-CD1 4.2Å; F205-L208 HydrophobicContact CZ-CD1 4.27Å
206	A	37.9	Very low	41.1	Very low	88 Å²	88	94.2 Å²	94.2	73%	0.727	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-6.6	179.9	0	0	0	0	0	114.7
207	G	33.3	Very low	39.7	Very low	29 Å²	29	96 Å²	96	30%	0.299	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.9	-0.7	-176.1	0	0	0	0	0	116.5	F205 F256	F205-G207 PolarHBondContact O-N 3.21Å; F205-G207 VanDerWaalsContact O-N 3.17Å; G207-F256 WeakPolarHBondContact O-CD1 3.46Å; G207-F256 WeakPolarHBondContact O-CE1 3.4Å
208	L	44.8	Very low	38.6	Very low	53 Å²	53	97.2 Å²	97.2	28%	0.277	57%	0.566	S	S	.	*	S	Bend	trans	-99.9	145.5	173.7	-76.3	175.7	0	0	0	110.7	F119 L122 F205	F119-L208 HydrophobicContact CE2-CD1 4.08Å; L122-L208 HydrophobicContact CD2-CD1 4Å; L122-L208 HydrophobicContact CD2-CD2 4.32Å; F205-L208 HydrophobicContact CE1-CD1 4.2Å; F205-L208 HydrophobicContact CZ-CD1 4.27Å
209	P	33.1	Very low	38	Very low	41 Å²	41	101 Å²	101	27%	0.266	58%	0.579	S	S	.	*			trans	-69.6	140.7	178.4	31.2	-32.1	0	0	0	109.4	F211 F256	P209-F211 PolarHBondContact O-N 2.71Å; P209-F256 HydrophobicContact CB-CE1 4.37Å; P209-F256 HydrophobicContact CB-CZ 3.92Å; P209-F256 VanDerWaalsContact CD-CZ 3.49Å; P209-F256 HydrophobicContact CG-CE1 4.32Å; P209-F256 HydrophobicContact CG-CZ 3.69Å
210	P	36.4	Very low	37.4	Very low	121 Å²	121	103 Å²	103	79%	0.786	58%	0.584	S	S	*	*			trans	-61.4	114.1	165.6	26.6	-32.2	0	0	0	107.9	S212	P210-S212 PolarHBondContact O-N 2.57Å
211	F	44.3	Very low	36.7	Very low	93 Å²	93	101.4 Å²	101.4	41%	0.408	58%	0.583	S	S	.	*			trans	-67.3	100.4	176.4	-97.3	-70.6	0	0	0	109.2	P52 P209 T213	P52-F211 HydrophobicContact CB-CE1 4.15Å; P52-F211 HydrophobicContact CB-CZ 4.27Å; P52-F211 HydrophobicContact CG-CD1 3.96Å; P52-F211 HydrophobicContact CG-CE1 3.68Å; P52-F211 HydrophobicContact CG-CZ 4.08Å; P209-F211 PolarHBondContact O-N 2.71Å; F211-T213 PolarHBondContact O-N 3.02Å
212	S	34.3	Very low	36.7	Very low	111 Å²	111	108.2 Å²	108.2	78%	0.776	60%	0.602	S	S	*	*			trans	-48.9	111.8	167.9	-57.1	0	0	0	0	109.2	P210	P210-S212 PolarHBondContact O-N 2.57Å
213	T	34.9	Very low	36.7	Very low	101 Å²	101	106.7 Å²	106.7	62%	0.62	60%	0.603	S	S	*	*			trans	-61.9	139	170.3	45	0	0	0	0	108.3	F211 V215	F211-T213 PolarHBondContact O-N 3.02Å; T213-V215 PolarHBondContact O-N 3.3Å
214	P	32.4	Very low	36.2	Very low	130 Å²	130	107.5 Å²	107.5	84%	0.844	62%	0.62	S	S	*	*			trans	-58.6	109.5	171.2	-24	34.4	0	0	0	109	D216	P214-D216 PolarHBondContact O-N 3.15Å
215	V	31.6	Very low	35.8	Very low	122 Å²	122	110.2 Å²	110.2	74%	0.739	64%	0.637	S	S	*	*			trans	-62.9	132.8	174.3	176.2	0	0	0	0	107.6	T213 Q217	T213-V215 PolarHBondContact O-N 3.3Å; V215-Q217 VanDerWaalsContact C-N 3.34Å; V215-Q217 PolarHBondContact O-N 3.34Å
216	D	30.7	Very low	35.2	Very low	78 Å²	78	118.3 Å²	118.3	42%	0.417	67%	0.666	S	S	.	*			trans	-63.3	88.2	-178.5	172.7	21.4	0	0	0	111.6	P214 S218 K219	P214-D216 PolarHBondContact O-N 3.15Å; D216-S218 PolarHBondContact O-N 3.45Å; D216-S218 VanDerWaalsContact OD1-CB 3.24Å; D216-S218 WeakPolarHBondContact OD1-CB 3.35Å; D216-S218 PolarHBondContact OD1-N 3.12Å; D216-S218 PolarHBondContact OD1-OG 3.29Å; D216-S218 PolarHBondContact OD2-OG 3.36Å; D216-K219 PolarHBondContact O-N 3.45Å; D216-K219 WeakPolarHBondContact OD2-CE 3.32Å; D216-K219 IonicContact OD2-NZ 2.73Å; D216-K219 PolarHBondContact OD2-NZ 2.79Å
217	Q	31.9	Very low	35.1	Very low	167 Å²	167	120.6 Å²	120.6	78%	0.78	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-62.6	-11.8	-179.5	-68.9	-174.8	-7.7	0	0	113.2	V215 K219 Q220	V215-Q217 VanDerWaalsContact C-N 3.34Å; V215-Q217 PolarHBondContact O-N 3.34Å; Q217-K219 PolarHBondContact O-N 3.45Å; Q217-Q220 PolarHBondContact O-N 3.37Å
218	S	35.1	Very low	35.1	Very low	89 Å²	89	128.2 Å²	128.2	62%	0.622	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-64.6	-9.2	177.5	79.3	0	0	0	0	114.2	D216	D216-S218 PolarHBondContact O-N 3.45Å; D216-S218 VanDerWaalsContact OD1-CB 3.24Å; D216-S218 WeakPolarHBondContact OD1-CB 3.35Å; D216-S218 PolarHBondContact OD1-N 3.12Å; D216-S218 PolarHBondContact OD1-OG 3.29Å; D216-S218 PolarHBondContact OD2-OG 3.36Å
219	K	37.7	Very low	34.6	Very low	156 Å²	156	135.4 Å²	135.4	68%	0.678	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-98.3	-10.8	179.3	-69.1	178.3	179.2	121.5	0	115.4	D216 Q217	D216-K219 PolarHBondContact O-N 3.45Å; D216-K219 WeakPolarHBondContact OD2-CE 3.32Å; D216-K219 IonicContact OD2-NZ 2.73Å; D216-K219 PolarHBondContact OD2-NZ 2.79Å; Q217-K219 PolarHBondContact O-N 3.45Å
220	Q	37.1	Very low	34.6	Very low	161 Å²	161	136.6 Å²	136.6	75%	0.752	75%	0.745	S	S	*	*	S	Bend	trans	-74.7	-26	-178.4	-149.6	75.2	8.2	0	0	112.8	Q217 R222	Q217-Q220 PolarHBondContact O-N 3.37Å; Q220-R222 PolarHBondContact O-N 2.92Å
221	C	31	Very low	34.5	Very low	115 Å²	115	136.8 Å²	136.8	78%	0.777	74%	0.744	S	S	*	*	S	Bend	trans	-102.4	48.6	-168.3	-61.7	0	0	0	0	114.5
222	R	35.7	Very low	33.9	Very low	234 Å²	234	139.1 Å²	139.1	88%	0.883	76%	0.76	S	S	*	*			trans	-140.9	47.2	175.4	-73.3	-162.3	176	-131.7	-4.2	115.1	Q220	Q220-R222 PolarHBondContact O-N 2.92Å
223	S	36.9	Very low	33.8	Very low	117 Å²	117	143.9 Å²	143.9	82%	0.818	76%	0.761	S	S	*	*			trans	-145.2	64.4	174.7	48.3	0	0	0	0	112.5
224	G	30.7	Very low	34	Very low	70 Å²	70	145.4 Å²	145.4	72%	0.722	77%	0.77	S	S	*	*			trans	-176.4	62	-178.4	0	0	0	0	0	116.7
225	L	36.6	Very low	34	Very low	169 Å²	169	142.3 Å²	142.3	89%	0.885	76%	0.762	S	S	*	*			trans	-164.1	145.1	153	-134.6	71.1	0	0	0	111.4
226	R	32.7	Very low	33.9	Very low	240 Å²	240	148.8 Å²	148.8	91%	0.906	77%	0.774	S	S	*	*			trans	66	139	-170	-56.8	-176.2	172.3	-160.1	-3	113.5
227	T	35.1	Very low	34	Very low	136 Å²	136	151.1 Å²	151.1	83%	0.834	79%	0.791	S	S	*	*			cis	-138.9	152.9	9.5	-28.5	0	0	0	0	111.3
228	K	35	Very low	34.1	Very low	188 Å²	188	147.6 Å²	147.6	82%	0.817	79%	0.785	S	S	*	*			trans	-69.3	142.3	174.9	-57.9	174.9	180	178.3	0	110.9
229	F	33.7	Very low	34.1	Very low	204 Å²	204	152.6 Å²	152.6	90%	0.895	80%	0.795	S	S	*	*				173.4	128.9	112	-106.3	-79.5	0	0	0	112.7
230	G	32.5	Very low	33.8	Very low	67 Å²	67	155 Å²	155	69%	0.691	81%	0.806	S	S	*	*			trans	78.1	161.9	163.5	0	0	0	0	0	118
231	T	34.6	Very low	33.4	Very low	124 Å²	124	151.8 Å²	151.8	76%	0.761	81%	0.807	S	S	*	*			cis	-161.2	107.6	-13.3	-71.9	0	0	0	0	110
232	L	31.9	Very low	33.6	Very low	143 Å²	143	153.5 Å²	153.5	75%	0.749	81%	0.807	S	S	*	*			trans	61.5	164	168.9	-76.2	76.5	0	0	0	115.3
233	R	33.1	Very low	33.3	Very low	210 Å²	210	152 Å²	152	79%	0.792	81%	0.81	S	S	*	*			cis	-149.8	155.9	3	-138	167	-159.5	-159	8.2	110.2
234	T	37.8	Very low	33.2	Very low	133 Å²	133	151 Å²	151	82%	0.816	80%	0.803	S	S	*	*			trans	15.2	135.1	152.1	52.9	0	0	0	0	120
235	G	32	Very low	33.3	Very low	65 Å²	65	155.8 Å²	155.8	67%	0.67	81%	0.812	S	S	*	*			cis	169.8	159.2	6.3	0	0	0	0	0	108.5
236	W	30.8	Very low	33.1	Very low	259 Å²	259	151.8 Å²	151.8	98%	0.981	81%	0.811	S	S	*	*				-174.9	158.3	97.6	-101.5	62.3	0	0	0	109.1
237	T	33.3	Very low	32.9	Very low	127 Å²	127	143.3 Å²	143.3	78%	0.779	80%	0.798	S	S	*	*			trans	-98.3	172	173.9	65.8	0	0	0	0	110
238	S	33	Very low	33	Very low	93 Å²	93	143.2 Å²	143.2	65%	0.65	80%	0.8	S	S	*	*			cis	-164.5	168.9	14.7	-149.6	0	0	0	0	112.3
239	K	34.4	Very low	32.9	Very low	193 Å²	193	143.2 Å²	143.2	84%	0.839	80%	0.803	S	S	*	*			trans	49.1	109.5	155.5	-68.2	172.8	-179.7	179.6	0	120.1
240	K	31.4	Very low	32.7	Very low	207 Å²	207	141.3 Å²	141.3	90%	0.9	80%	0.802	S	S	*	*				-162.6	145.6	98	-109.1	-178.1	179	-177.1	0	110.8
241	A	29.1	Very low	32.7	Very low	94 Å²	94	143.9 Å²	143.9	78%	0.777	80%	0.804	S	S	*	*			trans	-99.8	143.2	169.9	0	0	0	0	0	109.7
242	I	34.4	Very low	32.4	Very low	151 Å²	151	149.2 Å²	149.2	77%	0.774	81%	0.81	S	S	*	*			trans	-138.8	115.5	163.6	-61.4	-179	0	0	0	105.6
243	E	29.5	Very low	32.3	Very low	202 Å²	202	148.3 Å²	148.3	94%	0.944	80%	0.804	S	S	*	*			trans	-97.3	121.1	170.2	-66.8	178.4	132	0	0	108.3
244	S	36.4	Very low	32	Very low	96 Å²	96	143.1 Å²	143.1	67%	0.671	80%	0.797	S	S	*	*			trans	-156.4	96.6	172.5	61.5	0	0	0	0	112.1	G246	S244-G246 PolarHBondContact O-N 2.82Å
245	N	32.2	Very low	31.6	Very low	171 Å²	171	141.7 Å²	141.7	91%	0.914	80%	0.799	S	S	*	*			trans	17.5	98.7	152.3	-58.2	-20.2	0	0	0	117.8	G247	N245-G247 PolarHBondContact O-N 3.05Å
246	G	31.4	Very low	31.6	Very low	85 Å²	85	142.9 Å²	142.9	88%	0.876	79%	0.786	S	S	*	*			trans	-84.2	103.2	162.9	0	0	0	0	0	111.5	S244	S244-G246 PolarHBondContact O-N 2.82Å
247	G	29.9	Very low	31.6	Very low	61 Å²	61	135.4 Å²	135.4	63%	0.629	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-76.7	164.4	162.4	0	0	0	0	0	111.7	N245	N245-G247 PolarHBondContact O-N 3.05Å
248	P	37.1	Very low	31.4	Very low	135 Å²	135	135.5 Å²	135.5	88%	0.877	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-66.9	141.3	178.5	28.8	-34.6	0	0	0	111.7	D250	P248-D250 PolarHBondContact O-N 2.93Å
249	E	32.8	Very low	31.2	Very low	187 Å²	187	136.9 Å²	136.9	87%	0.874	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-71.4	125.1	-176.5	-65.1	-173	125.4	0	0	112.9	V251	E249-V251 PolarHBondContact O-N 3.34Å
250	D	29.1	Very low	30.9	Very low	165 Å²	165	133.7 Å²	133.7	88%	0.882	76%	0.763	S	S	*	*			trans	-84.3	100.2	174.4	-140.7	-3.4	0	0	0	109.4	P248 R252	P248-D250 PolarHBondContact O-N 2.93Å; D250-R252 VanDerWaalsContact C-N 3.34Å; D250-R252 PolarHBondContact O-N 3.28Å
251	V	31.8	Very low	31	Very low	120 Å²	120	127.8 Å²	127.8	73%	0.727	74%	0.744	S	S	*	*			trans	-73.5	84.8	-174.1	-176	0	0	0	0	110.8	E249 M253	E249-V251 PolarHBondContact O-N 3.34Å; V251-M253 PolarHBondContact O-N 2.98Å
252	R	29	Very low	31	Very low	237 Å²	237	128 Å²	128	89%	0.894	74%	0.74	S	S	*	*			trans	-66.6	112.3	177.8	-175.5	177	-69	-170.9	-1.9	111.4	D250	D250-R252 VanDerWaalsContact C-N 3.34Å; D250-R252 PolarHBondContact O-N 3.28Å
253	M	29.2	Very low	31.1	Very low	123 Å²	123	129.2 Å²	129.2	61%	0.606	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-66.2	145.6	173.8	-71.8	-75.2	174.2	0	0	112.1	V251	V251-M253 PolarHBondContact O-N 2.98Å
254	P	28.5	Very low	31.2	Very low	101 Å²	101	126 Å²	126	66%	0.656	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-73.5	157.8	173.1	31.7	-35.2	0	0	0	112.2
255	A	29.4	Very low	31	Very low	103 Å²	103	127.6 Å²	127.6	85%	0.851	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-79.2	149.5	-179.8	0	0	0	0	0	113
256	F	30.6	Very low	31	Very low	91 Å²	91	124.2 Å²	124.2	40%	0.399	72%	0.716	S	S	.	*	P	Polyproline II helix	trans	-99	148.1	-178	-72.3	-87.1	0	0	0	113.2	V126 G207 P209	V126-F256 HydrophobicContact CG1-CD2 4.45Å; V126-F256 HydrophobicContact CG1-CE2 4.43Å; G207-F256 WeakPolarHBondContact O-CD1 3.46Å; G207-F256 WeakPolarHBondContact O-CE1 3.4Å; P209-F256 HydrophobicContact CB-CE1 4.37Å; P209-F256 HydrophobicContact CB-CZ 3.92Å; P209-F256 VanDerWaalsContact CD-CZ 3.49Å; P209-F256 HydrophobicContact CG-CE1 4.32Å; P209-F256 HydrophobicContact CG-CZ 3.69Å
257	P	30.7	Very low	31	Very low	102 Å²	102	128.1 Å²	128.1	66%	0.662	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-69.7	148.8	169.5	30.6	-34.8	0	0	0	111.9	F259	P257-F259 PolarHBondContact O-N 2.93Å
258	S	28.8	Very low	30.9	Very low	128 Å²	128	136 Å²	136	90%	0.895	73%	0.727	S	S	*	*			trans	-71.1	90	-170.1	-54.8	0	0	0	0	114.3	N260	S258-N260 PolarHBondContact O-N 3.49Å
259	F	29.2	Very low	30.6	Very low	123 Å²	123	134.6 Å²	134.6	54%	0.539	71%	0.711	S	S	.	*			trans	-67.5	128.1	172	-105.6	-94.2	0	0	0	112.7	S203 P257 V261	S203-F259 WeakPolarHBondContact O-CZ 3.45Å; P257-F259 PolarHBondContact O-N 2.93Å; F259-V261 PolarHBondContact O-N 3.2Å
260	N	27.8	Very low	30.2	Very low	126 Å²	126	133.1 Å²	133.1	67%	0.674	71%	0.706	S	S	*	*			trans	-78.6	109.6	-176.1	-170.7	-20.6	0	0	0	111.5	S258 S262	S258-N260 PolarHBondContact O-N 3.49Å; N260-S262 PolarHBondContact O-N 3.33Å; N260-S262 VanDerWaalsContact OD1-CB 3.3Å; N260-S262 WeakPolarHBondContact OD1-CB 3.24Å; N260-S262 PolarHBondContact OD1-N 3.37Å; N260-S262 PolarHBondContact OD1-OG 2.99Å
261	V	34.3	Very low	30.2	Very low	83 Å²	83	134.6 Å²	134.6	50%	0.503	70%	0.704	S	S	.	*	G	3₁₀ helix	trans	-74.8	-8.6	-172.7	-173	0	0	0	0	113.1	F259 R263 F264	F259-V261 PolarHBondContact O-N 3.2Å; V261-R263 PolarHBondContact O-N 3.05Å; V261-F264 PolarHBondContact O-N 3.34Å
262	S	29.8	Very low	30.1	Very low	99 Å²	99	137.6 Å²	137.6	69%	0.692	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-61.4	-14	-173.3	61.3	0	0	0	0	116	N260	N260-S262 PolarHBondContact O-N 3.33Å; N260-S262 VanDerWaalsContact OD1-CB 3.3Å; N260-S262 WeakPolarHBondContact OD1-CB 3.24Å; N260-S262 PolarHBondContact OD1-N 3.37Å; N260-S262 PolarHBondContact OD1-OG 2.99Å
263	R	35	Very low	30.2	Very low	175 Å²	175	131.7 Å²	131.7	66%	0.66	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-81.2	-6.8	-178.5	-134	176	-170.4	-179.6	-0.4	115	H204 V261	H204-R263 PolarHBondContact NE2-NH1 3.2Å; V261-R263 PolarHBondContact O-N 3.05Å
264	F	32.8	Very low	30.1	Very low	134 Å²	134	131.7 Å²	131.7	59%	0.588	72%	0.715	S	S	*	*	S	Bend	trans	-119.4	118.5	175.6	-71.2	-83.7	0	0	0	111.1	V261 S266	V261-F264 PolarHBondContact O-N 3.34Å; F264-S266 PolarHBondContact O-N 3.12Å; F264-S266 VanDerWaalsContact O-N 3.13Å
265	P	31.7	Very low	30.3	Very low	130 Å²	130	130.5 Å²	130.5	84%	0.844	72%	0.721	S	S	*	*			trans	-60.3	116.8	170.6	-20.9	32.8	0	0	0	109.8
266	S	32.9	Very low	30.3	Very low	100 Å²	100	129.1 Å²	129.1	70%	0.699	72%	0.717	S	S	*	*			trans	-60.6	143.8	-176.6	-42.1	0	0	0	0	111.3	F264 R268	F264-S266 PolarHBondContact O-N 3.12Å; F264-S266 VanDerWaalsContact O-N 3.13Å; S266-R268 PolarHBondContact O-N 3.16Å
267	L	31.8	Very low	30.5	Very low	168 Å²	168	133.3 Å²	133.3	88%	0.88	74%	0.744	S	S	*	*			trans	-67.7	72.5	168.9	-77.2	168.6	0	0	0	110.9	L269	L267-L269 PolarHBondContact O-N 3.37Å; L267-L269 VanDerWaalsContact O-N 3.09Å
268	R	26.8	Very low	30.4	Very low	226 Å²	226	133.5 Å²	133.5	85%	0.853	75%	0.748	S	S	*	*			trans	-66.1	103.2	156.3	-77.6	-173.2	175.9	179.9	-0.4	107.1	S266 M270	S266-R268 PolarHBondContact O-N 3.16Å; R268-M270 PolarHBondContact O-N 3.45Å
269	L	29.9	Very low	30.7	Very low	105 Å²	105	133.5 Å²	133.5	55%	0.55	75%	0.748	S	S	.	*			trans	-51.9	114.9	159.7	-93.2	78.4	0	0	0	107.5	E92 L267 K271	E92-L269 HydrophobicContact CG-CD2 4.14Å; L267-L269 PolarHBondContact O-N 3.37Å; L267-L269 VanDerWaalsContact O-N 3.09Å; L269-K271 PolarHBondContact O-N 3.35Å
270	M	25.9	Very low	30.6	Very low	156 Å²	156	139 Å²	139	77%	0.768	77%	0.765	S	S	*	*			trans	-71.6	99.6	177.9	-75.8	-169.8	171.6	0	0	109.1	R268 F272	R268-M270 PolarHBondContact O-N 3.45Å; M270-F272 VanDerWaalsContact C-N 3.28Å; M270-F272 HydrophobicContact CB-CD2 3.98Å; M270-F272 HydrophobicContact CB-CE2 3.94Å; M270-F272 PolarHBondContact O-N 3.05Å; M270-F272 HydrophobicContact SD-CE2 4.01Å
271	K	28.8	Very low	30.7	Very low	196 Å²	196	139.8 Å²	139.8	85%	0.852	77%	0.774	S	S	*	*			trans	-64	86.1	169.6	-70.8	-174.4	175	-177.4	0	110.2	L269 S273	L269-K271 PolarHBondContact O-N 3.35Å; K271-S273 PolarHBondContact O-N 2.97Å; K271-S273 VanDerWaalsContact O-N 3.12Å
272	F	28.6	Very low	30.6	Very low	183 Å²	183	141.5 Å²	141.5	80%	0.803	79%	0.789	S	S	*	*			trans	-76	92.9	168.6	-89.7	-81.5	0	0	0	110	M270	M270-F272 VanDerWaalsContact C-N 3.28Å; M270-F272 HydrophobicContact CB-CD2 3.98Å; M270-F272 HydrophobicContact CB-CE2 3.94Å; M270-F272 PolarHBondContact O-N 3.05Å; M270-F272 HydrophobicContact SD-CE2 4.01Å
273	S	31.4	Very low	30.6	Very low	114 Å²	114	140.9 Å²	140.9	80%	0.797	79%	0.791	S	S	*	*			trans	-69.1	135.2	164.1	-170.4	0	0	0	0	109.8	K271 G275	K271-S273 PolarHBondContact O-N 2.97Å; K271-S273 VanDerWaalsContact O-N 3.12Å; S273-G275 PolarHBondContact O-N 2.74Å
274	S	28.6	Very low	30.5	Very low	122 Å²	122	143 Å²	143	85%	0.853	80%	0.804	S	S	*	*			trans	-80.1	99.1	-178.2	54.8	0	0	0	0	111.4
275	G	32.1	Very low	30.6	Very low	76 Å²	76	139.6 Å²	139.6	78%	0.784	81%	0.807	S	S	*	*			trans	-129.3	109.7	170.3	0	0	0	0	0	110.3	S273	S273-G275 PolarHBondContact O-N 2.74Å
276	G	28.7	Very low	30.7	Very low	74 Å²	74	139.7 Å²	139.7	76%	0.763	81%	0.811	S	S	*	*			trans	-103.3	138.8	-179.6	0	0	0	0	0	112.5
277	N	35	Very low	30.8	Very low	179 Å²	179	138.5 Å²	138.5	96%	0.957	82%	0.815	S	S	*	*			trans	-154.9	158.2	137	-120.5	-31.7	0	0	0	111.8
278	S	29.2	Very low	30.8	Very low	107 Å²	107	136.3 Å²	136.3	75%	0.748	81%	0.808	S	S	*	*			trans	-114.2	135.2	-169.6	-174.3	0	0	0	0	111.9
279	S	35	Very low	31	Very low	128 Å²	128	135.4 Å²	135.4	90%	0.895	81%	0.811	S	S	*	*			trans	-150	141.1	169.8	-72.5	0	0	0	0	109.6
280	R	26	Very low	31.1	Very low	238 Å²	238	133.3 Å²	133.3	90%	0.898	81%	0.814	S	S	*	*			trans	-133.6	114.5	-164.5	174.7	-156.3	-84.5	174.2	-8.4	111.8
281	V	31.6	Very low	31.4	Very low	142 Å²	142	134.8 Å²	134.8	86%	0.861	83%	0.825	S	S	*	*			trans	-141.1	102.8	160.7	-176.5	0	0	0	0	105.9
282	S	30.3	Very low	31.4	Very low	119 Å²	119	128.8 Å²	128.8	83%	0.832	82%	0.819	S	S	*	*				83.2	147.4	79.3	-157.9	0	0	0	0	112.9
283	A	30.7	Very low	31.6	Very low	87 Å²	87	126.1 Å²	126.1	72%	0.719	82%	0.823	S	S	*	*			trans	-140.4	155.9	-154.5	0	0	0	0	0	115.3
284	K	34	Very low	31.4	Very low	218 Å²	218	127 Å²	127	95%	0.948	82%	0.823	S	S	*	*			trans	178.7	143.2	155.3	-94.9	148.8	-176.2	-176.7	0	107.8
285	G	34.3	Very low	31.6	Very low	63 Å²	63	125.7 Å²	125.7	65%	0.649	82%	0.819	S	S	*	*			cis	-178.2	168	-8.9	0	0	0	0	0	113.4
286	S	33.3	Very low	31.4	Very low	133 Å²	133	132.6 Å²	132.6	93%	0.93	82%	0.822	S	S	*	*			trans	48	117.8	149.5	56.7	0	0	0	0	121.8
287	G	34.3	Very low	31.5	Very low	75 Å²	75	138.8 Å²	138.8	77%	0.773	83%	0.828	S	S	*	*			trans	173.2	116.5	159.3	0	0	0	0	0	111.3
288	T	31.9	Very low	31.1	Very low	121 Å²	121	140.9 Å²	140.9	74%	0.742	82%	0.822	S	S	*	*			trans	-138.7	163.3	-172.6	45.8	0	0	0	0	113
289	F	32.1	Very low	31.1	Very low	208 Å²	208	140.9 Å²	140.9	91%	0.912	82%	0.822	S	S	*	*			trans	72	138.5	-177.2	-57.6	-90	0	0	0	115.4
290	G	31.2	Very low	30.8	Very low	60 Å²	60	141 Å²	141	62%	0.619	82%	0.817	S	S	*	*			cis	170.8	156.3	-9.5	0	0	0	0	0	113.5
291	L	33.5	Very low	30.9	Very low	187 Å²	187	136.9 Å²	136.9	98%	0.979	81%	0.808	S	S	*	*			trans	66.1	140	177	-46.9	172.8	0	0	0	115.2
292	G	27.7	Very low	30.7	Very low	71 Å²	71	140.2 Å²	140.2	73%	0.732	81%	0.805	S	S	*	*			cis	167.2	110.2	-12	0	0	0	0	0	112.9
293	S	32.8	Very low	30.8	Very low	126 Å²	126	143.8 Å²	143.8	88%	0.881	81%	0.809	S	S	*	*			trans	-163.4	155.4	166.3	-88.5	0	0	0	0	112
294	V	27.8	Very low	30.9	Very low	134 Å²	134	147.8 Å²	147.8	81%	0.812	82%	0.817	S	S	*	*			trans	-102.2	97.8	-163	-178.3	0	0	0	0	112.6	R296	V294-R296 HydrophobicContact CG1-CG 4.27Å
295	A	31.6	Very low	30.8	Very low	93 Å²	93	149 Å²	149	77%	0.769	82%	0.816	S	S	*	*			trans	-107	108.2	168.4	0	0	0	0	0	110.8	K297	A295-K297 VanDerWaalsContact C-N 3.34Å; A295-K297 PolarHBondContact O-N 3.29Å
296	R	29.2	Very low	30.6	Very low	221 Å²	221	157.4 Å²	157.4	83%	0.834	83%	0.828	S	S	*	*			trans	-79.7	72.1	-176.9	-66.9	-173.5	-175.6	171.2	3.5	112.9	V294 W298	V294-R296 HydrophobicContact CG1-CG 4.27Å; R296-W298 PolarHBondContact O-N 3.25Å
297	K	29.3	Very low	30.7	Very low	204 Å²	204	159.9 Å²	159.9	89%	0.887	83%	0.825	S	S	*	*			trans	-80.4	106.1	171.3	-152.5	168.6	-170.8	173	0	109.6	A295 S299	A295-K297 VanDerWaalsContact C-N 3.34Å; A295-K297 PolarHBondContact O-N 3.29Å; K297-S299 PolarHBondContact O-N 3.03Å
298	W	26.6	Very low	30.7	Very low	223 Å²	223	164.3 Å²	164.3	85%	0.845	83%	0.825	S	S	*	*			trans	-69.2	114.2	-178	-87.2	65.2	0	0	0	111.3	R296 V300	R296-W298 PolarHBondContact O-N 3.25Å; W298-V300 HydrophobicContact CE3-CG2 4.24Å
299	S	29.4	Very low	30.8	Very low	108 Å²	108	164.7 Å²	164.7	76%	0.755	83%	0.83	S	S	*	*			trans	-102	104.6	170.7	-176.1	0	0	0	0	108.8	K297 E301	K297-S299 PolarHBondContact O-N 3.03Å; S299-E301 PolarHBondContact O-N 3.47Å
300	V	28.8	Very low	30.8	Very low	130 Å²	130	160.8 Å²	160.8	79%	0.788	82%	0.823	S	S	*	*			trans	-93	75.3	-179.7	-174.6	0	0	0	0	109.4	W298	W298-V300 HydrophobicContact CE3-CG2 4.24Å
301	E	28.4	Very low	31.1	Very low	151 Å²	151	167.8 Å²	167.8	71%	0.706	84%	0.836	S	S	*	*			trans	-146.6	148.5	169.5	-150.5	-177.3	-169.5	0	0	112.3	S299	S299-E301 PolarHBondContact O-N 3.47Å
302	R	28.5	Very low	31.1	Very low	212 Å²	212	168 Å²	168	80%	0.8	83%	0.833	S	S	*	*			trans	61.1	82.7	177.5	-44.6	-179.7	-151.4	155.6	6.4	116.3
303	H	30.9	Very low	31.5	Very low	195 Å²	195	172.7 Å²	172.7	90%	0.903	84%	0.838	S	S	*	*			trans	-152.9	29.9	150.3	-112.8	87.1	0	0	0	116
304	L	33.4	Very low	31.7	Very low	171 Å²	171	172.7 Å²	172.7	90%	0.895	83%	0.834	S	S	*	*	S	Bend	trans	-124.6	25.8	-178.5	-95.3	171	0	0	0	115.8
305	R	32	Very low	32	Very low	243 Å²	243	177.6 Å²	177.6	92%	0.917	84%	0.838	S	S	*	*	S	Bend	trans	-138.3	74.7	170	-74.9	-168.3	179.3	-134.1	4.1	111.9
306	R	31.1	Very low	32.4	Very low	239 Å²	239	178 Å²	178	90%	0.902	84%	0.842	S	S	*	*			trans	-162.3	36.4	172	-118.3	167.9	-159	-134.6	1.8	116.6
307	Q	33.6	Very low	32.6	Very low	185 Å²	185	175.4 Å²	175.4	86%	0.864	84%	0.844	S	S	*	*			trans	-139.7	82.9	168.5	-70.9	-62.6	-8.3	0	0	111.7
308	Q	35.1	Very low	33.1	Very low	168 Å²	168	170.6 Å²	170.6	79%	0.785	84%	0.843	S	S	*	*			trans	-137.3	125	156.7	-89	-170.3	-21.7	0	0	107.7	T310	Q308-T310 PolarHBondContact O-N 3.05Å
309	P	33.5	Very low	33.3	Very low	130 Å²	130	169.5 Å²	169.5	84%	0.844	84%	0.844	S	S	*	*			trans	-89.3	75.5	-177.3	35.1	-34.4	0	0	0	111.6	K311	P309-K311 PolarHBondContact O-N 3.13Å
310	T	32.6	Very low	33.6	Very low	126 Å²	126	169.2 Å²	169.2	77%	0.773	84%	0.842	S	S	*	*			trans	-72.7	108.5	168.7	42.3	0	0	0	0	110.2	Q308	Q308-T310 PolarHBondContact O-N 3.05Å
311	K	36.7	Very low	33.9	Very low	206 Å²	206	169.9 Å²	169.9	90%	0.896	84%	0.841	S	S	*	*			trans	-121.5	64.5	169.2	-90.4	-164.5	172.3	-172.4	0	110.6	P309	P309-K311 PolarHBondContact O-N 3.13Å
312	E	34.9	Very low	34.1	Very low	192 Å²	192	174.5 Å²	174.5	90%	0.897	85%	0.852	S	S	*	*			trans	-88.3	133.2	155.3	-66.1	-172.5	139.4	0	0	107.9
313	M	35.9	Very low	34.4	Very low	170 Å²	170	172.1 Å²	172.1	84%	0.837	85%	0.852	S	S	*	*			trans	-127	119.1	179.1	-171.1	168.4	74.1	0	0	107.9
314	P	35.7	Very low	34.7	Very low	125 Å²	125	171 Å²	171	81%	0.812	85%	0.847	S	S	*	*			trans	-70.3	141.7	-173.6	28.6	-34.7	0	0	0	111
315	R	35.6	Very low	34.9	Very low	237 Å²	237	168.3 Å²	168.3	89%	0.894	84%	0.842	S	S	*	*			trans	-116.9	129.7	155.9	-79.7	-173.8	168.6	-175.5	-4	107.5
316	A	40.5	Very low	35.1	Very low	102 Å²	102	159.9 Å²	159.9	84%	0.843	83%	0.831	S	S	*	*			trans	-92.9	148.8	173.5	0	0	0	0	0	110
317	D	32.9	Very low	35.3	Very low	166 Å²	166	158.8 Å²	158.8	89%	0.888	83%	0.827	S	S	*	*			trans	-76.8	139.6	175.3	-59.4	-74.5	0	0	0	112.3
318	A	38.3	Very low	35.6	Very low	103 Å²	103	156.7 Å²	156.7	85%	0.851	82%	0.817	S	S	*	*			trans	-154.1	151.3	159.6	0	0	0	0	0	110.2
319	K	32.1	Very low	35.6	Very low	200 Å²	200	154.2 Å²	154.2	87%	0.87	82%	0.818	S	S	*	*			trans	-99.9	-173.5	-175.8	-71.5	-179	173.9	178.5	0	112.3
320	S	36.4	Very low	35.8	Very low	102 Å²	102	151.5 Å²	151.5	71%	0.713	81%	0.814	S	S	*	*			trans	68.7	112.1	172.6	41.2	0	0	0	0	115.2
321	D	33.3	Very low	35.8	Very low	145 Å²	145	152.4 Å²	152.4	78%	0.775	82%	0.819	S	S	*	*				82.4	114.9	65.1	-68.2	-44.1	0	0	0	112
322	W	33.5	Very low	35.5	Very low	247 Å²	247	148.3 Å²	148.3	94%	0.936	81%	0.811	S	S	*	*				-174.9	163.6	113.6	-106.7	62.7	0	0	0	110.5
323	M	34.1	Very low	35.5	Very low	162 Å²	162	146 Å²	146	80%	0.798	81%	0.81	S	S	*	*			trans	-98.7	155.9	-166.6	-55	170.1	106.9	0	0	113.7
324	H	37.3	Very low	35.1	Very low	173 Å²	173	145.5 Å²	145.5	80%	0.801	81%	0.81	S	S	*	*			trans	152.9	149.3	135	-81.7	15.3	0	0	0	111.2
325	S	37.6	Very low	35.1	Very low	113 Å²	113	144.5 Å²	144.5	79%	0.79	81%	0.806	S	S	*	*			cis	-167.8	164.1	-24	59.9	0	0	0	0	110
326	G	36.4	Very low	35	Very low	66 Å²	66	137.8 Å²	137.8	68%	0.68	80%	0.795	S	S	*	*			trans	104	108.3	175.6	0	0	0	0	0	114.1
327	R	36.1	Very low	34.7	Very low	217 Å²	217	141.6 Å²	141.6	82%	0.819	80%	0.8	S	S	*	*				80.8	132.8	71.4	-79.6	-174.2	178.6	-126.7	12.7	113
328	Q	38.8	Very low	34.6	Very low	140 Å²	140	136.9 Å²	136.9	65%	0.654	79%	0.791	S	S	*	*			cis	-159.2	163.3	-1.6	-137.2	163.8	-30.9	0	0	111.9
329	S	36.5	Very low	35	Very low	116 Å²	116	137.8 Å²	137.8	81%	0.811	79%	0.789	S	S	*	*			trans	15.8	140.5	163.1	-51	0	0	0	0	121.4
330	G	37.5	Very low	35	Very low	73 Å²	73	132.8 Å²	132.8	75%	0.753	78%	0.778	S	S	*	*			cis	-175.7	-152.3	7.5	0	0	0	0	0	109.4
331	T	32.9	Very low	35	Very low	145 Å²	145	137 Å²	137	89%	0.89	78%	0.784	S	S	*	*			cis	-155.9	172.3	2	-56.8	0	0	0	0	108.7
332	V	29.8	Very low	35.1	Very low	120 Å²	120	134.7 Å²	134.7	73%	0.727	78%	0.779	S	S	*	*			trans	-101.4	145.3	-173.2	172.2	0	0	0	0	113.8
333	V	33.4	Very low	35.1	Very low	143 Å²	143	131.9 Å²	131.9	87%	0.867	77%	0.774	S	S	*	*			trans	-147.4	147.7	136.8	177.3	0	0	0	0	109.6
334	L	29.5	Very low	35.1	Very low	161 Å²	161	130.8 Å²	130.8	84%	0.843	77%	0.771	S	S	*	*			trans	-128.3	138.3	-178.1	-110.1	163.2	0	0	0	110.9
335	S	35.7	Very low	34.9	Very low	103 Å²	103	125.7 Å²	125.7	72%	0.72	76%	0.764	S	S	*	*			trans	-174.6	165.6	160.9	49.8	0	0	0	0	112.4
336	S	31.6	Very low	34.8	Very low	96 Å²	96	128.8 Å²	128.8	67%	0.671	77%	0.771	S	S	*	*				-179.1	137	-63.9	49.7	0	0	0	0	111.5
337	L	34.5	Very low	34.7	Very low	182 Å²	182	128.7 Å²	128.7	95%	0.953	77%	0.77	S	S	*	*			trans	66.7	163.2	166.9	-52.4	159.9	0	0	0	114.7
338	G	31.9	Very low	34.7	Very low	67 Å²	67	123.7 Å²	123.7	69%	0.691	77%	0.769	S	S	*	*			cis	-162.5	-176.9	0.1	0	0	0	0	0	112.3
339	P	45.8	Very low	34.5	Very low	123 Å²	123	124.9 Å²	124.9	80%	0.799	78%	0.779	S	S	*	*			trans	-120.9	175.3	-156.1	42.3	-33.5	0	0	0	117.3
340	S	32.9	Very low	34.2	Very low	94 Å²	94	124.5 Å²	124.5	66%	0.657	78%	0.775	S	S	*	*				147.1	160.5	120.8	65.6	0	0	0	0	117.3
341	K	36.9	Very low	34.2	Very low	192 Å²	192	125.4 Å²	125.4	84%	0.835	78%	0.775	S	S	*	*			trans	78.5	150.2	161.3	-60.8	168.9	-169.9	176.7	0	119.1
342	S	34.4	Very low	34.1	Very low	95 Å²	95	129.9 Å²	129.9	66%	0.664	78%	0.776	S	S	*	*			cis	-179.7	173.2	-41.7	47.5	0	0	0	0	110.9
343	F	33.9	Very low	34.4	Very low	188 Å²	188	133.7 Å²	133.7	83%	0.825	78%	0.782	S	S	*	*			trans	76.7	147.8	171.2	-92	-115.9	0	0	0	118.4
344	L	34.2	Very low	34.4	Very low	140 Å²	140	135.2 Å²	135.2	73%	0.733	78%	0.777	S	S	*	*			cis	-169	138	-44.8	-123.6	173.7	0	0	0	112.6
345	G	33.6	Very low	34.6	Very low	65 Å²	65	134.2 Å²	134.2	67%	0.67	77%	0.772	S	S	*	*			trans	87	159.3	151	0	0	0	0	0	119.3
346	L	34.5	Very low	34.9	Very low	179 Å²	179	133.6 Å²	133.6	94%	0.937	77%	0.766	S	S	*	*			cis	-167	151.8	-20.9	-127	176.2	0	0	0	111.5
347	G	33.9	Very low	34.9	Very low	64 Å²	64	137.4 Å²	137.4	66%	0.66	77%	0.773	S	S	*	*			trans	118.2	121.9	171.7	0	0	0	0	0	112.7
348	S	35.8	Very low	34.9	Very low	112 Å²	112	137.4 Å²	137.4	78%	0.783	77%	0.768	S	S	*	*			cis	117.3	127.4	40.3	166.5	0	0	0	0	107.5
349	L	35.1	Very low	35	Very low	165 Å²	165	141.6 Å²	141.6	86%	0.864	77%	0.774	S	S	*	*			cis	-145.3	-157	6.8	-121.9	169.3	0	0	0	111.8
350	C	30.5	Very low	34.6	Very low	108 Å²	108	140.3 Å²	140.3	73%	0.73	77%	0.765	S	S	*	*			trans	-154.5	138.4	-157.6	179.5	0	0	0	0	117.6
351	A	36.7	Very low	34.5	Very low	92 Å²	92	141.2 Å²	141.2	76%	0.76	77%	0.772	S	S	*	*			trans	-149.9	126.9	160.7	0	0	0	0	0	109.9
352	R	31.6	Very low	34.7	Very low	238 Å²	238	137.9 Å²	137.9	90%	0.898	77%	0.77	S	S	*	*				71.6	131	54.7	-65.1	-178.3	170.9	-159.1	-2.6	112.3
353	K	36.9	Very low	34.5	Very low	200 Å²	200	138.6 Å²	138.6	87%	0.87	78%	0.775	S	S	*	*			cis	-143.9	171.7	12.4	-117.4	-172.9	178.2	-170.9	0	108.3
354	K	32.9	Very low	34.3	Very low	175 Å²	175	135.3 Å²	135.3	76%	0.761	77%	0.77	S	S	*	*			cis	79.4	131.9	5.8	-78.1	-157.1	170.4	-162.7	0	120.2
355	L	32.7	Very low	34.3	Very low	140 Å²	140	136 Å²	136	73%	0.733	77%	0.77	S	S	*	*			cis	-139.1	-104.4	5.5	-170.5	69.1	0	0	0	117.8
356	P	43.5	Very low	34	Very low	90 Å²	90	139.2 Å²	139.2	58%	0.584	77%	0.771	S	S	*	*			trans	-136	-163.9	-148.6	46.9	-26.7	0	0	0	119.1
357	E	31.3	Very low	33.6	Very low	176 Å²	176	134.7 Å²	134.7	82%	0.822	75%	0.754	S	S	*	*			trans	73.8	144.1	159.2	-71.4	161.3	154.2	0	0	118.8
358	E	33.5	Very low	33.4	Very low	183 Å²	183	139.8 Å²	139.8	86%	0.855	76%	0.758	S	S	*	*			cis	-144.3	-156.9	2.8	-140.4	-169.3	161.4	0	0	114.2
359	L	33.8	Very low	33	Very low	154 Å²	154	142 Å²	142	81%	0.806	76%	0.761	S	S	*	*			trans	-118.9	-166	-164	-83.5	167.3	0	0	0	112.7
360	P	37.3	Very low	32.6	Very low	96 Å²	96	139.1 Å²	139.1	62%	0.623	75%	0.754	S	S	*	*			cis	-138.2	171.8	-47.1	36.2	-18.9	0	0	0	117.2
361	S	31.2	Very low	32.4	Very low	114 Å²	114	143.1 Å²	143.1	80%	0.797	76%	0.759	S	S	*	*			trans	80.6	162.9	140.2	70.7	0	0	0	0	123
362	P	40.9	Very low	32.1	Very low	121 Å²	121	145.7 Å²	145.7	79%	0.786	76%	0.761	S	S	*	*			trans	-131.6	171.9	-157.5	44.5	-29.7	0	0	0	118.1
363	S	31.2	Very low	31.8	Very low	110 Å²	110	140 Å²	140	77%	0.769	75%	0.752	S	S	*	*			trans	-164.1	121.1	160.6	43.5	0	0	0	0	117.4
364	T	29.3	Very low	31.3	Very low	119 Å²	119	135.4 Å²	135.4	73%	0.73	75%	0.745	S	S	*	*				55	157.7	126.7	-18.9	0	0	0	0	124.4
365	E	33.1	Very low	31	Very low	155 Å²	155	132 Å²	132	72%	0.724	74%	0.739	S	S	*	*			trans	72.6	155.9	165	-58.2	-61.6	101.9	0	0	119.2
366	L	27.4	Very low	30.7	Very low	132 Å²	132	132.1 Å²	132.1	69%	0.691	74%	0.74	S	S	*	*				-173	153.9	-57	-121.4	-178.2	0	0	0	108.3
367	S	26.5	Very low	29.9	Very low	85 Å²	85	135.6 Å²	135.6	59%	0.594	75%	0.753	S	S	*	*			trans	68.6	157.1	168.6	83.5	0	0	0	0	115.8
368	K	30	Very low	29.6	Very low	170 Å²	170	136.3 Å²	136.3	74%	0.739	75%	0.754	S	S	*	*			cis	-151.6	149.3	13.7	-113.7	127.7	-160.9	153.9	0	110.6
369	L	27.3	Very low	29.4	Very low	160 Å²	160	134.6 Å²	134.6	84%	0.838	75%	0.751	S	S	*	*			trans	62.4	153.6	144.6	-59.8	167.2	0	0	0	118.9
370	S	28	Very low	29	Very low	103 Å²	103	132.1 Å²	132.1	72%	0.72	75%	0.745	S	S	*	*			cis	-163.9	151.7	-20.1	45.1	0	0	0	0	110.3
371	F	26.3	Very low	28.7	Very low	192 Å²	192	135.9 Å²	135.9	84%	0.842	75%	0.752	S	S	*	*			trans	-75.1	150.9	167.9	-93.1	-105.8	0	0	0	112.3
372	N	30.1	Very low	28.7	Very low	147 Å²	147	137.3 Å²	137.3	79%	0.786	75%	0.751	S	S	*	*			trans	173.3	111.4	142.1	-85.6	-12.4	0	0	0	107
373	T	24.7	Very low	28.2	Very low	119 Å²	119	136.8 Å²	136.8	73%	0.73	75%	0.75	S	S	*	*				53.4	105.9	80.1	65.9	0	0	0	0	115.4
374	S	27.1	Very low	28.3	Very low	102 Å²	102	138.9 Å²	138.9	71%	0.713	75%	0.747	S	S	*	*				177.6	148.4	111.8	-163.5	0	0	0	0	113.3
375	T	26.7	Very low	28.1	Very low	103 Å²	103	141 Å²	141	63%	0.632	75%	0.747	S	S	*	*			trans	41.4	128.8	146.5	47.2	0	0	0	0	123
376	D	25.1	Very low	28	Very low	143 Å²	143	140 Å²	140	77%	0.765	75%	0.751	S	S	*	*			trans	59.9	137.5	133.3	-43.6	-24.4	0	0	0	118.9
377	L	27.3	Very low	28	Very low	164 Å²	164	138.3 Å²	138.3	86%	0.859	75%	0.75	S	S	*	*			cis	-156.3	174.2	46.4	-160.2	68.8	0	0	0	111.8
378	F	24.9	Very low	28.2	Very low	191 Å²	191	138.7 Å²	138.7	84%	0.838	76%	0.758	S	S	*	*			trans	-67.8	147.4	164.2	-85.5	-110.7	0	0	0	111.9
379	D	29.5	Very low	28.3	Very low	146 Å²	146	136.1 Å²	136.1	78%	0.781	76%	0.762	S	S	*	*				-153.9	161.4	122.5	-143.8	-15.7	0	0	0	111.5
380	C	24.2	Very low	28.4	Very low	102 Å²	102	133.7 Å²	133.7	69%	0.689	76%	0.758	S	S	*	*			trans	-142.2	144.9	174.1	-75.7	0	0	0	0	108.9
381	K	32.7	Very low	28.6	Very low	176 Å²	176	133.7 Å²	133.7	77%	0.765	76%	0.758	S	S	*	*			trans	-165.9	141	158.7	-108.1	167.9	-173.2	165.4	0	113.2
382	D	30.1	Very low	28.7	Very low	144 Å²	144	133.4 Å²	133.4	77%	0.77	76%	0.757	S	S	*	*			trans	48.8	135.2	140.3	-46.8	-19.5	0	0	0	119.1
383	S	31.3	Very low	28.7	Very low	110 Å²	110	133.6 Å²	133.6	77%	0.769	76%	0.758	S	S	*	*			cis	-146.3	-160.3	23.5	51.9	0	0	0	0	110
384	E	32.1	Very low	28.8	Very low	153 Å²	153	131.7 Å²	131.7	72%	0.715	75%	0.749	S	S	*	*			cis	-157.5	-177.2	15.7	-133.9	-57.7	67.9	0	0	110.3
385	F	26	Very low	29	Very low	165 Å²	165	132.8 Å²	132.8	72%	0.724	76%	0.757	S	S	*	*			trans	-62.9	169.4	176.6	-94.5	-122.4	0	0	0	115.2
386	V	30.8	Very low	29.2	Very low	134 Å²	134	136.1 Å²	136.1	81%	0.812	77%	0.765	S	S	*	*			cis	-141.5	154.3	41.4	-179.7	0	0	0	0	113.5
387	S	27.6	Very low	29.4	Very low	96 Å²	96	135.1 Å²	135.1	67%	0.671	77%	0.769	S	S	*	*			trans	-75.7	173.5	178.6	56.5	0	0	0	0	113.8
388	A	30.6	Very low	29.2	Very low	92 Å²	92	132.6 Å²	132.6	76%	0.76	76%	0.764	S	S	*	*			cis	-153.3	-164.8	23.7	0	0	0	0	0	110.5
389	S	31.7	Very low	29.3	Very low	117 Å²	117	129.4 Å²	129.4	82%	0.818	77%	0.765	S	S	*	*			cis	-153.5	-91.4	14.1	49.3	0	0	0	0	114.9
390	S	29.1	Very low	29.2	Very low	108 Å²	108	127.8 Å²	127.8	76%	0.755	77%	0.766	S	S	*	*			trans	-151.7	163.5	-168.1	58.4	0	0	0	0	110.7
391	S	31.9	Very low	29.2	Very low	103 Å²	103	127.8 Å²	127.8	72%	0.72	77%	0.766	S	S	*	*			cis	-154.3	162.8	26.8	56.2	0	0	0	0	115
392	F	28.3	Very low	28.8	Very low	186 Å²	186	130.2 Å²	130.2	82%	0.816	77%	0.773	S	S	*	*			trans	-11.4	148.7	155	-68.2	-92.9	0	0	0	118
393	D	30.1	Very low	28.3	Very low	152 Å²	152	129.4 Å²	129.4	81%	0.813	77%	0.772	S	S	*	*			cis	-149	-166.6	49.6	-154.8	-2.3	0	0	0	116.3
394	S	27.3	Very low	28	Very low	79 Å²	79	129.5 Å²	129.5	55%	0.552	77%	0.773	S	S	*	*			trans	-139.6	136.4	-140.1	-31.2	0	0	0	0	113.7
395	S	31.9	Very low	27.5	Very low	124 Å²	124	130 Å²	130	87%	0.867	78%	0.78	S	S	*	*			trans	-160.2	134.1	152.2	50.5	0	0	0	0	113.5
396	H	30.6	Very low	27.4	Very low	173 Å²	173	127.2 Å²	127.2	80%	0.801	78%	0.781	S	S	*	*			trans	-79.1	152.3	-169.7	-57	-100.3	0	0	0	114.8
397	S	29.2	Very low	27.1	Very low	122 Å²	122	126 Å²	126	85%	0.853	78%	0.778	S	S	*	*				-165.8	157.1	110.7	39.9	0	0	0	0	111.2
398	C	23.2	Very low	26.9	Very low	112 Å²	112	128.1 Å²	128.1	76%	0.757	79%	0.787	S	S	*	*			trans	-123.9	-177.6	-163.1	-63.1	0	0	0	0	113.2
399	S	28	Very low	26.5	Very low	123 Å²	123	129.3 Å²	129.3	86%	0.86	79%	0.789	S	S	*	*			trans	86.6	139.1	168.2	82.5	0	0	0	0	116.5
400	S	27.5	Very low	26.1	Very low	113 Å²	113	130.9 Å²	130.9	79%	0.79	79%	0.788	S	S	*	*			cis	-150.8	147.1	-19.6	-172.1	0	0	0	0	110.9
401	S	22.9	Very low	25.8	Very low	101 Å²	101	131.3 Å²	131.3	71%	0.706	79%	0.788	S	S	*	*			trans	-64.5	146.6	168.9	-43.3	0	0	0	0	111.7
402	Y	24	Very low	25.5	Very low	228 Å²	228	132.7 Å²	132.7	89%	0.894	79%	0.792	S	S	*	*			trans	-146.2	125.2	143.5	-119.6	-80.3	0	0	0	110.1
403	V	21	Very low	25.1	Very low	126 Å²	126	133.2 Å²	133.2	76%	0.764	79%	0.794	S	S	*	*			trans	-122	137.2	172.1	173.4	0	0	0	0	106.8
404	S	23.8	Very low	24.8	Very low	113 Å²	113	132.3 Å²	132.3	79%	0.79	79%	0.794	S	S	*	*			trans	-153.8	152	162	-150.6	0	0	0	0	111.8
405	L	21.1	Very low	24.6	Very low	162 Å²	162	134.6 Å²	134.6	85%	0.848	81%	0.805	S	S	*	*			trans	-119.7	129.3	-174.2	-75.1	158.6	0	0	0	109.9
406	S	25	Very low	24.3	Very low	108 Å²	108	133.2 Å²	133.2	76%	0.755	80%	0.801	S	S	*	*			trans	-172	109.8	159.2	4.6	0	0	0	0	107.5
407	S	24.8	Very low	23.9	Very low	108 Å²	108	134.3 Å²	134.3	76%	0.755	81%	0.807	S	S	*	*				84.2	96.3	76.3	72.5	0	0	0	0	114.1
408	V	22.5	Very low	23.8	Very low	140 Å²	140	138 Å²	138	85%	0.848	81%	0.81	S	S	*	*			trans	16.5	115.2	146.6	-172.8	0	0	0	0	118
409	C	22.9	Very low	23.9	Very low	118 Å²	118	138.7 Å²	138.7	80%	0.797	81%	0.812	S	S	*	*				-169.7	131.5	128	-115.2	0	0	0	0	114.2
410	N	23.2	Very low	23.7	Very low	149 Å²	149	142.9 Å²	142.9	80%	0.797	82%	0.815	S	S	*	*			trans	29.4	142.4	161.6	-75.1	-25.9	0	0	0	123.8
411	P	23.5	Very low	23.6	Very low	117 Å²	117	143.6 Å²	143.6	76%	0.76	81%	0.805	S	S	*	*			trans	-84.5	142.2	170.9	35.6	-33.6	0	0	0	112.7
412	T	24.6	Very low	23.7	Very low	133 Å²	133	146.2 Å²	146.2	82%	0.816	80%	0.804	S	S	*	*			trans	-104.4	139.5	166.6	39.1	0	0	0	0	111.3
413	F	20.9	Very low	23.8	Very low	196 Å²	196	144.3 Å²	144.3	86%	0.86	80%	0.8	S	S	*	*			trans	-73.6	139.5	170	-83.6	-118.2	0	0	0	109.9
414	V	23.6	Very low	24.3	Very low	133 Å²	133	148 Å²	148	81%	0.806	81%	0.807	S	S	*	*			trans	-133	113.9	157.5	-177.8	0	0	0	0	107.9
415	T	21.5	Very low	24.4	Very low	128 Å²	128	147.3 Å²	147.3	79%	0.785	81%	0.808	S	S	*	*			trans	-105	129.7	168.6	46.6	0	0	0	0	108.4
416	A	25.7	Very low	24.6	Very low	95 Å²	95	143.1 Å²	143.1	79%	0.785	80%	0.804	S	S	*	*			trans	-140.2	95	174.9	0	0	0	0	0	109.8
417	E	22	Very low	24.8	Very low	196 Å²	196	148.6 Å²	148.6	92%	0.916	81%	0.814	S	S	*	*			trans	-98.8	117.6	154.9	-70.4	-177.6	120.2	0	0	106.7
418	E	29	Very low	24.8	Very low	198 Å²	198	147.6 Å²	147.6	93%	0.925	81%	0.813	S	S	*	*			trans	-131.1	122.8	162.1	-76	-157.9	134.5	0	0	110.6
419	T	24	Very low	25	Very low	128 Å²	128	146.6 Å²	146.6	79%	0.785	81%	0.812	S	S	*	*			trans	-75.5	146.9	-179.4	-24	0	0	0	0	111.1
420	F	24.9	Very low	25.3	Very low	210 Å²	210	147.2 Å²	147.2	92%	0.921	81%	0.806	S	S	*	*			trans	-143.6	141	148.3	-135.2	-89.4	0	0	0	113.1
421	E	25.6	Very low	25.4	Very low	128 Å²	128	147.9 Å²	147.9	60%	0.598	81%	0.808	S	S	*	*			trans	-94.9	154.5	-173.1	-80.3	-151.7	127.3	0	0	114.3
422	K	24.2	Very low	25.5	Very low	157 Å²	157	146 Å²	146	68%	0.683	81%	0.81	S	S	*	*			trans	42.5	108.9	142.4	-62.5	165.5	-171.5	147.3	0	118.2
423	K	26.9	Very low	25.6	Very low	187 Å²	187	144.3 Å²	144.3	81%	0.813	80%	0.803	S	S	*	*				-179.7	119.7	118	-97.2	152.8	-174.6	173.5	0	111.3
424	F	29.5	Very low	25.8	Very low	204 Å²	204	145.2 Å²	145.2	90%	0.895	80%	0.801	S	S	*	*				-178	142.8	102.2	-104.9	-75.2	0	0	0	110
425	A	26.3	Very low	26	Very low	98 Å²	98	146.6 Å²	146.6	81%	0.81	80%	0.798	S	S	*	*			trans	-110.6	150.6	178.1	0	0	0	0	0	110.9
426	G	26.4	Very low	26.2	Very low	75 Å²	75	150.2 Å²	150.2	77%	0.773	80%	0.803	S	S	*	*			trans	90.8	97.7	156.1	0	0	0	0	0	117.3
427	K	29.3	Very low	26.1	Very low	222 Å²	222	152.9 Å²	152.9	97%	0.965	80%	0.8	S	S	*	*			trans	-157	134.2	132.6	-110.7	166.2	-174	176.6	0	109.3
428	A	23.3	Very low	26.3	Very low	88 Å²	88	151.5 Å²	151.5	73%	0.727	79%	0.793	S	S	*	*			trans	-123.6	136.8	-178.9	0	0	0	0	0	110.3
429	S	28.5	Very low	26	Very low	119 Å²	119	147.6 Å²	147.6	83%	0.832	78%	0.783	S	S	*	*			trans	-153.9	90	168.8	-173.1	0	0	0	0	107
430	I	27.5	Very low	26	Very low	131 Å²	131	151.1 Å²	151.1	67%	0.672	79%	0.787	S	S	*	*				80.1	108.8	66.9	-63.7	178.6	0	0	0	112.6
431	I	25.4	Very low	26	Very low	162 Å²	162	148.8 Å²	148.8	83%	0.831	78%	0.782	S	S	*	*			trans	77.6	116	160	-64.7	164.5	0	0	0	118.8
432	G	26.8	Very low	26	Very low	78 Å²	78	148.5 Å²	148.5	80%	0.804	78%	0.784	S	S	*	*			trans	175.8	88.1	169.2	0	0	0	0	0	108.8
433	S	25.3	Very low	26.1	Very low	97 Å²	97	144.3 Å²	144.3	68%	0.678	78%	0.779	S	S	*	*			trans	-103.9	162	-151.6	-52.5	0	0	0	0	117.2
434	R	27	Very low	26.4	Very low	216 Å²	216	143.6 Å²	143.6	82%	0.815	78%	0.778	S	S	*	*			trans	98.9	100.1	167.1	-55.5	172.8	-165.7	-160.5	6.2	113.8
435	H	26.1	Very low	26.4	Very low	162 Å²	162	141.4 Å²	141.4	75%	0.75	77%	0.771	S	S	*	*				60.1	107.1	71	-68.8	-61.9	0	0	0	114.8
436	F	25.6	Very low	26.5	Very low	203 Å²	203	143.2 Å²	143.2	89%	0.89	77%	0.766	S	S	*	*				-155.2	129.9	92.6	-125.8	-87.7	0	0	0	110.8
437	E	24	Very low	26.7	Very low	152 Å²	152	145.5 Å²	145.5	71%	0.71	76%	0.76	S	S	*	*			trans	-90.2	146.4	172.3	-66.9	159.2	100.8	0	0	109.9
438	H	26.4	Very low	26.9	Very low	166 Å²	166	140.5 Å²	140.5	77%	0.769	75%	0.748	S	S	*	*				-179.9	119.3	125.7	-106.1	-77.9	0	0	0	112.2
439	T	22.6	Very low	27.2	Very low	117 Å²	117	139.1 Å²	139.1	72%	0.718	74%	0.743	S	S	*	*			trans	45.2	92.2	150.8	53.6	0	0	0	0	119.1
440	F	23.8	Very low	27.6	Very low	201 Å²	201	139.5 Å²	139.5	88%	0.882	74%	0.742	S	S	*	*			trans	-160.3	64.9	133.3	-117.5	-67.3	0	0	0	111.9
441	M	25.3	Very low	27.7	Very low	162 Å²	162	138.6 Å²	138.6	80%	0.798	75%	0.747	S	S	*	*			trans	-93.9	173.7	159.5	-67.9	-173.1	68.6	0	0	109.8
442	D	25.5	Very low	28.1	Very low	121 Å²	121	137 Å²	137	65%	0.647	75%	0.746	S	S	*	*			trans	65.7	59.6	168.4	-45.1	-27.3	0	0	0	116.2
443	A	27.4	Very low	28.4	Very low	69 Å²	69	142.8 Å²	142.8	57%	0.57	75%	0.749	S	S	*	*	S	Bend	trans	-101.9	-23.2	168.2	0	0	0	0	0	114.3
444	E	31.6	Very low	28.8	Very low	173 Å²	173	143.9 Å²	143.9	81%	0.808	76%	0.757	S	S	*	*	S	Bend	trans	-83	-27.4	-177.7	-71.4	-173.2	114.3	0	0	113.4	L446 L447	E444-L446 VanDerWaalsContact C-N 3.31Å; E444-L446 PolarHBondContact O-N 3.13Å; E444-L447 PolarHBondContact O-N 3.4Å
445	E	30.2	Very low	28.8	Very low	157 Å²	157	140.2 Å²	140.2	73%	0.734	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-77.8	-14	179.9	-158.5	163.9	-147	0	0	113.5
446	L	28.8	Very low	29	Very low	136 Å²	136	136.6 Å²	136.6	71%	0.712	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-93.4	12.7	174.6	-71.2	173.1	0	0	0	114.1	E444	E444-L446 VanDerWaalsContact C-N 3.31Å; E444-L446 PolarHBondContact O-N 3.13Å
447	L	30.6	Very low	29.3	Very low	124 Å²	124	131.7 Å²	131.7	65%	0.649	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-109.7	-3.4	178.4	-63.8	176.8	0	0	0	114.1	E444	E444-L447 PolarHBondContact O-N 3.4Å
448	T	33.1	Very low	29.6	Very low	116 Å²	116	132.3 Å²	132.3	71%	0.712	76%	0.756	S	S	*	*	S	Bend	trans	-119.7	-0.1	-175.4	49.6	0	0	0	0	114.6
449	G	30.8	Very low	29.6	Very low	60 Å²	60	128.1 Å²	128.1	62%	0.619	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-70.2	133.3	177.1	0	0	0	0	0	113.5
450	P	36.3	Very low	29.9	Very low	126 Å²	126	129.2 Å²	129.2	82%	0.818	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-72.6	133.2	179.5	29.3	-34.3	0	0	0	112
451	C	29.5	Very low	30.1	Very low	113 Å²	113	126.4 Å²	126.4	76%	0.764	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-63.7	135.2	170.7	-74.2	0	0	0	0	110.9
452	P	34.1	Very low	30.1	Very low	127 Å²	127	122.3 Å²	122.3	83%	0.825	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-66.7	134.9	178.5	27.5	-34.3	0	0	0	111.2	S454	P452-S454 PolarHBondContact O-N 3.11Å
453	K	31.6	Very low	30.1	Very low	200 Å²	200	124 Å²	124	87%	0.87	77%	0.77	S	S	*	*			trans	-80.1	103.7	172.5	-66.9	179.7	-179.6	177.5	0	109.4	T455	K453-T455 PolarHBondContact O-N 2.97Å
454	S	33.6	Very low	30.1	Very low	121 Å²	121	125.4 Å²	125.4	85%	0.846	78%	0.776	S	S	*	*			trans	-72.9	119.7	169.6	53.6	0	0	0	0	110.7	P452	P452-S454 PolarHBondContact O-N 3.11Å
455	T	27.6	Very low	29.9	Very low	138 Å²	138	123.5 Å²	123.5	85%	0.847	78%	0.776	S	S	*	*			trans	-92.2	113.1	179.8	48.1	0	0	0	0	112.2	K453	K453-T455 PolarHBondContact O-N 2.97Å
456	A	30.5	Very low	30.1	Very low	87 Å²	87	124.7 Å²	124.7	72%	0.719	78%	0.779	S	S	*	*			trans	-160.5	101.9	163.9	0	0	0	0	0	106.4
457	S	32	Very low	30.3	Very low	99 Å²	99	122.4 Å²	122.4	69%	0.692	77%	0.767	S	S	*	*				72.4	92.4	86.3	71.4	0	0	0	0	113.4
458	D	30.1	Very low	30.3	Very low	166 Å²	166	121.2 Å²	121.2	89%	0.888	77%	0.767	S	S	*	*			trans	57	128	143.1	-46.8	-38.4	0	0	0	121.7
459	G	26.9	Very low	30.2	Very low	78 Å²	78	122.5 Å²	122.5	80%	0.804	77%	0.767	S	S	*	*				123.6	5.7	125.4	0	0	0	0	0	121
460	V	29	Very low	30.3	Very low	140 Å²	140	125.9 Å²	125.9	85%	0.848	76%	0.764	S	S	*	*			trans	-133	138.6	174.3	-173.1	0	0	0	0	112.9
461	T	27.2	Very low	30.2	Very low	141 Å²	141	125.3 Å²	125.3	87%	0.865	75%	0.751	S	S	*	*			trans	-83.6	150.4	-179.3	46.5	0	0	0	0	113.1
462	G	25.6	Very low	30.4	Very low	76 Å²	76	122.7 Å²	122.7	78%	0.784	73%	0.733	S	S	*	*			trans	102.4	56.6	165.1	0	0	0	0	0	117	S464	G462-S464 PolarHBondContact O-N 3.16Å
463	I	25.8	Very low	30.5	Very low	156 Å²	156	118.3 Å²	118.3	80%	0.8	71%	0.711	S	S	*	*			trans	-76.8	112.6	176.2	-61	177.6	0	0	0	111.3	V465	I463-V465 PolarHBondContact O-N 3.43Å
464	S	27.8	Very low	30.8	Very low	100 Å²	100	113.1 Å²	113.1	70%	0.699	69%	0.689	S	S	*	*			trans	-76.1	114.4	164.1	-177.7	0	0	0	0	110	G462 K466	G462-S464 PolarHBondContact O-N 3.16Å; S464-K466 VanDerWaalsContact C-N 3.35Å; S464-K466 PolarHBondContact O-N 2.75Å
465	V	27.3	Very low	31.1	Very low	133 Å²	133	110.8 Å²	110.8	81%	0.806	67%	0.667	S	S	*	*			trans	-78.4	80.8	-177.7	-173.1	0	0	0	0	110.8	I463 N467	I463-V465 PolarHBondContact O-N 3.43Å; V465-N467 PolarHBondContact O-N 3.48Å
466	K	33.9	Very low	31.6	Very low	181 Å²	181	110.5 Å²	110.5	79%	0.787	65%	0.65	S	S	*	*			trans	-70.3	122.7	163.7	-69.5	-176.2	178	179.7	0	109.1	S464 P468	S464-K466 VanDerWaalsContact C-N 3.35Å; S464-K466 PolarHBondContact O-N 2.75Å; K466-P468 WeakPolarHBondContact O-CD 3.3Å
467	N	32.4	Very low	31.9	Very low	89 Å²	89	111.7 Å²	111.7	48%	0.476	64%	0.644	S	S	.	*			trans	-65.7	109	-175.1	-174.4	-13.3	0	0	0	111.6	V465 M469	V465-N467 PolarHBondContact O-N 3.48Å; N467-M469 VanDerWaalsContact C-N 3.33Å; N467-M469 PolarHBondContact O-N 2.88Å
468	P	31.5	Very low	32.1	Very low	98 Å²	98	109.2 Å²	109.2	64%	0.636	63%	0.626	S	S	*	*	H	α-helix	trans	-69.7	-24.3	-167	-22.2	35.2	0	0	0	115	K466 F470 Q471 C472	K466-P468 WeakPolarHBondContact O-CD 3.3Å; P468-F470 PolarHBondContact O-N 3.24Å; P468-Q471 PolarHBondContact O-N 3.07Å; P468-C472 PolarHBondContact O-N 2.81Å
469	M	31.6	Very low	32.7	Very low	144 Å²	144	107.8 Å²	107.8	71%	0.709	61%	0.612	S	S	*	*	H	α-helix	trans	-63.5	-42.1	-175.5	-71.9	-170.3	-71.3	0	0	112.4	N467 C472 G473	N467-M469 VanDerWaalsContact C-N 3.33Å; N467-M469 PolarHBondContact O-N 2.88Å; M469-C472 PolarHBondContact O-N 2.94Å; M469-G473 PolarHBondContact O-N 2.86Å
470	F	32.3	Very low	33	Very low	130 Å²	130	109.3 Å²	109.3	57%	0.57	60%	0.601	S	S	*	*	H	α-helix	trans	-67.9	-37.6	-178.3	-87	-85.3	0	0	0	112.6	Y103 P468 G473 F474	Y103-F470 HydrophobicContact CE2-CZ 4.36Å; P468-F470 PolarHBondContact O-N 3.24Å; F470-G473 PolarHBondContact O-N 3.38Å; F470-F474 WeakPolarHBondContact O-CB 3.4Å; F470-F474 PolarHBondContact O-N 2.85Å
471	Q	33.3	Very low	33.4	Very low	115 Å²	115	106.8 Å²	106.8	54%	0.537	59%	0.586	S	S	.	*	H	α-helix	trans	-66	-45.8	176.6	-163.9	65.1	52.1	0	0	111	P468 G473 F474 D475	P468-Q471 PolarHBondContact O-N 3.07Å; Q471-G473 VanDerWaalsContact C-N 3.34Å; Q471-G473 PolarHBondContact O-N 3.1Å; Q471-F474 PolarHBondContact O-N 3.03Å; Q471-D475 PolarHBondContact NE2-OD1 3.01Å; Q471-D475 WeakPolarHBondContact O-CB 3.24Å; Q471-D475 PolarHBondContact O-N 3.09Å
472	C	34.3	Very low	34	Very low	58 Å²	58	105.4 Å²	105.4	39%	0.392	57%	0.57	S	S	.	*	H	α-helix	trans	-60.9	-41.2	177.1	-170.6	0	0	0	0	112.3	P468 M469 R476	P468-C472 PolarHBondContact O-N 2.81Å; M469-C472 PolarHBondContact O-N 2.94Å; C472-R476 WeakPolarHBondContact O-CB 3.44Å; C472-R476 VanDerWaalsContact O-CG 3.22Å; C472-R476 WeakPolarHBondContact O-CG 3.45Å; C472-R476 PolarHBondContact O-N 3.22Å; C472-R476 VanDerWaalsContact O-N 3.11Å
473	G	35.3	Very low	34.6	Very low	34 Å²	34	109.7 Å²	109.7	35%	0.351	57%	0.567	S	S	.	*	H	α-helix	trans	-64.5	-44.9	174.5	0	0	0	0	0	113.1	M469 F470 Q471 R476 L477	M469-G473 PolarHBondContact O-N 2.86Å; F470-G473 PolarHBondContact O-N 3.38Å; Q471-G473 VanDerWaalsContact C-N 3.34Å; Q471-G473 PolarHBondContact O-N 3.1Å; G473-R476 PolarHBondContact O-N 2.9Å; G473-L477 PolarHBondContact O-N 3.35Å
474	F	38.2	Very low	35.1	Very low	92 Å²	92	108.5 Å²	108.5	40%	0.404	57%	0.567	S	S	.	*	H	α-helix	trans	-67.4	-42.1	-179.2	-162.1	-82.9	0	0	0	112.2	F470 Q471 L477 S478 K555	F470-F474 WeakPolarHBondContact O-CB 3.4Å; F470-F474 PolarHBondContact O-N 2.85Å; Q471-F474 PolarHBondContact O-N 3.03Å; F474-L477 PolarHBondContact O-N 2.92Å; F474-S478 WeakPolarHBondContact O-CB 3.27Å; F474-S478 PolarHBondContact O-N 3.37Å; F474-K555 HydrophobicContact CZ-CD 4.22Å
475	D	39.6	Very low	35.7	Very low	72 Å²	72	110 Å²	110	39%	0.385	56%	0.563	S	S	.	*	H	α-helix	trans	-69.9	-33.1	178.8	-63.6	-14.9	0	0	0	111.7	Q471 K479	Q471-D475 PolarHBondContact NE2-OD1 3.01Å; Q471-D475 WeakPolarHBondContact O-CB 3.24Å; Q471-D475 PolarHBondContact O-N 3.09Å; D475-K479 WeakPolarHBondContact O-CG 3.46Å; D475-K479 PolarHBondContact O-N 3.11Å; D475-K479 VanDerWaalsContact O-N 3.13Å
476	R	38.5	Very low	35.8	Very low	131 Å²	131	113 Å²	113	49%	0.494	56%	0.56	S	S	.	*	H	α-helix	trans	-67.6	-41.6	171.1	-74.9	177.9	-175.3	-139.2	1.9	111.9	C472 G473 K479 L480	C472-R476 WeakPolarHBondContact O-CB 3.44Å; C472-R476 VanDerWaalsContact O-CG 3.22Å; C472-R476 WeakPolarHBondContact O-CG 3.45Å; C472-R476 PolarHBondContact O-N 3.22Å; C472-R476 VanDerWaalsContact O-N 3.11Å; G473-R476 PolarHBondContact O-N 2.9Å; R476-K479 PolarHBondContact O-N 2.79Å; R476-L480 PolarHBondContact O-N 2.9Å
477	L	36.4	Very low	35.5	Very low	113 Å²	113	110.3 Å²	110.3	59%	0.592	56%	0.56	S	S	*	*	H	α-helix	trans	-63.9	-42.4	173.7	-87	164.9	0	0	0	112.3	G473 F474 K479 L480 T481	G473-L477 PolarHBondContact O-N 3.35Å; F474-L477 PolarHBondContact O-N 2.92Å; L477-K479 VanDerWaalsContact C-N 3.31Å; L477-K479 PolarHBondContact O-N 3.38Å; L477-L480 WeakPolarHBondContact O-CB 3.04Å; L477-L480 PolarHBondContact O-N 3.19Å; L477-L480 VanDerWaalsContact O-N 3.13Å; L477-T481 PolarHBondContact O-N 3.41Å; L477-T481 PolarHBondContact O-OG1 3Å
478	S	38	Very low	35.7	Very low	47 Å²	47	114.4 Å²	114.4	33%	0.329	58%	0.577	S	S	.	*	H	α-helix	trans	-59.3	-43.1	176.4	-162.1	0	0	0	0	111.4	F474 L480 T481 E482	F474-S478 WeakPolarHBondContact O-CB 3.27Å; F474-S478 PolarHBondContact O-N 3.37Å; S478-L480 VanDerWaalsContact C-N 3.35Å; S478-L480 PolarHBondContact O-N 3.11Å; S478-T481 WeakPolarHBondContact CA-OG1 3.35Å; S478-T481 PolarHBondContact O-N 2.65Å; S478-T481 PolarHBondContact O-OG1 3.07Å; S478-E482 PolarHBondContact O-N 3.5Å
479	K	40.8	Very low	35.6	Very low	136 Å²	136	117.8 Å²	117.8	59%	0.591	58%	0.584	S	S	*	*	H	α-helix	trans	-67.5	-30	175.9	-73.7	172.9	-179.7	177.9	0	113.5	D475 R476 L477 K483	D475-K479 WeakPolarHBondContact O-CG 3.46Å; D475-K479 PolarHBondContact O-N 3.11Å; D475-K479 VanDerWaalsContact O-N 3.13Å; R476-K479 PolarHBondContact O-N 2.79Å; L477-K479 VanDerWaalsContact C-N 3.31Å; L477-K479 PolarHBondContact O-N 3.38Å; K479-K483 WeakPolarHBondContact O-CB 3.48Å; K479-K483 WeakPolarHBondContact O-CG 3.22Å; K479-K483 PolarHBondContact O-N 3.14Å
480	L	35.2	Very low	35.7	Very low	109 Å²	109	119.1 Å²	119.1	57%	0.571	59%	0.593	S	S	*	*	H	α-helix	trans	-67.1	-43.6	170.9	-80.4	165.1	0	0	0	111.2	R476 L477 S478 K483 V484	R476-L480 PolarHBondContact O-N 2.9Å; L477-L480 WeakPolarHBondContact O-CB 3.04Å; L477-L480 PolarHBondContact O-N 3.19Å; L477-L480 VanDerWaalsContact O-N 3.13Å; S478-L480 VanDerWaalsContact C-N 3.35Å; S478-L480 PolarHBondContact O-N 3.11Å; L480-K483 PolarHBondContact O-N 3.12Å; L480-V484 WeakPolarHBondContact O-CG2 3.35Å; L480-V484 PolarHBondContact O-N 2.64Å
481	T	36	Very low	35.5	Very low	87 Å²	87	124.2 Å²	124.2	53%	0.534	61%	0.609	S	S	.	*	H	α-helix	trans	-64.1	-41	174.7	41.7	0	0	0	0	112.8	L477 S478 K483 V484 E485	L477-T481 PolarHBondContact O-N 3.41Å; L477-T481 PolarHBondContact O-OG1 3Å; S478-T481 WeakPolarHBondContact CA-OG1 3.35Å; S478-T481 PolarHBondContact O-N 2.65Å; S478-T481 PolarHBondContact O-OG1 3.07Å; T481-K483 PolarHBondContact O-N 3.44Å; T481-V484 PolarHBondContact O-N 3.37Å; T481-E485 PolarHBondContact O-N 2.94Å
482	E	40.7	Very low	35.5	Very low	113 Å²	113	122.5 Å²	122.5	53%	0.528	62%	0.621	S	S	.	*	H	α-helix	trans	-64.8	-35.7	175.7	-72.4	-178	129.2	0	0	113.1	S478 V484 E485	S478-E482 PolarHBondContact O-N 3.5Å; E482-V484 VanDerWaalsContact C-N 3.31Å; E482-V484 PolarHBondContact O-N 3.03Å; E482-E485 PolarHBondContact O-N 2.73Å
483	K	38.5	Very low	35.4	Very low	166 Å²	166	126.4 Å²	126.4	72%	0.722	64%	0.644	S	S	*	*	H	α-helix	trans	-65.8	-32.1	175	-83	-171.4	172.6	-168.8	0	112.7	K479 L480 T481 E485	K479-K483 WeakPolarHBondContact O-CB 3.48Å; K479-K483 WeakPolarHBondContact O-CG 3.22Å; K479-K483 PolarHBondContact O-N 3.14Å; L480-K483 PolarHBondContact O-N 3.12Å; T481-K483 PolarHBondContact O-N 3.44Å; K483-E485 VanDerWaalsContact C-N 3.33Å
484	V	36.2	Very low	35.3	Very low	131 Å²	131	132 Å²	132	79%	0.794	67%	0.671	S	S	*	*	H	α-helix	trans	-74.5	-23.4	175.4	175.3	0	0	0	0	112	L480 T481 E482	L480-V484 WeakPolarHBondContact O-CG2 3.35Å; L480-V484 PolarHBondContact O-N 2.64Å; T481-V484 PolarHBondContact O-N 3.37Å; E482-V484 VanDerWaalsContact C-N 3.31Å; E482-V484 PolarHBondContact O-N 3.03Å
485	E	39.2	Very low	35.2	Very low	130 Å²	130	132.5 Å²	132.5	61%	0.607	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-2.9	177.6	-70.6	-168.5	142.8	0	0	114.8	T481 E482 K483	T481-E485 PolarHBondContact O-N 2.94Å; E482-E485 PolarHBondContact O-N 2.73Å; K483-E485 VanDerWaalsContact C-N 3.33Å
486	R	28.9	Very low	34.9	Very low	198 Å²	198	132.5 Å²	132.5	75%	0.747	71%	0.709	S	S	*	*			trans	-121.2	92.9	-178.5	-72	-165.4	-179.1	-162.9	2.8	114.8	Q488	R486-Q488 PolarHBondContact O-N 3.26Å; R486-Q488 VanDerWaalsContact O-N 3.1Å
487	P	28.8	Very low	34.7	Very low	123 Å²	123	136.2 Å²	136.2	80%	0.799	73%	0.728	S	S	*	*			trans	-73.2	97.2	164.9	30.3	-33	0	0	0	110.5
488	Q	37.2	Very low	34.5	Very low	176 Å²	176	134 Å²	134	82%	0.822	73%	0.733	S	S	*	*			trans	-75.1	124.4	170.4	-71.2	-168.9	-70.8	0	0	110.5	R486 L490	R486-Q488 PolarHBondContact O-N 3.26Å; R486-Q488 VanDerWaalsContact O-N 3.1Å; Q488-L490 PolarHBondContact O-N 3.27Å
489	Q	28.9	Very low	34.4	Very low	168 Å²	168	137.9 Å²	137.9	79%	0.785	76%	0.757	S	S	*	*			trans	-74.5	123.5	172.2	-65.5	-175.2	4.2	0	0	110.3
490	L	33.2	Very low	34.1	Very low	173 Å²	173	137 Å²	137	91%	0.906	77%	0.765	S	S	*	*			trans	-122.2	122.7	160.2	-80.1	167.5	0	0	0	108.2	Q488	Q488-L490 PolarHBondContact O-N 3.27Å
491	R	28.8	Very low	33.8	Very low	237 Å²	237	140.1 Å²	140.1	89%	0.894	78%	0.777	S	S	*	*			trans	-89	128.6	177.4	-63.4	-177.6	-179.2	-167.8	0.8	109
492	G	33.1	Very low	33.4	Very low	78 Å²	78	145.5 Å²	145.5	80%	0.804	79%	0.793	S	S	*	*			trans	-159.6	113.3	172.9	0	0	0	0	0	110.2
493	T	30.9	Very low	32.7	Very low	140 Å²	140	145.5 Å²	145.5	86%	0.859	80%	0.8	S	S	*	*			trans	-99.5	120	-168.7	46.6	0	0	0	0	113.3
494	V	34.1	Very low	32	Very low	152 Å²	152	148 Å²	148	92%	0.921	81%	0.805	S	S	*	*			trans	-142.3	144.6	143	-174.2	0	0	0	0	107.4
495	A	35.8	Very low	31.4	Very low	103 Å²	103	151 Å²	151	85%	0.851	81%	0.808	S	S	*	*			trans	-110.8	146.9	-173.4	0	0	0	0	0	112.9
496	G	33.6	Very low	30.6	Very low	71 Å²	71	149.6 Å²	149.6	73%	0.732	81%	0.808	S	S	*	*			trans	171	98.1	170.6	0	0	0	0	0	117.6
497	K	34.4	Very low	30.4	Very low	209 Å²	209	144.3 Å²	144.3	91%	0.909	80%	0.8	S	S	*	*	S	Bend	trans	55.6	102.6	154.1	-60.8	-179	179.1	178.8	0	119.3
498	G	33	Very low	30.1	Very low	66 Å²	66	143.8 Å²	143.8	68%	0.68	79%	0.794	S	S	*	*			trans	126.2	133.5	153.5	0	0	0	0	0	114.1
499	P	34.5	Very low	29.5	Very low	129 Å²	129	140.4 Å²	140.4	84%	0.838	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-74.3	129.5	173.3	30.3	-32.3	0	0	0	110.2
500	P	34.3	Very low	29.3	Very low	117 Å²	117	137.8 Å²	137.8	76%	0.76	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-71.7	136.5	174.5	29	-33.6	0	0	0	110.9	K502	P500-K502 PolarHBondContact O-N 3.49Å
501	E	29.6	Very low	28.9	Very low	176 Å²	176	134 Å²	134	82%	0.822	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-65.7	130.3	176.1	-172.4	170.9	-158	0	0	110.6	T503	E501-T503 VanDerWaalsContact C-N 3.31Å; E501-T503 PolarHBondContact O-N 3.42Å
502	K	28.5	Very low	28.8	Very low	200 Å²	200	125.4 Å²	125.4	87%	0.87	74%	0.736	S	S	*	*			trans	-80.2	74.9	-173.9	-70.3	-178.6	-179.7	173.8	0	111.6	P500 R504	P500-K502 PolarHBondContact O-N 3.49Å; K502-R504 PolarHBondContact O-N 3.13Å
503	T	25	Very low	28.5	Very low	112 Å²	112	126.1 Å²	126.1	69%	0.687	73%	0.726	S	S	*	*			trans	-60.7	92.9	171.4	38.4	0	0	0	0	111.2	E501 F505	E501-T503 VanDerWaalsContact C-N 3.31Å; E501-T503 PolarHBondContact O-N 3.42Å; T503-F505 PolarHBondContact O-N 3.43Å
504	R	23.3	Very low	28.5	Very low	218 Å²	218	130.9 Å²	130.9	82%	0.823	73%	0.729	S	S	*	*			trans	-78.4	87.5	-174.3	-156.3	-178.8	-159.3	177.9	7.1	110.1	K502 V506	K502-R504 PolarHBondContact O-N 3.13Å; R504-V506 PolarHBondContact O-N 3.4Å
505	F	23.7	Very low	28.4	Very low	195 Å²	195	129.9 Å²	129.9	86%	0.855	72%	0.716	S	S	*	*			trans	-57.4	109.4	172.1	-95.8	-91.9	0	0	0	110.7	T503	T503-F505 PolarHBondContact O-N 3.43Å
506	V	23.1	Very low	28.1	Very low	100 Å²	100	133.3 Å²	133.3	61%	0.606	71%	0.711	S	S	*	*			trans	-106.8	108	172.3	178.7	0	0	0	0	107.9	R504 T508	R504-V506 PolarHBondContact O-N 3.4Å; V506-T508 PolarHBondContact O-N 2.87Å
507	P	23.8	Very low	28.1	Very low	88 Å²	88	137 Å²	137	57%	0.571	71%	0.714	S	S	*	*			trans	-72.8	94.3	174.9	28.5	-32.9	0	0	0	109.7	V509	P507-V509 VanDerWaalsContact C-N 3.3Å; P507-V509 PolarHBondContact O-N 3.31Å
508	T	23.4	Very low	27.9	Very low	112 Å²	112	133.3 Å²	133.3	69%	0.687	71%	0.709	S	S	*	*			trans	-71.8	82.1	177.6	-54.9	0	0	0	0	110.5	V506 V510	V506-T508 PolarHBondContact O-N 2.87Å; T508-V510 HydrophobicContact CG2-CG2 4.01Å; T508-V510 PolarHBondContact O-N 2.98Å
509	V	24.4	Very low	27.7	Very low	104 Å²	104	138.5 Å²	138.5	63%	0.63	72%	0.716	S	S	*	*			trans	-71.9	98	170	-176.1	0	0	0	0	108.5	P507 I511	P507-V509 VanDerWaalsContact C-N 3.3Å; P507-V509 PolarHBondContact O-N 3.31Å; V509-I511 HydrophobicContact CG1-CG1 3.98Å; V509-I511 PolarHBondContact O-N 3.45Å
510	V	24.6	Very low	27.5	Very low	114 Å²	114	135.6 Å²	135.6	69%	0.691	71%	0.709	S	S	*	*			trans	-74.1	92	175.9	-176.9	0	0	0	0	109.2	T508 C512	T508-V510 HydrophobicContact CG2-CG2 4.01Å; T508-V510 PolarHBondContact O-N 2.98Å; V510-C512 PolarHBondContact O-N 3.11Å
511	I	25.9	Very low	27.1	Very low	93 Å²	93	138.2 Å²	138.2	48%	0.477	72%	0.716	S	S	.	*			trans	-79.8	105.2	170.7	-55.5	-179.9	0	0	0	107.9	V509 M515	V509-I511 HydrophobicContact CG1-CG1 3.98Å; V509-I511 PolarHBondContact O-N 3.45Å; I511-M515 HydrophobicContact CG2-CE 3.91Å
512	C	25	Very low	27.1	Very low	56 Å²	56	135.8 Å²	135.8	38%	0.378	72%	0.719	S	S	.	*			trans	-60.4	134.3	177.7	-74.2	0	0	0	0	111.7	V510 W514 M515	V510-C512 PolarHBondContact O-N 3.11Å; C512-W514 PolarHBondContact O-N 3.26Å; C512-M515 PolarHBondContact O-N 2.94Å
513	P	27.7	Very low	27.1	Very low	93 Å²	93	136 Å²	136	60%	0.604	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-57.8	-18.6	-176.8	-29.5	36.6	0	0	0	116.8	M515 K516	P513-M515 PolarHBondContact O-N 3.01Å; P513-M515 VanDerWaalsContact O-N 3.09Å; P513-K516 PolarHBondContact O-N 3.1Å; P513-K516 VanDerWaalsContact O-N 3.12Å
514	W	31.6	Very low	27.3	Very low	241 Å²	241	136 Å²	136	91%	0.913	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-59.9	-21.3	-177.8	-166.9	33.6	0	0	0	113.9	C512 K516	C512-W514 PolarHBondContact O-N 3.26Å; W514-K516 PolarHBondContact O-N 3.12Å
515	M	31	Very low	27.5	Very low	131 Å²	131	133.3 Å²	133.3	65%	0.645	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-67.6	1.5	173.6	-93.7	-179.7	-82.7	0	0	115.3	I511 C512 P513	I511-M515 HydrophobicContact CG2-CE 3.91Å; C512-M515 PolarHBondContact O-N 2.94Å; P513-M515 PolarHBondContact O-N 3.01Å; P513-M515 VanDerWaalsContact O-N 3.09Å
516	K	30.2	Very low	27.5	Very low	174 Å²	174	134.8 Å²	134.8	76%	0.757	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-81.2	-16.6	-180	-82.7	-166.6	168.9	-169.9	0	116.4	P513 W514	P513-K516 PolarHBondContact O-N 3.1Å; P513-K516 VanDerWaalsContact O-N 3.12Å; W514-K516 PolarHBondContact O-N 3.12Å
517	N	32.1	Very low	27.7	Very low	149 Å²	149	135.6 Å²	135.6	80%	0.797	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-90.2	9.9	-177.4	-87	20.4	0	0	0	115.4	Q519	N517-Q519 PolarHBondContact O-N 3.29Å
518	V	30.5	Very low	27.9	Very low	132 Å²	132	137.6 Å²	137.6	80%	0.8	75%	0.75	S	S	*	*			trans	-97.9	52.7	178.2	-161.8	0	0	0	0	111.6
519	Q	30	Very low	28.2	Very low	175 Å²	175	137.1 Å²	137.1	82%	0.818	76%	0.758	S	S	*	*			trans	-139.8	79.4	171.3	-70.8	-166.1	-79.6	0	0	110	N517	N517-Q519 PolarHBondContact O-N 3.29Å
520	G	28.8	Very low	28.3	Very low	67 Å²	67	143.5 Å²	143.5	69%	0.691	77%	0.77	S	S	*	*	S	Bend	trans	-173.7	32	-172.3	0	0	0	0	0	118
521	N	27.7	Very low	28.6	Very low	172 Å²	172	144.5 Å²	144.5	92%	0.92	77%	0.772	S	S	*	*			trans	-179.6	97.5	149.3	-97	-23.6	0	0	0	112.3
522	S	28.3	Very low	28.6	Very low	126 Å²	126	148.9 Å²	148.9	88%	0.881	79%	0.788	S	S	*	*			trans	-158.7	66.9	165.6	50.2	0	0	0	0	111.2
523	K	29.9	Very low	28.8	Very low	204 Å²	204	153 Å²	153	89%	0.887	81%	0.81	S	S	*	*			trans	-115.4	140.7	166.5	-81.3	-172.4	176.2	-178.6	0	109.7
524	S	27.8	Very low	28.7	Very low	111 Å²	111	152.2 Å²	152.2	78%	0.776	82%	0.82	S	S	*	*			trans	56.2	110.5	171	-157.9	0	0	0	0	117.4
525	L	27.6	Very low	28.5	Very low	163 Å²	163	147 Å²	147	85%	0.853	81%	0.814	S	S	*	*				-173.2	115.9	102.9	-96.9	167	0	0	0	109
526	Y	24.5	Very low	28.4	Very low	226 Å²	226	148.2 Å²	148.2	89%	0.886	82%	0.823	S	S	*	*			trans	-144	91.2	-179.6	-152.6	-74.1	0	0	0	109.7
527	S	26.2	Very low	28.1	Very low	117 Å²	117	145.1 Å²	145.1	82%	0.818	82%	0.822	S	S	*	*			trans	-159.7	122.2	167.3	-89.7	0	0	0	0	109.3
528	P	29.5	Very low	27.9	Very low	129 Å²	129	148.8 Å²	148.8	84%	0.838	83%	0.825	S	S	*	*			trans	-94.5	129.5	179.1	34.2	-30.7	0	0	0	112.1
529	A	29.7	Very low	27.9	Very low	103 Å²	103	150.2 Å²	150.2	85%	0.851	83%	0.828	S	S	*	*			trans	-130	141.1	161.2	0	0	0	0	0	109.1
530	R	26.2	Very low	27.9	Very low	237 Å²	237	146.7 Å²	146.7	89%	0.894	82%	0.823	S	S	*	*			trans	-89	140.5	173.7	-64.3	170.4	173.9	154.9	-4	108.1
531	D	30.4	Very low	28.4	Very low	136 Å²	136	147.5 Å²	147.5	73%	0.727	82%	0.818	S	S	*	*				-162.3	-178.8	95.3	-124	-49.2	0	0	0	113.3
532	K	27.1	Very low	28.9	Very low	185 Å²	185	142.8 Å²	142.8	80%	0.804	80%	0.798	S	S	*	*			trans	-89.1	144.3	-164.4	-52.7	142.3	-170.6	162.6	0	113.2
533	V	28.4	Very low	29.1	Very low	141 Å²	141	139.9 Å²	139.9	86%	0.855	78%	0.782	S	S	*	*				-176.2	139.3	125	142.2	0	0	0	0	111
534	G	26.1	Very low	29.3	Very low	78 Å²	78	132.9 Å²	132.9	80%	0.804	76%	0.762	S	S	*	*			trans	53.2	74.4	150.5	0	0	0	0	0	120.4
535	V	26.3	Very low	29.5	Very low	130 Å²	130	133.1 Å²	133.1	79%	0.788	75%	0.751	S	S	*	*			trans	-97.3	126.8	167.8	-170.2	0	0	0	0	111	C537	V535-C537 VanDerWaalsContact CG1-SG 3.56Å
536	N	28.5	Very low	30	Very low	157 Å²	157	130 Å²	130	84%	0.84	74%	0.739	S	S	*	*			trans	-111.8	87.7	176.4	-163.9	-2.6	0	0	0	110.3	R538	N536-R538 PolarHBondContact O-N 3.02Å
537	C	25.3	Very low	30.5	Very low	110 Å²	110	128 Å²	128	74%	0.743	73%	0.73	S	S	*	*			trans	-75	120.9	-169.3	-69.4	0	0	0	0	114	V535	V535-C537 VanDerWaalsContact CG1-SG 3.56Å
538	R	27.8	Very low	30.9	Very low	226 Å²	226	127.4 Å²	127.4	85%	0.853	72%	0.717	S	S	*	*			trans	-136.4	139.7	155.9	-76.5	-172	172	-179	-1.9	110.9	N536	N536-R538 PolarHBondContact O-N 3.02Å
539	N	29.4	Very low	31.4	Very low	161 Å²	161	128.5 Å²	128.5	86%	0.861	71%	0.708	S	S	*	*			trans	61.3	108.4	167.6	-56.2	-6.1	0	0	0	117.6
540	S	30.9	Very low	31.9	Very low	101 Å²	101	127.1 Å²	127.1	71%	0.706	69%	0.692	S	S	*	*			trans	-145.6	84.6	169.8	49.4	0	0	0	0	112.7
541	S	38.4	Very low	32.8	Very low	85 Å²	85	118.1 Å²	118.1	59%	0.594	66%	0.664	S	S	*	*			trans	-81.6	-39.5	170.2	51	0	0	0	0	112.9	A543 A544 E545	S541-A543 VanDerWaalsContact C-N 3.27Å; S541-A543 PolarHBondContact O-N 3.46Å; S541-A543 VanDerWaalsContact O-N 3.17Å; S541-A544 WeakPolarHBondContact O-CB 3.34Å; S541-A544 PolarHBondContact O-N 2.89Å; S541-E545 PolarHBondContact O-N 2.96Å
542	S	38.7	Very low	33.4	Very low	72 Å²	72	117.1 Å²	117.1	50%	0.503	65%	0.653	S	S	.	*	H	α-helix	trans	-57.8	-32.7	-172.3	54.8	0	0	0	0	114.6	A544 E545 T546	S542-A544 VanDerWaalsContact C-N 3.33Å; S542-A544 PolarHBondContact O-N 3.3Å; S542-E545 PolarHBondContact O-N 3.47Å; S542-T546 WeakPolarHBondContact O-CB 3.5Å; S542-T546 PolarHBondContact O-N 3.42Å; S542-T546 PolarHBondContact O-OG1 2.85Å
543	A	33.4	Very low	34.4	Very low	65 Å²	65	110.8 Å²	110.8	54%	0.537	63%	0.632	S	S	.	*	H	α-helix	trans	-64.2	-36.6	177.1	0	0	0	0	0	112.4	S541 W547	S541-A543 VanDerWaalsContact C-N 3.27Å; S541-A543 PolarHBondContact O-N 3.46Å; S541-A543 VanDerWaalsContact O-N 3.17Å; A543-W547 WeakPolarHBondContact O-CB 3.46Å; A543-W547 PolarHBondContact O-N 2.79Å
544	A	32.3	Very low	35.5	Very low	57 Å²	57	109.4 Å²	109.4	47%	0.471	62%	0.617	S	S	.	*	H	α-helix	trans	-72.4	-43.1	178.5	0	0	0	0	0	111.5	S541 S542 W547 I548	S541-A544 WeakPolarHBondContact O-CB 3.34Å; S541-A544 PolarHBondContact O-N 2.89Å; S542-A544 VanDerWaalsContact C-N 3.33Å; S542-A544 PolarHBondContact O-N 3.3Å; A544-W547 PolarHBondContact O-N 2.9Å; A544-I548 VanDerWaalsContact O-CG1 3.29Å; A544-I548 WeakPolarHBondContact O-CG1 3.35Å; A544-I548 PolarHBondContact O-N 3.21Å
545	E	33.5	Very low	36.5	Very low	117 Å²	117	110.3 Å²	110.3	55%	0.547	60%	0.598	S	S	.	*	H	α-helix	trans	-62.4	-45.4	178.1	-65.8	172.3	155.8	0	0	111.1	S541 S542 W547 I548 F549	S541-E545 PolarHBondContact O-N 2.96Å; S542-E545 PolarHBondContact O-N 3.47Å; E545-W547 VanDerWaalsContact C-N 3.33Å; E545-W547 PolarHBondContact O-N 2.84Å; E545-I548 PolarHBondContact O-N 2.87Å; E545-F549 WeakPolarHBondContact O-CD2 3.41Å; E545-F549 PolarHBondContact O-N 2.96Å
546	T	37.8	Very low	37.3	Very low	98 Å²	98	106.8 Å²	106.8	60%	0.601	58%	0.577	S	S	*	*	H	α-helix	trans	-59.7	-42	176.3	-53.8	0	0	0	0	111.7	S542 S550	S542-T546 WeakPolarHBondContact O-CB 3.5Å; S542-T546 PolarHBondContact O-N 3.42Å; S542-T546 PolarHBondContact O-OG1 2.85Å; T546-S550 VanDerWaalsContact O-CB 3.28Å; T546-S550 WeakPolarHBondContact O-CB 3.35Å; T546-S550 PolarHBondContact O-N 2.96Å
547	W	33.8	Very low	38.3	Very low	182 Å²	182	106.4 Å²	106.4	69%	0.689	56%	0.564	S	S	*	*	H	α-helix	trans	-68	-38.2	178.2	-166.9	78.4	0	0	0	112.8	A543 A544 E545 T551	A543-W547 WeakPolarHBondContact O-CB 3.46Å; A543-W547 PolarHBondContact O-N 2.79Å; A544-W547 PolarHBondContact O-N 2.9Å; E545-W547 VanDerWaalsContact C-N 3.33Å; E545-W547 PolarHBondContact O-N 2.84Å; W547-T551 WeakPolarHBondContact O-CB 3.32Å; W547-T551 PolarHBondContact O-N 3.27Å; W547-T551 PolarHBondContact O-OG1 2.78Å
548	I	36.1	Very low	39.4	Very low	106 Å²	106	106.1 Å²	106.1	54%	0.544	55%	0.551	S	S	.	*	H	α-helix	trans	-64.3	-49.2	175.2	-69.4	164.1	0	0	0	110.5	A544 E545 S550 T551 F552	A544-I548 VanDerWaalsContact O-CG1 3.29Å; A544-I548 WeakPolarHBondContact O-CG1 3.35Å; A544-I548 PolarHBondContact O-N 3.21Å; E545-I548 PolarHBondContact O-N 2.87Å; I548-S550 PolarHBondContact O-N 2.99Å; I548-T551 PolarHBondContact O-N 2.89Å; I548-F552 WeakPolarHBondContact O-CB 3.49Å; I548-F552 PolarHBondContact O-N 2.78Å
549	F	38.4	Very low	40.1	Very low	151 Å²	151	100.1 Å²	100.1	66%	0.662	54%	0.535	S	S	*	.	H	α-helix	trans	-62.5	-41.5	177.8	-91.8	-80.3	0	0	0	112.6	E545 S553	E545-F549 WeakPolarHBondContact O-CD2 3.41Å; E545-F549 PolarHBondContact O-N 2.96Å; F549-S553 VanDerWaalsContact O-CB 3.24Å; F549-S553 WeakPolarHBondContact O-CB 3.42Å; F549-S553 PolarHBondContact O-N 3.45Å
550	S	41.3	Very low	40.6	Very low	74 Å²	74	97.6 Å²	97.6	52%	0.517	52%	0.519	S	S	.	.	H	α-helix	trans	-58.2	-50.5	173.7	179.7	0	0	0	0	111.6	T546 I548 F552 S553 H554	T546-S550 VanDerWaalsContact O-CB 3.28Å; T546-S550 WeakPolarHBondContact O-CB 3.35Å; T546-S550 PolarHBondContact O-N 2.96Å; I548-S550 PolarHBondContact O-N 2.99Å; S550-F552 PolarHBondContact O-N 3.01Å; S550-S553 PolarHBondContact O-N 2.96Å; S550-H554 WeakPolarHBondContact O-CB 3.28Å; S550-H554 PolarHBondContact O-N 3.36Å
551	T	46	Very low	41.4	Very low	48 Å²	48	99.5 Å²	99.5	29%	0.294	52%	0.517	S	S	.	.	H	α-helix	trans	-66.4	-38.9	-177.8	-53.9	0	0	0	0	112.2	W547 I548 K555	W547-T551 WeakPolarHBondContact O-CB 3.32Å; W547-T551 PolarHBondContact O-N 3.27Å; W547-T551 PolarHBondContact O-OG1 2.78Å; I548-T551 PolarHBondContact O-N 2.89Å; T551-K555 PolarHBondContact O-N 2.96Å
552	F	42.4	Very low	41.6	Very low	115 Å²	115	101.4 Å²	101.4	50%	0.504	51%	0.514	S	S	.	.	H	α-helix	trans	-64.2	-51.3	174.5	-179.5	-100.3	0	0	0	111.4	I548 S550 H554 K555 V556	I548-F552 WeakPolarHBondContact O-CB 3.49Å; I548-F552 PolarHBondContact O-N 2.78Å; S550-F552 PolarHBondContact O-N 3.01Å; F552-H554 VanDerWaalsContact C-N 3.3Å; F552-H554 PolarHBondContact O-N 3.24Å; F552-K555 PolarHBondContact O-N 2.9Å; F552-V556 HydrophobicContact CD1-CG2 4.26Å; F552-V556 HydrophobicContact CD2-CG2 4.49Å; F552-V556 HydrophobicContact CE1-CG2 3.91Å; F552-V556 HydrophobicContact CE2-CG2 4.16Å; F552-V556 HydrophobicContact CZ-CG2 3.86Å; F552-V556 WeakPolarHBondContact O-CG2 3.47Å; F552-V556 PolarHBondContact O-N 3.47Å
553	S	48.1	Very low	41.7	Very low	52 Å²	52	105 Å²	105	36%	0.364	52%	0.517	S	S	.	.	H	α-helix	trans	-58	-41.9	177.6	-171.6	0	0	0	0	111.7	F549 S550 V556 R557	F549-S553 VanDerWaalsContact O-CB 3.24Å; F549-S553 WeakPolarHBondContact O-CB 3.42Å; F549-S553 PolarHBondContact O-N 3.45Å; S550-S553 PolarHBondContact O-N 2.96Å; S553-V556 PolarHBondContact O-N 3.01Å; S553-R557 WeakPolarHBondContact O-CB 3.11Å; S553-R557 VanDerWaalsContact O-CG 3.3Å; S553-R557 WeakPolarHBondContact O-CG 3.13Å; S553-R557 PolarHBondContact O-N 3.44Å
554	H	51.9	Low	42.1	Very low	113 Å²	113	105.9 Å²	105.9	52%	0.523	52%	0.524	S	S	.	.	H	α-helix	trans	-66.4	-42.3	177.4	-162	-93.4	0	0	0	112.9	S550 F552 R557 Q558	S550-H554 WeakPolarHBondContact O-CB 3.28Å; S550-H554 PolarHBondContact O-N 3.36Å; F552-H554 VanDerWaalsContact C-N 3.3Å; F552-H554 PolarHBondContact O-N 3.24Å; H554-R557 PolarHBondContact O-N 3.44Å; H554-Q558 PolarHBondContact O-N 3.45Å
555	K	46	Very low	42.5	Very low	96 Å²	96	107.3 Å²	107.3	42%	0.417	53%	0.531	S	S	.	.	H	α-helix	trans	-67.9	-39.4	175.3	-80.2	-172.8	173.8	-176.6	0	112.6	F474 T551 F552 Q558 I559	F474-K555 HydrophobicContact CZ-CD 4.22Å; T551-K555 PolarHBondContact O-N 2.96Å; F552-K555 PolarHBondContact O-N 2.9Å; K555-Q558 PolarHBondContact O-N 3.4Å; K555-I559 WeakPolarHBondContact O-CG1 3.43Å; K555-I559 PolarHBondContact O-N 2.76Å
556	V	44.3	Very low	42.3	Very low	56 Å²	56	110.5 Å²	110.5	34%	0.339	54%	0.538	S	S	.	.	H	α-helix	trans	-62.4	-43.7	173.2	172.8	0	0	0	0	110.7	F552 S553 Q558 I559 M560	F552-V556 HydrophobicContact CD1-CG2 4.26Å; F552-V556 HydrophobicContact CD2-CG2 4.49Å; F552-V556 HydrophobicContact CE1-CG2 3.91Å; F552-V556 HydrophobicContact CE2-CG2 4.16Å; F552-V556 HydrophobicContact CZ-CG2 3.86Å; F552-V556 WeakPolarHBondContact O-CG2 3.47Å; F552-V556 PolarHBondContact O-N 3.47Å; S553-V556 PolarHBondContact O-N 3.01Å; V556-Q558 PolarHBondContact O-N 3.2Å; V556-I559 PolarHBondContact O-N 3.24Å; V556-M560 HydrophobicContact CG1-CG 4.38Å; V556-M560 WeakPolarHBondContact O-CB 3.48Å; V556-M560 WeakPolarHBondContact O-CG 3.17Å; V556-M560 PolarHBondContact O-N 2.99Å
557	R	48.5	Very low	41.8	Very low	150 Å²	150	110.5 Å²	110.5	57%	0.566	54%	0.54	S	S	*	.	H	α-helix	trans	-59.6	-42.6	172.6	-74.3	179.1	-168.3	-167.8	3.2	112.3	S553 H554 M560 H561	S553-R557 WeakPolarHBondContact O-CB 3.11Å; S553-R557 VanDerWaalsContact O-CG 3.3Å; S553-R557 WeakPolarHBondContact O-CG 3.13Å; S553-R557 PolarHBondContact O-N 3.44Å; H554-R557 PolarHBondContact O-N 3.44Å; R557-M560 PolarHBondContact O-N 2.84Å; R557-H561 WeakPolarHBondContact O-CB 3.29Å; R557-H561 PolarHBondContact O-CD2 3.39Å; R557-H561 PolarHBondContact O-N 3.12Å
558	Q	47.8	Very low	41.4	Very low	104 Å²	104	114 Å²	114	49%	0.486	55%	0.553	S	S	.	*	H	α-helix	trans	-66	-36.7	176.4	-77.6	-165.4	-14.8	0	0	113.2	H554 K555 V556 H561 K562	H554-Q558 PolarHBondContact O-N 3.45Å; K555-Q558 PolarHBondContact O-N 3.4Å; V556-Q558 PolarHBondContact O-N 3.2Å; Q558-H561 PolarHBondContact O-N 3.18Å; Q558-K562 WeakPolarHBondContact O-CB 3.46Å; Q558-K562 WeakPolarHBondContact O-CG 3.38Å; Q558-K562 PolarHBondContact O-N 3.3Å
559	I	43.2	Very low	41	Very low	99 Å²	99	114 Å²	114	51%	0.508	56%	0.558	S	S	.	*	H	α-helix	trans	-65.6	-41.3	173.5	-68.1	163.8	0	0	0	110.7	K555 V556 K562 R563	K555-I559 WeakPolarHBondContact O-CG1 3.43Å; K555-I559 PolarHBondContact O-N 2.76Å; V556-I559 PolarHBondContact O-N 3.24Å; I559-K562 PolarHBondContact O-N 3.01Å; I559-R563 PolarHBondContact O-N 2.74Å
560	M	39.3	Very low	40.4	Very low	108 Å²	108	114.2 Å²	114.2	53%	0.532	57%	0.565	S	S	.	*	H	α-helix	trans	-64.7	-44.5	175.9	-66.7	-79.4	-102.6	0	0	111.8	V556 R557 R563 A564	V556-M560 HydrophobicContact CG1-CG 4.38Å; V556-M560 WeakPolarHBondContact O-CB 3.48Å; V556-M560 WeakPolarHBondContact O-CG 3.17Å; V556-M560 PolarHBondContact O-N 2.99Å; R557-M560 PolarHBondContact O-N 2.84Å; M560-R563 PolarHBondContact O-N 3.3Å; M560-A564 PolarHBondContact O-N 3.48Å
561	H	47.5	Very low	39.7	Very low	142 Å²	142	115.1 Å²	115.1	66%	0.657	57%	0.571	S	S	*	*	H	α-helix	trans	-65.2	-42.3	174.6	-90.9	-88.7	0	0	0	112.6	R557 Q558 R563 A564 S565	R557-H561 WeakPolarHBondContact O-CB 3.29Å; R557-H561 PolarHBondContact O-CD2 3.39Å; R557-H561 PolarHBondContact O-N 3.12Å; Q558-H561 PolarHBondContact O-N 3.18Å; H561-R563 VanDerWaalsContact C-N 3.3Å; H561-R563 PolarHBondContact O-N 3.27Å; H561-A564 CarbonylContact O-C 3.49Å; H561-A564 WeakPolarHBondContact O-CA 3.14Å; H561-A564 WeakPolarHBondContact O-CB 3.49Å; H561-A564 PolarHBondContact O-N 3.02Å; H561-S565 PolarHBondContact O-N 3.46Å; H561-S565 PolarHBondContact O-OG 3.17Å
562	K	44.1	Very low	38.5	Very low	124 Å²	124	118.9 Å²	118.9	54%	0.539	60%	0.598	S	S	.	*	H	α-helix	trans	-60.8	-37.7	174.2	-81	-174.9	171.7	-169.7	0	112.1	Q558 I559 S565 W566	Q558-K562 WeakPolarHBondContact O-CB 3.46Å; Q558-K562 WeakPolarHBondContact O-CG 3.38Å; Q558-K562 PolarHBondContact O-N 3.3Å; I559-K562 PolarHBondContact O-N 3.01Å; K562-S565 PolarHBondContact O-N 3.42Å; K562-S565 PolarHBondContact O-OG 3.48Å; K562-S565 VanDerWaalsContact O-OG 3.11Å; K562-W566 PolarHBondContact O-N 3.33Å
563	R	41.1	Very low	37.8	Very low	148 Å²	148	120.1 Å²	120.1	56%	0.558	62%	0.615	S	S	*	*	H	α-helix	trans	-68.6	-32.9	171.8	-85.7	-176	164.9	-179	-3.8	113.1	I559 M560 H561 S565	I559-R563 PolarHBondContact O-N 2.74Å; M560-R563 PolarHBondContact O-N 3.3Å; H561-R563 VanDerWaalsContact C-N 3.3Å; H561-R563 PolarHBondContact O-N 3.27Å; R563-S565 VanDerWaalsContact C-N 3.33Å
564	A	41.8	Very low	36.7	Very low	83 Å²	83	122.1 Å²	122.1	69%	0.686	63%	0.627	S	S	*	*	H	α-helix	trans	-70.1	-29.2	173.8	0	0	0	0	0	112.6	M560 H561	M560-A564 PolarHBondContact O-N 3.48Å; H561-A564 CarbonylContact O-C 3.49Å; H561-A564 WeakPolarHBondContact O-CA 3.14Å; H561-A564 WeakPolarHBondContact O-CB 3.49Å; H561-A564 PolarHBondContact O-N 3.02Å
565	S	39.7	Very low	35.5	Very low	88 Å²	88	125.7 Å²	125.7	62%	0.615	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	11.8	177.6	71.8	0	0	0	0	114.7	H561 K562 R563	H561-S565 PolarHBondContact O-N 3.46Å; H561-S565 PolarHBondContact O-OG 3.17Å; K562-S565 PolarHBondContact O-N 3.42Å; K562-S565 PolarHBondContact O-OG 3.48Å; K562-S565 VanDerWaalsContact O-OG 3.11Å; R563-S565 VanDerWaalsContact C-N 3.33Å
566	W	28.9	Very low	34.6	Very low	183 Å²	183	129.7 Å²	129.7	69%	0.693	66%	0.661	S	S	*	*	S	Bend	trans	-74.7	127	172.2	-86.8	21.8	0	0	0	110.4	K562 R568	K562-W566 PolarHBondContact O-N 3.33Å; W566-R568 PolarHBondContact O-N 2.94Å
567	P	27.7	Very low	33.8	Very low	98 Å²	98	132.6 Å²	132.6	64%	0.636	68%	0.679	S	S	*	*			trans	-64.8	131.9	177	27.7	-34.2	0	0	0	110.3	T569	P567-T569 HydrophobicContact CB-CG2 4.12Å; P567-T569 PolarHBondContact O-N 3.48Å; P567-T569 PolarHBondContact O-OG1 3.22Å
568	R	25.6	Very low	32.7	Very low	255 Å²	255	130.6 Å²	130.6	96%	0.962	69%	0.688	S	S	*	*			trans	-78.9	61.4	176.6	-67.5	-171.4	-178.5	-178.7	4.6	111.4	W566 L570	W566-R568 PolarHBondContact O-N 2.94Å; R568-L570 PolarHBondContact O-N 3.46Å
569	T	27	Very low	31.9	Very low	106 Å²	106	135.3 Å²	135.3	65%	0.65	71%	0.707	S	S	*	*			trans	-99.1	76.7	-176.1	45.2	0	0	0	0	112.6	P567	P567-T569 HydrophobicContact CB-CG2 4.12Å; P567-T569 PolarHBondContact O-N 3.48Å; P567-T569 PolarHBondContact O-OG1 3.22Å
570	L	26	Very low	31.1	Very low	157 Å²	157	136 Å²	136	82%	0.822	72%	0.721	S	S	*	*			trans	-156.1	68.5	155.4	-85.7	-176.8	0	0	0	105.3	R568	R568-L570 PolarHBondContact O-N 3.46Å
571	S	26.7	Very low	30.6	Very low	92 Å²	92	135.5 Å²	135.5	64%	0.643	73%	0.733	S	S	*	*				60.3	100.6	60.2	86.4	0	0	0	0	112.4
572	C	22.3	Very low	29.8	Very low	127 Å²	127	133.9 Å²	133.9	86%	0.858	75%	0.745	S	S	*	*			trans	-72.3	152.1	-178.7	-49.8	0	0	0	0	112.2
573	V	25.9	Very low	29.1	Very low	141 Å²	141	131.6 Å²	131.6	86%	0.855	76%	0.756	S	S	*	*			trans	-134.8	130.9	155.7	-176.7	0	0	0	0	106.8
574	P	25.5	Very low	28.5	Very low	94 Å²	94	133 Å²	133	61%	0.61	77%	0.774	S	S	*	*			trans	-114	160.5	-167.1	40.7	-33.2	0	0	0	115.1	F576	P574-F576 HydrophobicContact CG-CD2 4.43Å; P574-F576 HydrophobicContact CG-CE2 4.47Å
575	E	26	Very low	28.1	Very low	189 Å²	189	133.8 Å²	133.8	88%	0.883	78%	0.775	S	S	*	*			trans	-123.9	130.1	142.5	-66.7	-177.1	116.8	0	0	105.5
576	F	27.6	Very low	27.8	Very low	179 Å²	179	133.6 Å²	133.6	79%	0.785	77%	0.773	S	S	*	*				59.3	123.6	55.5	-76.2	-105.3	0	0	0	112.5	P574	P574-F576 HydrophobicContact CG-CD2 4.43Å; P574-F576 HydrophobicContact CG-CE2 4.47Å
577	V	28.5	Very low	28.1	Very low	117 Å²	117	132 Å²	132	71%	0.709	78%	0.778	S	S	*	*			cis	-149.5	156.2	-5.9	93	0	0	0	0	110.5
578	S	25.1	Very low	28.3	Very low	108 Å²	108	131.1 Å²	131.1	76%	0.755	77%	0.774	S	S	*	*			trans	-76.5	138.7	173.2	47.8	0	0	0	0	111.8
579	K	29.6	Very low	28.7	Very low	203 Å²	203	126.9 Å²	126.9	88%	0.883	77%	0.766	S	S	*	*			trans	-150.9	144.5	154.7	-115.9	169.3	-173.4	179	0	111.1
580	S	27.9	Very low	28.6	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	78%	0.776	S	S	*	*			trans	-98.9	161.7	-167	-52	0	0	0	0	112.9
581	A	28.5	Very low	28.9	Very low	97 Å²	97	129.2 Å²	129.2	80%	0.802	78%	0.776	S	S	*	*			trans	77.8	137.7	147.6	0	0	0	0	0	120.3
582	A	30.7	Very low	28.9	Very low	109 Å²	109	133.3 Å²	133.3	90%	0.901	79%	0.785	S	S	*	*			trans	63.1	132.1	148.9	0	0	0	0	0	120
583	G	29.2	Very low	29.5	Very low	75 Å²	75	132.3 Å²	132.3	77%	0.773	78%	0.777	S	S	*	*			trans	138.3	99	152.7	0	0	0	0	0	116.3
584	L	29	Very low	29.7	Very low	177 Å²	177	137.1 Å²	137.1	93%	0.927	78%	0.78	S	S	*	*			trans	-17.7	146.4	139.1	-52.3	163.9	0	0	0	113.7
585	S	32	Very low	29.9	Very low	101 Å²	101	136.1 Å²	136.1	71%	0.706	79%	0.786	S	S	*	*				-172.8	165.8	50	-178.9	0	0	0	0	112.2
586	S	35	Very low	30.2	Very low	84 Å²	84	135.3 Å²	135.3	59%	0.587	79%	0.787	S	S	*	*			trans	46.6	107.9	147.1	55.7	0	0	0	0	118.7
587	D	33.3	Very low	30.4	Very low	148 Å²	148	132.2 Å²	132.2	79%	0.791	79%	0.785	S	S	*	*				106.6	150.3	84.2	-89.4	-61.4	0	0	0	111.1
588	S	32.6	Very low	30.4	Very low	80 Å²	80	132.3 Å²	132.3	56%	0.559	79%	0.79	S	S	*	*			cis	-153.4	167	-3.3	-135.5	0	0	0	0	112
589	Q	33.9	Very low	30.6	Very low	167 Å²	167	134 Å²	134	78%	0.78	80%	0.796	S	S	*	*			trans	50.6	107.1	152.2	-67	172.5	26.8	0	0	119.3
590	M	25.3	Very low	30.7	Very low	175 Å²	175	129.4 Å²	129.4	86%	0.862	79%	0.79	S	S	*	*				77.4	115.3	82	-79.4	-177.9	64.4	0	0	116.2
591	V	31.2	Very low	30.8	Very low	136 Å²	136	133.2 Å²	133.2	82%	0.824	79%	0.792	S	S	*	*				-175.3	141.9	120.2	146.7	0	0	0	0	109.3
592	Q	28.2	Very low	30.9	Very low	179 Å²	179	133.1 Å²	133.1	84%	0.836	79%	0.785	S	S	*	*			trans	-134	157.3	160.1	-75.4	-161.4	-0.1	0	0	108.7
593	P	34.5	Very low	30.7	Very low	105 Å²	105	135.3 Å²	135.3	68%	0.682	78%	0.782	S	S	*	*				-148.5	141.6	109.5	34.5	-17.5	0	0	0	117
594	R	29.4	Very low	30.6	Very low	243 Å²	243	139.6 Å²	139.6	92%	0.917	78%	0.782	S	S	*	*			trans	53.1	123.8	135.1	-55.8	174.8	-170.4	-168.5	2.7	120.7
595	G	31	Very low	30.5	Very low	72 Å²	72	139.2 Å²	139.2	74%	0.742	78%	0.777	S	S	*	*				136.9	97.3	127.7	0	0	0	0	0	117.9
596	L	30.8	Very low	30.1	Very low	172 Å²	172	141.3 Å²	141.3	90%	0.901	78%	0.78	S	S	*	*			trans	176.4	158.4	138.8	-93.8	162.9	0	0	0	108.9
597	P	32.2	Very low	29.6	Very low	114 Å²	114	144.5 Å²	144.5	74%	0.74	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-85.2	173.1	-164.6	33.9	-36.7	0	0	0	115.6
598	S	29.1	Very low	29.2	Very low	119 Å²	119	142.9 Å²	142.9	83%	0.832	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-71.7	135.4	-167.9	54.1	0	0	0	0	116.2
599	V	29.8	Very low	28.8	Very low	143 Å²	143	150.1 Å²	150.1	87%	0.867	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-94.6	127.6	158.5	178	0	0	0	0	109.2
600	S	31.9	Very low	28.6	Very low	108 Å²	108	149 Å²	149	76%	0.755	81%	0.807	S	S	*	*			trans	-90.1	109.4	-178	57.5	0	0	0	0	112.8
601	K	28.7	Very low	28.7	Very low	193 Å²	193	150.2 Å²	150.2	84%	0.839	80%	0.802	S	S	*	*			trans	24.6	108	156.7	-64.2	-176.5	178.2	-178.2	0	117.9
602	S	30.1	Very low	28.7	Very low	95 Å²	95	150.6 Å²	150.6	66%	0.664	80%	0.799	S	S	*	*			trans	-82.8	120.2	156.7	52.3	0	0	0	0	110.9	H604	S602-H604 PolarHBondContact O-N 3.31Å
603	D	27.3	Very low	28.8	Very low	156 Å²	156	147.8 Å²	147.8	83%	0.834	79%	0.79	S	S	*	*			trans	-73.5	111.7	177.9	-76.3	-38.5	0	0	0	112.2	M605	D603-M605 PolarHBondContact O-N 3.46Å
604	H	28	Very low	28.6	Very low	165 Å²	165	153.2 Å²	153.2	76%	0.764	80%	0.797	S	S	*	*			trans	-79.5	89.9	170.9	-70.2	-86.4	0	0	0	110.7	S602 L606	S602-H604 PolarHBondContact O-N 3.31Å; H604-L606 PolarHBondContact O-N 3.21Å
605	M	25.2	Very low	28.6	Very low	169 Å²	169	149.5 Å²	149.5	83%	0.833	79%	0.79	S	S	*	*			trans	-75.9	110.1	173.9	-172.9	166	62.8	0	0	111.4	D603	D603-M605 PolarHBondContact O-N 3.46Å
606	L	24.2	Very low	28.4	Very low	145 Å²	145	153.1 Å²	153.1	76%	0.759	79%	0.791	S	S	*	*			trans	-63.5	134.8	170.8	-78.6	78.5	0	0	0	110.5	H604	H604-L606 PolarHBondContact O-N 3.21Å
607	I	25.8	Very low	28.4	Very low	151 Å²	151	150.9 Å²	150.9	77%	0.774	79%	0.785	S	S	*	*			trans	-94.9	94.9	165.7	-59.2	178.6	0	0	0	108.1	R609	I607-R609 PolarHBondContact O-N 3.2Å
608	C	24.1	Very low	28	Very low	113 Å²	113	153.8 Å²	153.8	76%	0.764	79%	0.793	S	S	*	*			trans	-64.3	129.6	168.9	-65	0	0	0	0	110
609	R	24.4	Very low	28.2	Very low	232 Å²	232	153.6 Å²	153.6	88%	0.875	79%	0.792	S	S	*	*			trans	-115.9	108.4	164.7	-88.4	-176.3	165	140.6	-3.1	108.6	I607	I607-R609 PolarHBondContact O-N 3.2Å
610	T	29.9	Very low	28	Very low	143 Å²	143	150.3 Å²	150.3	88%	0.877	79%	0.787	S	S	*	*			trans	-68.3	154.6	158.2	45.7	0	0	0	0	109.5
611	R	26.2	Very low	28	Very low	202 Å²	202	153.4 Å²	153.4	76%	0.762	80%	0.795	S	S	*	*			trans	-151.8	109.6	-174.8	173.2	-159	173.5	-179.7	-3.2	107.9	D613	R611-D613 IonicContact NE-OD2 3.73Å; R611-D613 IonicContact NH2-OD2 3.98Å
612	D	32.1	Very low	28.1	Very low	143 Å²	143	150.7 Å²	150.7	77%	0.765	79%	0.794	S	S	*	*			trans	-137.2	129.6	164.9	-91.2	-69.7	0	0	0	110.5	R614	D612-R614 IonicContact OD1-NH2 3.88Å
613	D	29.4	Very low	28.2	Very low	120 Å²	120	155.5 Å²	155.5	64%	0.642	81%	0.806	S	S	*	*			trans	-102.5	133.8	173.7	-61	-76	0	0	0	108.3	R611	R611-D613 IonicContact NE-OD2 3.73Å; R611-D613 IonicContact NH2-OD2 3.98Å
614	R	31.8	Very low	28.4	Very low	220 Å²	220	151.5 Å²	151.5	83%	0.83	80%	0.802	S	S	*	*			trans	177.4	113.8	166.1	-104.7	160.8	-94.7	-149.6	4.9	107.3	D612	D612-R614 IonicContact OD1-NH2 3.88Å
615	H	29.6	Very low	28.5	Very low	165 Å²	165	152.5 Å²	152.5	76%	0.764	81%	0.807	S	S	*	*			cis	79.8	121	31.4	-127.5	-66.1	0	0	0	114
616	L	26.5	Very low	28.9	Very low	147 Å²	147	150 Å²	150	77%	0.77	80%	0.803	S	S	*	*			trans	72.1	154.4	172.8	-47.2	174.2	0	0	0	115.3
617	T	29.5	Very low	29.4	Very low	125 Å²	125	149.3 Å²	149.3	77%	0.767	81%	0.81	S	S	*	*			cis	-147.6	163.1	3.2	-21.4	0	0	0	0	111.4
618	L	25	Very low	29.7	Very low	175 Å²	175	145 Å²	145	92%	0.916	80%	0.804	S	S	*	*			trans	-85.9	130.6	161.9	-83	163.5	0	0	0	110.5
619	S	32.2	Very low	30	Very low	116 Å²	116	149.6 Å²	149.6	81%	0.811	81%	0.806	S	S	*	*			trans	-159	116	160.3	55.4	0	0	0	0	108.7
620	G	26.9	Very low	30.3	Very low	74 Å²	74	145.2 Å²	145.2	76%	0.763	79%	0.794	S	S	*	*			trans	-93.7	161.3	169.6	0	0	0	0	0	111.1
621	N	30.5	Very low	30.6	Very low	172 Å²	172	145 Å²	145	92%	0.92	79%	0.787	S	S	*	*			trans	-139	157.8	149.9	-103	-9.2	0	0	0	108.2
622	V	31.4	Very low	30.8	Very low	136 Å²	136	140.4 Å²	140.4	82%	0.824	79%	0.785	S	S	*	*			trans	-103.4	-177.6	-177.3	177.9	0	0	0	0	108.4
623	E	32.5	Very low	30.8	Very low	196 Å²	196	139.1 Å²	139.1	92%	0.916	79%	0.786	S	S	*	*			trans	82.7	135.4	-175.1	-52.6	168.2	-158.5	0	0	113.5
624	G	31.7	Very low	30.8	Very low	72 Å²	72	138.2 Å²	138.2	74%	0.742	79%	0.789	S	S	*	*			cis	179.7	159.6	-7	0	0	0	0	0	112.8
625	E	29	Very low	30.8	Very low	187 Å²	187	132.8 Å²	132.8	87%	0.874	78%	0.783	S	S	*	*			trans	59.2	130.2	170.1	-71.6	-59.9	100.3	0	0	121.3
626	P	34.5	Very low	30.9	Very low	115 Å²	115	131.6 Å²	131.6	75%	0.747	78%	0.782	S	S	*	*			trans	-111.8	129.7	175.2	38	-28.2	0	0	0	115
627	S	34.1	Very low	31.1	Very low	131 Å²	131	133 Å²	133	92%	0.916	79%	0.785	S	S	*	*			trans	-162	155.8	158.2	58.9	0	0	0	0	109.8
628	G	32.1	Very low	31.3	Very low	62 Å²	62	132.7 Å²	132.7	64%	0.639	79%	0.785	S	S	*	*			cis	170.6	166.3	-6.5	0	0	0	0	0	110.1
629	Y	30.7	Very low	31.6	Very low	208 Å²	208	133.1 Å²	133.1	82%	0.816	78%	0.782	S	S	*	*			trans	65.9	151	176.5	-81.4	-121.5	0	0	0	116.7
630	K	31.2	Very low	31.6	Very low	141 Å²	141	130.9 Å²	130.9	61%	0.613	77%	0.771	S	S	*	*			cis	-167.1	176.4	-35.1	-132	-176.1	-163.7	168.3	0	109.5
631	D	34.9	Very low	31.7	Very low	137 Å²	137	134.9 Å²	134.9	73%	0.733	78%	0.775	S	S	*	*			trans	69.3	139.7	162.6	-50.9	-25.2	0	0	0	116.6
632	C	31.5	Very low	31.8	Very low	106 Å²	106	132.3 Å²	132.3	72%	0.716	77%	0.77	S	S	*	*			cis	-151.5	135.6	1.7	-138.7	0	0	0	0	112.3
633	C	31.4	Very low	31.6	Very low	117 Å²	117	132.5 Å²	132.5	79%	0.791	78%	0.776	S	S	*	*			trans	47.8	149.1	150.6	-64.7	0	0	0	0	121.4
634	S	30.8	Very low	31.5	Very low	101 Å²	101	127 Å²	127	71%	0.706	77%	0.772	S	S	*	*			cis	179.8	151	-11.7	54.2	0	0	0	0	106
635	C	31	Very low	31.5	Very low	105 Å²	105	129.4 Å²	129.4	71%	0.709	78%	0.777	S	S	*	*			cis	-153	155.8	32.4	-82.2	0	0	0	0	111.7
636	L	32	Very low	31.6	Very low	141 Å²	141	125.3 Å²	125.3	74%	0.738	77%	0.77	S	S	*	*			trans	45.9	102.8	140.9	-55.3	169.7	0	0	0	118.1
637	E	31.2	Very low	31.5	Very low	175 Å²	175	125 Å²	125	82%	0.818	77%	0.77	S	S	*	*				101.4	118.6	58	-89.4	179	-161.7	0	0	112.6
638	P	32.4	Very low	31.2	Very low	120 Å²	120	124.7 Å²	124.7	78%	0.779	77%	0.768	S	S	*	*			trans	-101.1	153.2	163.3	37.8	-30.4	0	0	0	111.7
639	E	32.3	Very low	30.9	Very low	183 Å²	183	129.2 Å²	129.2	86%	0.855	78%	0.776	S	S	*	*			trans	-169.2	163.8	150.4	-109.2	-48.8	128.2	0	0	111.2
640	A	30.7	Very low	30.8	Very low	70 Å²	70	128.1 Å²	128.1	58%	0.579	78%	0.779	S	S	*	*			trans	54.5	115	160.3	0	0	0	0	0	122.5
641	D	30.3	Very low	30.5	Very low	157 Å²	157	128.4 Å²	128.4	84%	0.84	79%	0.786	S	S	*	*				85	138.9	128.9	-72.4	-24.3	0	0	0	125.7
642	S	33.2	Very low	30.2	Very low	118 Å²	118	126.7 Å²	126.7	83%	0.825	79%	0.791	S	S	*	*			trans	84.8	134.4	159.1	77.9	0	0	0	0	120.1
643	C	26.6	Very low	29.9	Very low	141 Å²	141	128.1 Å²	128.1	95%	0.953	80%	0.796	S	S	*	*			trans	-70.5	139.2	-175.4	-62.9	0	0	0	0	113.5
644	G	29.6	Very low	29.9	Very low	79 Å²	79	131.3 Å²	131.3	81%	0.814	82%	0.819	S	S	*	*			trans	-170.8	81.3	173.5	0	0	0	0	0	114.8
645	S	31.2	Very low	29.8	Very low	123 Å²	123	132.9 Å²	132.9	86%	0.86	83%	0.825	S	S	*	*			trans	-49.9	133.3	178.8	53.4	0	0	0	0	116.2
646	S	31.1	Very low	29.8	Very low	102 Å²	102	134.3 Å²	134.3	71%	0.713	83%	0.831	S	S	*	*				175.2	149.8	113.5	-176.7	0	0	0	0	114.2
647	S	32.3	Very low	29.6	Very low	108 Å²	108	133.9 Å²	133.9	76%	0.755	84%	0.836	S	S	*	*			trans	54.6	86.1	153	45.9	0	0	0	0	118.5
648	S	27.9	Very low	29.5	Very low	125 Å²	125	131.5 Å²	131.5	87%	0.874	84%	0.837	S	S	*	*			trans	-61.1	147.1	165	-45.7	0	0	0	0	113.1
649	L	26.4	Very low	29.4	Very low	156 Å²	156	132.3 Å²	132.3	82%	0.817	84%	0.841	S	S	*	*			trans	-141.9	75.2	170.5	-156.6	170.1	0	0	0	109.2
650	E	28.1	Very low	29.2	Very low	185 Å²	185	128.9 Å²	128.9	86%	0.864	84%	0.84	S	S	*	*			trans	-98.2	128.7	175.8	-77.2	-162.9	126.7	0	0	112.1
651	I	25	Very low	29	Very low	148 Å²	148	133.1 Å²	133.1	76%	0.759	86%	0.859	S	S	*	*			trans	-95	101.2	170.5	-61.9	171.4	0	0	0	107.4	V653	I651-V653 HydrophobicContact CG2-CG2 4.2Å
652	A	29.5	Very low	29	Very low	101 Å²	101	131.2 Å²	131.2	84%	0.835	86%	0.86	S	S	*	*			trans	-96.2	102.4	173	0	0	0	0	0	110.4
653	V	25.8	Very low	28.6	Very low	136 Å²	136	132.3 Å²	132.3	82%	0.824	86%	0.863	S	S	*	*			trans	-84.2	133.3	168.7	178.7	0	0	0	0	109.3	I651	I651-V653 HydrophobicContact CG2-CG2 4.2Å
654	S	29.7	Very low	28.8	Very low	184 Å²	184	131.5 Å²	131.5	100%	1.287	86%	0.855	S	S	*	*			trans	-155.3	0	169.6	179.9	0	0	0	0	111.3

Retrieved 654 of 654 residues in 426.7 ms (Link to these results)

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